smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(Br)c([N+](=O)[O-])cc1CC(=O)[O-]	ZINC000396145898	344846030	/nfs/dbraw/zinc/84/60/30/344846030.db2.gz	VAOIJEFHCJQCTK-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
O=C(N[C@@H]1CCC[C@H]2C[C@H]21)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000592897511	345413331	/nfs/dbraw/zinc/41/33/31/345413331.db2.gz	QZIUMTUEBRPUMS-JMJZKYOTSA-N	-1	0	276.292	2.219	10	5		CEBERM
C[C@@H](CO)CSc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000097458457	185610028	/nfs/dbraw/zinc/61/00/28/185610028.db2.gz	GHGNRCDIXSFMAC-ZETCQYMHSA-N	-1	0	271.294	2.014	10	5		CEBERM
Cc1cc(O[C@@H](C(=O)[O-])C2CC2)ccc1[N+](=O)[O-]	ZINC000088793163	179673203	/nfs/dbraw/zinc/67/32/03/179673203.db2.gz	OJHCUISMECEVDB-LLVKDONJSA-N	-1	0	251.238	2.145	10	5		CEBERM
O=C([O-])c1ccc(NC[C@H]2CCC[C@H]2CO)c([N+](=O)[O-])c1	ZINC000089502211	179805609	/nfs/dbraw/zinc/80/56/09/179805609.db2.gz	QZURTGVZOFMQGQ-MNOVXSKESA-N	-1	0	294.307	2.114	10	5		CEBERM
Cc1cnc(N[C@H]2CCC[C@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000090691729	180024935	/nfs/dbraw/zinc/02/49/35/180024935.db2.gz	CUCGKUYIICECPD-UWVGGRQHSA-N	-1	0	279.296	2.354	10	5		CEBERM
O=C([O-])c1cncc(Oc2cc(F)ccc2[N+](=O)[O-])n1	ZINC000091417375	180149653	/nfs/dbraw/zinc/14/96/53/180149653.db2.gz	ZMBGAAOXLYCLSE-UHFFFAOYSA-N	-1	0	279.183	2.014	10	5		CEBERM
COc1ccc(N[C@H]2C=C[C@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000092183566	180339370	/nfs/dbraw/zinc/33/93/70/180339370.db2.gz	KPCHXVJGASUVAI-IUCAKERBSA-N	-1	0	278.264	2.045	10	5		CEBERM
Cc1ccc(N[C@H]2C=C[C@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000092183790	180340106	/nfs/dbraw/zinc/34/01/06/180340106.db2.gz	ACHWASQBZHTXSU-UWVGGRQHSA-N	-1	0	262.265	2.344	10	5		CEBERM
Cc1ccc(N(CC(=O)[O-])CC(F)(F)F)cc1[N+](=O)[O-]	ZINC000092436850	180385038	/nfs/dbraw/zinc/38/50/38/180385038.db2.gz	QWLMPIPOZJYETB-UHFFFAOYSA-N	-1	0	292.213	2.357	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N(CC(=O)[O-])CC(F)(F)F	ZINC000092436534	180385076	/nfs/dbraw/zinc/38/50/76/180385076.db2.gz	QJBRWOZKUDHTDU-UHFFFAOYSA-N	-1	0	292.213	2.357	10	5		CEBERM
C[C@@H]1CN(c2c(F)c(F)ccc2[N+](=O)[O-])C[C@@H]1C(=O)[O-]	ZINC000111253792	186377888	/nfs/dbraw/zinc/37/78/88/186377888.db2.gz	GZIXYJSEZCQJFX-RQJHMYQMSA-N	-1	0	286.234	2.030	10	5		CEBERM
C[C@@H]1C[C@@H]1CN(C)c1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000111823915	186460221	/nfs/dbraw/zinc/46/02/21/186460221.db2.gz	WJKVKTMMNNVMMW-RKDXNWHRSA-N	-1	0	264.281	2.385	10	5		CEBERM
COc1cc([S-])c(OC(F)F)cc1[N+](=O)[O-]	ZINC000575664200	366322262	/nfs/dbraw/zinc/32/22/62/366322262.db2.gz	DHGHYGOESGSMPM-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
O=C([O-])Cc1c([N+](=O)[O-])ccc(F)c1OC(F)(F)F	ZINC000575710854	366338674	/nfs/dbraw/zinc/33/86/74/366338674.db2.gz	KYCPCYKPNFMDSB-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
CC(=O)c1cc([N+](=O)[O-])c([O-])cc1Br	ZINC000575691243	366329789	/nfs/dbraw/zinc/32/97/89/366329789.db2.gz	LECJZDYSIJJHBU-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CCOC(=O)c1cc([O-])c([N+](=O)[O-])cc1Br	ZINC000575700132	366333976	/nfs/dbraw/zinc/33/39/76/366333976.db2.gz	OJRWWUXOEAPLLG-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
O=C([O-])Cn1c2ccccc2c(=O)c2ccc(F)cc21	ZINC000049452762	304090911	/nfs/dbraw/zinc/09/09/11/304090911.db2.gz	VLWFHZHHLSYYLJ-UHFFFAOYSA-N	-1	0	271.247	2.378	10	5		CEBERM
O=[N+]([O-])c1cc(Cn2cc[nH]c2=S)ccc1[O-]	ZINC000013776314	361442003	/nfs/dbraw/zinc/44/20/03/361442003.db2.gz	BABJGFMBQHGMGQ-UHFFFAOYSA-N	-1	0	251.267	2.208	10	5		CEBERM
CCC[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000233364913	189819745	/nfs/dbraw/zinc/81/97/45/189819745.db2.gz	XFJZVOWHPRMSKU-QMMMGPOBSA-N	-1	0	273.676	2.308	10	5		CEBERM
O=c1ccc(S(=O)(=O)[O-])c2ccc3ccc[nH]c3c12	ZINC000072266226	256702825	/nfs/dbraw/zinc/70/28/25/256702825.db2.gz	AYRRWNVJAZQPTL-UHFFFAOYSA-N	-1	0	275.285	2.340	10	5		CEBERM
O=C([O-])CC1C[C@H]2CC[C@@H](C1)N2c1cc([N+](=O)[O-])ccn1	ZINC000093680215	184705156	/nfs/dbraw/zinc/70/51/56/184705156.db2.gz	XEDVINGJYJIIBA-FGWVZKOKSA-N	-1	0	291.307	2.212	10	5		CEBERM
COc1ccc(C(=O)[O-])cc1Oc1ccncc1[N+](=O)[O-]	ZINC000094067285	184753254	/nfs/dbraw/zinc/75/32/54/184753254.db2.gz	MVQBDWMBLQEPPM-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N1CCSC[C@H]1CC(=O)[O-]	ZINC000091130190	135067011	/nfs/dbraw/zinc/06/70/11/135067011.db2.gz	BJMFBJYASWXALN-LLVKDONJSA-N	-1	0	296.348	2.300	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc([N+](=O)[O-])cn1)c1ccccc1	ZINC000020278770	171132924	/nfs/dbraw/zinc/13/29/24/171132924.db2.gz	YPFXRBFHMRSQKL-GFCCVEGCSA-N	-1	0	273.248	2.228	10	5		CEBERM
O=C([O-])Cn1c(=O)c2ccccc2c2ccccc21	ZINC000025988091	171469699	/nfs/dbraw/zinc/46/96/99/171469699.db2.gz	MWCWZXJYYOFOAS-UHFFFAOYSA-N	-1	0	253.257	2.239	10	5		CEBERM
CC[C@@H](C)N(CC(=O)[O-])c1ccccc1[N+](=O)[O-]	ZINC000037593272	173541965	/nfs/dbraw/zinc/54/19/65/173541965.db2.gz	AINMANQZILMNIX-SECBINFHSA-N	-1	0	252.270	2.284	10	5		CEBERM
NN=c1[n-]cnc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-]	ZINC000040607696	174352976	/nfs/dbraw/zinc/35/29/76/174352976.db2.gz	DTFLUSBUZPKCEH-UHFFFAOYSA-N	-1	0	297.727	2.475	10	5		CEBERM
Cc1nn(-c2cc(F)cc([N+](=O)[O-])c2)c(C)c1CC(=O)[O-]	ZINC000043299261	175000224	/nfs/dbraw/zinc/00/02/24/175000224.db2.gz	GHWKEPXNZNDELK-UHFFFAOYSA-N	-1	0	293.254	2.164	10	5		CEBERM
CC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1[O-])C(C)C	ZINC000228072819	270311953	/nfs/dbraw/zinc/31/19/53/270311953.db2.gz	DGOKIXNHXZQQBV-SNVBAGLBSA-N	-1	0	266.297	2.465	10	5		CEBERM
CC(C)CN(CC(=O)[O-])c1ccccc1[N+](=O)[O-]	ZINC000062742617	519712380	/nfs/dbraw/zinc/71/23/80/519712380.db2.gz	QBXFDRDDTACEMR-UHFFFAOYSA-N	-1	0	252.270	2.142	10	5		CEBERM
CCN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)C(C)(C)C(=O)[O-]	ZINC000061149070	520080208	/nfs/dbraw/zinc/08/02/08/520080208.db2.gz	SQRRSKJTRWDAOG-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)CC(=O)[O-]	ZINC000061178257	520081429	/nfs/dbraw/zinc/08/14/29/520081429.db2.gz	VAQOVFRSDYXMTI-JTQLQIEISA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(c1cc(F)ccc1[N+](=O)[O-])[C@H](C)CC(=O)[O-]	ZINC000061181856	521479611	/nfs/dbraw/zinc/47/96/11/521479611.db2.gz	HRMJHVPWJNIADF-MRVPVSSYSA-N	-1	0	270.260	2.423	10	5		CEBERM
Cc1cccc([N+](=O)[O-])c1C(=O)NC(C)(C)CCC(=O)[O-]	ZINC000050194824	524904117	/nfs/dbraw/zinc/90/41/17/524904117.db2.gz	IXSZMAIUUVYPPM-UHFFFAOYSA-N	-1	0	294.307	2.276	10	5		CEBERM
Cc1c(NC[C@H]2CCOC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000061147388	525870498	/nfs/dbraw/zinc/87/04/98/525870498.db2.gz	BDFOJUAVXOCOOO-SECBINFHSA-N	-1	0	280.280	2.050	10	5		CEBERM
Cc1nc(-c2ccc([N+](=O)[O-])cc2)nc(C)c1C(=O)[O-]	ZINC000054836114	526578991	/nfs/dbraw/zinc/57/89/91/526578991.db2.gz	JUFBBOSDIJYROG-UHFFFAOYSA-N	-1	0	273.248	2.367	10	5		CEBERM
Cc1cc([N-]c2nc3sccn3c2[N+](=O)[O-])nn1C	ZINC000092826106	344204541	/nfs/dbraw/zinc/20/45/41/344204541.db2.gz	BIGDBLXEVLRNSP-UHFFFAOYSA-N	-1	0	278.297	2.090	10	5		CEBERM
Cc1cc(N2CC[C@H](F)C2)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000592969205	345417124	/nfs/dbraw/zinc/41/71/24/345417124.db2.gz	FEFJZSJTWHBXBY-QMMMGPOBSA-N	-1	0	268.244	2.150	10	5		CEBERM
COc1ccc(CC2(C(=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000097147428	185549419	/nfs/dbraw/zinc/54/94/19/185549419.db2.gz	JBBVJDMXGMBQIX-UHFFFAOYSA-N	-1	0	251.238	2.011	10	5		CEBERM
Cc1ccnc(N[C@H]2CCCC[C@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000085329845	179020278	/nfs/dbraw/zinc/02/02/78/179020278.db2.gz	LLWYYQQLKJJVPS-ZJUUUORDSA-N	-1	0	279.296	2.354	10	5		CEBERM
Cc1sc(Nc2ccccc2[N+](=O)[O-])nc1C(=O)[O-]	ZINC000604941606	347435932	/nfs/dbraw/zinc/43/59/32/347435932.db2.gz	WRKPWRASHXBGMB-UHFFFAOYSA-N	-1	0	279.277	2.223	10	5		CEBERM
O=C([O-])[C@@H](Oc1cc([N+](=O)[O-])ccc1Cl)C1CC1	ZINC000088794062	179672999	/nfs/dbraw/zinc/67/29/99/179672999.db2.gz	NSAQBROCDKMORO-JTQLQIEISA-N	-1	0	271.656	2.490	10	5		CEBERM
C[C@@H](Nc1ccncc1[N+](=O)[O-])c1nc(C(=O)[O-])cs1	ZINC000090943280	180068756	/nfs/dbraw/zinc/06/87/56/180068756.db2.gz	HIPVNBNXHSPMRX-ZCFIWIBFSA-N	-1	0	294.292	2.318	10	5		CEBERM
C[C@@H](c1ccc(C(=O)[O-])o1)n1cc(Cl)c([N+](=O)[O-])n1	ZINC000091779956	180252605	/nfs/dbraw/zinc/25/26/05/180252605.db2.gz	OLDOEQCEXUVHIC-YFKPBYRVSA-N	-1	0	285.643	2.345	10	5		CEBERM
CCC[C@@]1(C(=O)[O-])CCN(c2cc(C)c([N+](=O)[O-])cn2)C1	ZINC000092026467	180308422	/nfs/dbraw/zinc/30/84/22/180308422.db2.gz	NPLKZBQUZGYXGS-CQSZACIVSA-N	-1	0	293.323	2.379	10	5		CEBERM
Cc1cc(NC[C@H]2CCC[C@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000092026555	180308818	/nfs/dbraw/zinc/30/88/18/180308818.db2.gz	RRWLYNCOJPIUHO-NXEZZACHSA-N	-1	0	279.296	2.211	10	5		CEBERM
Cc1cc(N[C@H]2CCC[C@H](C(=O)[O-])C2)ncc1[N+](=O)[O-]	ZINC000092026452	180308903	/nfs/dbraw/zinc/30/89/03/180308903.db2.gz	BNQODXONLZIYPE-UWVGGRQHSA-N	-1	0	279.296	2.354	10	5		CEBERM
COc1cc(N[C@@H]2C=C[C@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092183407	180339459	/nfs/dbraw/zinc/33/94/59/180339459.db2.gz	LDKCZDKWPYVTKH-DTWKUNHWSA-N	-1	0	278.264	2.045	10	5		CEBERM
Cc1ccc(N[C@H]2C=C[C@H](C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000092183838	180339996	/nfs/dbraw/zinc/33/99/96/180339996.db2.gz	MYKPGAJPQGFQKC-UWVGGRQHSA-N	-1	0	262.265	2.344	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@H](Nc2cccc(F)c2[N+](=O)[O-])C1	ZINC000092183844	180340153	/nfs/dbraw/zinc/34/01/53/180340153.db2.gz	ZXBUIDVOGCHCHD-SFYZADRCSA-N	-1	0	266.228	2.175	10	5		CEBERM
O=C([O-])CSc1nc(-c2ccc([N+](=O)[O-])cc2)c[nH]1	ZINC000106100905	186101185	/nfs/dbraw/zinc/10/11/85/186101185.db2.gz	PLVXMAWJSBBZCM-UHFFFAOYSA-N	-1	0	279.277	2.162	10	5		CEBERM
Cc1c(N[C@@H]2CCCOC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000109550379	186261972	/nfs/dbraw/zinc/26/19/72/186261972.db2.gz	UYALVBVDIHHWQJ-SNVBAGLBSA-N	-1	0	280.280	2.192	10	5		CEBERM
COc1cc(NC(C)(C)C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000110624870	186306276	/nfs/dbraw/zinc/30/62/76/186306276.db2.gz	QEWHKXANGRSBKE-UHFFFAOYSA-N	-1	0	272.232	2.018	10	5		CEBERM
O=C([O-])c1cc(NC(=O)c2ccc([N+](=O)[O-])s2)ccn1	ZINC000110965707	186337618	/nfs/dbraw/zinc/33/76/18/186337618.db2.gz	HVGYYRILDIEWHQ-UHFFFAOYSA-N	-1	0	293.260	2.002	10	5		CEBERM
CCCOc1cc(N[C@H](C)c2nnn[n-]2)ccc1[N+](=O)[O-]	ZINC000111049040	186347817	/nfs/dbraw/zinc/34/78/17/186347817.db2.gz	RPQLQUVYKUVDNR-MRVPVSSYSA-N	-1	0	292.299	2.070	10	5		CEBERM
Cc1c(=O)n(-c2ccccc2[N+](=O)[O-])[n-]c1C(F)(F)F	ZINC000111308797	186394759	/nfs/dbraw/zinc/39/47/59/186394759.db2.gz	CKKUHLXTXRBVSB-ZCFIWIBFSA-N	-1	0	287.197	2.496	10	5		CEBERM
COc1cc(Oc2cncc(C(=O)[O-])c2)ccc1[N+](=O)[O-]	ZINC000111686057	186441980	/nfs/dbraw/zinc/44/19/80/186441980.db2.gz	JPTBUNWCGBWDAI-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
O=C([O-])c1cccc(CCNc2ncccc2[N+](=O)[O-])c1	ZINC000111404115	186413394	/nfs/dbraw/zinc/41/33/94/186413394.db2.gz	RSEGGNGHXCDOKE-UHFFFAOYSA-N	-1	0	287.275	2.343	10	5		CEBERM
COc1cc(OC(F)F)c([S-])cc1[N+](=O)[O-]	ZINC000575666680	366323820	/nfs/dbraw/zinc/32/38/20/366323820.db2.gz	YLELZIZKALAMFB-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
CCOc1ccc(OC(F)F)c([N+](=O)[O-])c1C(=O)[O-]	ZINC000575656158	366315143	/nfs/dbraw/zinc/31/51/43/366315143.db2.gz	CUGMVDWUSUJTBY-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1cc(OC(F)F)c([N+](=O)[O-])cc1CC(=O)[O-]	ZINC000575658781	366318782	/nfs/dbraw/zinc/31/87/82/366318782.db2.gz	RZZTVZSNYDFWOW-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1c(OC(F)F)ccc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575658955	366318881	/nfs/dbraw/zinc/31/88/81/366318881.db2.gz	KCCHVOQQEYVEKG-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCc1cc(CC(=O)[O-])cc([N+](=O)[O-])c1OC(F)F	ZINC000575659586	366320431	/nfs/dbraw/zinc/32/04/31/366320431.db2.gz	JMMSMCGDVUBPPG-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cc(OC(F)F)c1F	ZINC000575660865	366320830	/nfs/dbraw/zinc/32/08/30/366320830.db2.gz	BKZKTYOCUVIJEU-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(C(F)(F)F)c(Cl)cc1[N+](=O)[O-]	ZINC000575694795	366331265	/nfs/dbraw/zinc/33/12/65/366331265.db2.gz	NWGRJAFBYGFNAK-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOc1cc(CC)c([N+](=O)[O-])cc1CC(=O)[O-]	ZINC000575695482	366331608	/nfs/dbraw/zinc/33/16/08/366331608.db2.gz	IUDAFANVEUJIMV-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
CCOC(=O)c1cc([O-])c([N+](=O)[O-])c(Br)c1	ZINC000575700111	366333668	/nfs/dbraw/zinc/33/36/68/366333668.db2.gz	NWHRSIVKENPNMD-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
O=C([O-])[C@H]1CCCO[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000092862493	184633027	/nfs/dbraw/zinc/63/30/27/184633027.db2.gz	DYWZKTPKWTUURN-WDEREUQCSA-N	-1	0	251.238	2.147	10	5		CEBERM
Cc1nn(C)c(N[C@H]2CCCCC[C@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000094745176	184851535	/nfs/dbraw/zinc/85/15/35/184851535.db2.gz	DISPUWOQJLOVDH-ZJUUUORDSA-N	-1	0	296.327	2.082	10	5		CEBERM
Cc1ccc(N2CCSC[C@H]2CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000091130373	135067251	/nfs/dbraw/zinc/06/72/51/135067251.db2.gz	DLDCMGCXYBEIHA-LLVKDONJSA-N	-1	0	296.348	2.300	10	5		CEBERM
COc1cc(C(=O)[O-])c([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000091366440	394656833	/nfs/dbraw/zinc/65/68/33/394656833.db2.gz	LGDLDYVASKEWAM-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
O=C([O-])c1c[nH]c2c(Cl)cc([N+](=O)[O-])cc2c1=O	ZINC000006188124	170181416	/nfs/dbraw/zinc/18/14/16/170181416.db2.gz	ASCPBNBFFZNVJH-UHFFFAOYSA-N	-1	0	268.612	2.200	10	5		CEBERM
COc1ccc(OCc2ccc(C(=O)[O-])o2)c([N+](=O)[O-])c1	ZINC000008207754	170324293	/nfs/dbraw/zinc/32/42/93/170324293.db2.gz	CKFLSEZWBMQNIG-UHFFFAOYSA-N	-1	0	293.231	2.474	10	5		CEBERM
Cc1cc(-c2nnc(SCC(=O)[O-])o2)ccc1[N+](=O)[O-]	ZINC000020159312	171039997	/nfs/dbraw/zinc/03/99/97/171039997.db2.gz	YMEWNAAPJDTCEM-UHFFFAOYSA-N	-1	0	295.276	2.130	10	5		CEBERM
COCCSc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000035321792	172125074	/nfs/dbraw/zinc/12/50/74/172125074.db2.gz	FKTNJOHKLAXQAE-UHFFFAOYSA-N	-1	0	257.267	2.032	10	5		CEBERM
Cc1nc2cc(N[C@H](C)C(=O)[O-])c([N+](=O)[O-])cc2s1	ZINC000035407098	172178119	/nfs/dbraw/zinc/17/81/19/172178119.db2.gz	IWMSNTZARTYADD-RXMQYKEDSA-N	-1	0	281.293	2.398	10	5		CEBERM
CCOc1ncnc([N-]c2cccc(C)n2)c1[N+](=O)[O-]	ZINC000040584796	174345504	/nfs/dbraw/zinc/34/55/04/174345504.db2.gz	PWZFNPGUHZZVFE-UHFFFAOYSA-N	-1	0	275.268	2.231	10	5		CEBERM
CN(C)c1ncnc([N-]c2ccc(Cl)cn2)c1[N+](=O)[O-]	ZINC000040608422	174353264	/nfs/dbraw/zinc/35/32/64/174353264.db2.gz	YOFHZMQZUZESMU-UHFFFAOYSA-N	-1	0	294.702	2.243	10	5		CEBERM
O=[N+]([O-])c1c([N-]c2nccs2)ncnc1N1CCCC1	ZINC000040609064	174353757	/nfs/dbraw/zinc/35/37/57/174353757.db2.gz	QZLNAGRSLPTKLZ-UHFFFAOYSA-N	-1	0	292.324	2.185	10	5		CEBERM
Cc1cc(Oc2nc[n-]c(=NN)c2[N+](=O)[O-])ccc1Cl	ZINC000040656769	174365231	/nfs/dbraw/zinc/36/52/31/174365231.db2.gz	TYUWUQQSCKCOBJ-UHFFFAOYSA-N	-1	0	295.686	2.425	10	5		CEBERM
COC[C@H](C)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043386745	175032445	/nfs/dbraw/zinc/03/24/45/175032445.db2.gz	GZVYVSYUIMLOLF-ZETCQYMHSA-N	-1	0	268.269	2.048	10	5		CEBERM
Cc1nc(-c2ccccc2[N+](=O)[O-])nc(C)c1CC(=O)[O-]	ZINC000044732082	175240987	/nfs/dbraw/zinc/24/09/87/175240987.db2.gz	YAWWNKZGKUHBAH-UHFFFAOYSA-N	-1	0	287.275	2.296	10	5		CEBERM
CC[C@H](COC)Nc1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000079768748	177553190	/nfs/dbraw/zinc/55/31/90/177553190.db2.gz	PTTPEVVMUCMXST-MRVPVSSYSA-N	-1	0	268.269	2.130	10	5		CEBERM
O=C([O-])c1cccc(Oc2cccc([N+](=O)[O-])c2)n1	ZINC000051041654	260208185	/nfs/dbraw/zinc/20/81/85/260208185.db2.gz	HLAYSECKVVYDGQ-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
Cc1c([N+](=O)[O-])cc(C(=O)[O-])c(Cl)c1[N+](=O)[O-]	ZINC000098177615	301012571	/nfs/dbraw/zinc/01/25/71/301012571.db2.gz	JLOLMCVWQUJAJZ-UHFFFAOYSA-N	-1	0	260.589	2.163	10	5		CEBERM
CC(C)CN(C)c1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070232303	519709443	/nfs/dbraw/zinc/70/94/43/519709443.db2.gz	GZLWZTPMUSBHNE-UHFFFAOYSA-N	-1	0	252.270	2.385	10	5		CEBERM
CCCCOC(=O)COc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000050517628	520712826	/nfs/dbraw/zinc/71/28/26/520712826.db2.gz	XYWGOPVBISARRY-UHFFFAOYSA-N	-1	0	297.263	2.015	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1Oc1cc(C(=O)[O-])ccn1	ZINC000050505026	522985265	/nfs/dbraw/zinc/98/52/65/522985265.db2.gz	GCEOTIGAQGXLLU-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
CN(C[C@@H]1CCCO1)c1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000050031001	523055358	/nfs/dbraw/zinc/05/53/58/523055358.db2.gz	BFMLVANFGMCUMQ-QMMMGPOBSA-N	-1	0	298.270	2.047	10	5		CEBERM
CSCCCNc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000069456128	525483688	/nfs/dbraw/zinc/48/36/88/525483688.db2.gz	HYGFDENHMGIKPX-UHFFFAOYSA-N	-1	0	270.310	2.458	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(C)cc1OC[C@H]1CC[C@@H](C(=O)[O-])O1	ZINC000062997628	525555915	/nfs/dbraw/zinc/55/59/15/525555915.db2.gz	LZGWCAMQLICCLN-PWSUYJOCSA-N	-1	0	295.291	2.223	10	5		CEBERM
O=C([O-])c1cc(-n2ccc(C3CC3)n2)ccc1[N+](=O)[O-]	ZINC000052855722	526342539	/nfs/dbraw/zinc/34/25/39/526342539.db2.gz	LGKDTVMNQCGQDF-UHFFFAOYSA-N	-1	0	273.248	2.356	10	5		CEBERM
O=C([O-])c1ccc(-n2cc([N+](=O)[O-])cn2)c(Cl)c1	ZINC000062796363	526359522	/nfs/dbraw/zinc/35/95/22/526359522.db2.gz	VDERCHNNAPPYCV-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
Cc1nc(-c2cccc([N+](=O)[O-])c2)nc(C)c1C(=O)[O-]	ZINC000054836116	526595562	/nfs/dbraw/zinc/59/55/62/526595562.db2.gz	AXDUFVNGEIJXLJ-UHFFFAOYSA-N	-1	0	273.248	2.367	10	5		CEBERM
Cn1cc(Sc2cc(C(=O)[O-])c([N+](=O)[O-])cc2F)cn1	ZINC000050033302	527293508	/nfs/dbraw/zinc/29/35/08/527293508.db2.gz	AFSMXYIFKIHEOG-UHFFFAOYSA-N	-1	0	297.267	2.317	10	5		CEBERM
COc1cc(N2CCCC[C@@H]2C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000110920409	536826914	/nfs/dbraw/zinc/82/69/14/536826914.db2.gz	CIASUKRPOQPPHI-SECBINFHSA-N	-1	0	298.270	2.186	10	5		CEBERM
Cc1nn(-c2cccc([N+](=O)[O-])c2)c(C)c1CC(=O)[O-]	ZINC000034956946	361800254	/nfs/dbraw/zinc/80/02/54/361800254.db2.gz	IACVWNPUWZRWJL-UHFFFAOYSA-N	-1	0	275.264	2.024	10	5		CEBERM
C[C@H]1CN(c2cc(C(=O)[O-])ccc2[N+](=O)[O-])CCS1	ZINC000137190066	344386945	/nfs/dbraw/zinc/38/69/45/344386945.db2.gz	PFJRSPAUDCNCSS-QMMMGPOBSA-N	-1	0	282.321	2.235	10	5		CEBERM
O=C([O-])c1ccc(F)c(Br)c1[N+](=O)[O-]	ZINC000307341086	344722010	/nfs/dbraw/zinc/72/20/10/344722010.db2.gz	UVIORQCJUZGJKQ-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(Cl)cc([N+](=O)[O-])c1Cl	ZINC000396114938	344845556	/nfs/dbraw/zinc/84/55/56/344845556.db2.gz	GLZXDJLUBGTXLL-SSDOTTSWSA-N	-1	0	266.036	2.020	10	5		CEBERM
Cn1c2ccccc2c2cc(F)ccc2/c(=N\[O-])c1=O	ZINC000584638058	344971386	/nfs/dbraw/zinc/97/13/86/344971386.db2.gz	KBASHSUUBMWQGR-SAPNQHFASA-N	-1	0	270.263	2.121	10	5		CEBERM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000085407989	179055376	/nfs/dbraw/zinc/05/53/76/179055376.db2.gz	BRNLXLIBKTYZCH-UWVGGRQHSA-N	-1	0	296.254	2.029	10	5		CEBERM
Cc1cnc(N[C@@H]2CCC[C@@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000090691730	180024541	/nfs/dbraw/zinc/02/45/41/180024541.db2.gz	CUCGKUYIICECPD-NXEZZACHSA-N	-1	0	279.296	2.354	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCC[C@H](C(=O)[O-])C1	ZINC000091556593	180190792	/nfs/dbraw/zinc/19/07/92/180190792.db2.gz	AQETVORPXARLPS-UWVGGRQHSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCc1nn(C)c(NCCCCCCC(=O)[O-])c1[N+](=O)[O-]	ZINC000091561219	180191846	/nfs/dbraw/zinc/19/18/46/180191846.db2.gz	AVMOAKXISDUZAL-UHFFFAOYSA-N	-1	0	298.343	2.338	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N(CCC(=O)[O-])C(C)C	ZINC000091554378	180189439	/nfs/dbraw/zinc/18/94/39/180189439.db2.gz	XTOOWPNYWGTPAY-UHFFFAOYSA-N	-1	0	298.343	2.199	10	5		CEBERM
COc1cc(N(CCC(=O)[O-])C2CC2)c([N+](=O)[O-])cc1F	ZINC000110624838	186306431	/nfs/dbraw/zinc/30/64/31/186306431.db2.gz	DJRQZGRYSGMILE-UHFFFAOYSA-N	-1	0	298.270	2.186	10	5		CEBERM
COc1cc(Oc2cccnc2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000111053775	186347836	/nfs/dbraw/zinc/34/78/36/186347836.db2.gz	LWGHPQXWYPJJGD-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
C[C@H](C(=O)[O-])N(C)c1ccc([N+](=O)[O-])cc1C(F)F	ZINC000111289593	186391333	/nfs/dbraw/zinc/39/13/33/186391333.db2.gz	QLKHWRNQQGJROU-ZCFIWIBFSA-N	-1	0	274.223	2.442	10	5		CEBERM
Cc1cc(CC(=O)[O-])cc([N+](=O)[O-])c1OC(F)F	ZINC000575668061	366323553	/nfs/dbraw/zinc/32/35/53/366323553.db2.gz	QJYBUYVJYFEWPF-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
Cc1c(OC(F)F)ccc(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575669067	366323641	/nfs/dbraw/zinc/32/36/41/366323641.db2.gz	XWCWEJXBMIBFHH-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(CC(=O)[O-])cc1OC(F)(F)F	ZINC000575673436	366323837	/nfs/dbraw/zinc/32/38/37/366323837.db2.gz	KBRKOCCCGYSEGO-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
CCOc1ccc(C(=O)[O-])c([N+](=O)[O-])c1OC(F)F	ZINC000575657551	366316404	/nfs/dbraw/zinc/31/64/04/366316404.db2.gz	OIZIORPTWZYIEI-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1ccc([N+](=O)[O-])c(C(=O)[O-])c1OC(F)F	ZINC000575658100	366318073	/nfs/dbraw/zinc/31/80/73/366318073.db2.gz	QVVJKZMRUKMDNW-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1ccc(OC(F)F)c(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575657748	366318168	/nfs/dbraw/zinc/31/81/68/366318168.db2.gz	LSLYZHXOPLXFTC-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
O=C([O-])c1cc(F)c(OC(F)F)c([N+](=O)[O-])c1	ZINC000575661668	366320878	/nfs/dbraw/zinc/32/08/78/366320878.db2.gz	SGPLJQFFKSFOFG-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])[C@H](O)c1c(Cl)cc([N+](=O)[O-])cc1C(F)(F)F	ZINC000575694775	366331129	/nfs/dbraw/zinc/33/11/29/366331129.db2.gz	NMXGYTDKIDBMIC-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOc1cc([N+](=O)[O-])c(CC(=O)[O-])cc1CC	ZINC000575697508	366332382	/nfs/dbraw/zinc/33/23/82/366332382.db2.gz	XJWMMJSFCGLHIC-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
CC(C)C[S@](=O)C=C([O-])c1ccc([N+](=O)[O-])cc1	ZINC000081917392	177892410	/nfs/dbraw/zinc/89/24/10/177892410.db2.gz	OVXIRDLEXUHXPM-GOSISDBHSA-N	-1	0	269.322	2.182	10	5		CEBERM
CC[C@@H](CCNc1ccc([N+](=O)[O-])c(N)n1)CCC(=O)[O-]	ZINC000094261003	184771076	/nfs/dbraw/zinc/77/10/76/184771076.db2.gz	ZVWYOXCRXZEKFM-SECBINFHSA-N	-1	0	296.327	2.265	10	5		CEBERM
C[C@@]1(CNc2cc([N+](=O)[O-])ccc2C(=O)[O-])CCCO1	ZINC000094803917	184869184	/nfs/dbraw/zinc/86/91/84/184869184.db2.gz	DDTGOFWYQBEERE-ZDUSSCGKSA-N	-1	0	280.280	2.274	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(N(CC(=O)[O-])C(C)C)c1	ZINC000094659009	184836796	/nfs/dbraw/zinc/83/67/96/184836796.db2.gz	VKAJCJSVQKGEPR-UHFFFAOYSA-N	-1	0	252.270	2.203	10	5		CEBERM
CCC[C@H](Nc1ccc([N+](=O)[O-])c(C(C)=O)c1)C(=O)[O-]	ZINC000263539410	154122340	/nfs/dbraw/zinc/12/23/40/154122340.db2.gz	BQIACXJCBJGSFC-NSHDSACASA-N	-1	0	280.280	2.463	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1OC[C@H]1CCCCO1	ZINC000019276566	170769921	/nfs/dbraw/zinc/76/99/21/170769921.db2.gz	KPSUMMHCMZLEFG-SNVBAGLBSA-N	-1	0	281.264	2.241	10	5		CEBERM
O=C([O-])c1cccnc1Sc1ccc([N+](=O)[O-])cn1	ZINC000019503418	170815750	/nfs/dbraw/zinc/81/57/50/170815750.db2.gz	JPZNCXDFXYBRQD-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
Cc1nn([C@@H](C(=O)[O-])c2ccccc2)c(C)c1[N+](=O)[O-]	ZINC000019869497	170900656	/nfs/dbraw/zinc/90/06/56/170900656.db2.gz	QUFCGPYLVGCCBK-GFCCVEGCSA-N	-1	0	275.264	2.082	10	5		CEBERM
O=C([O-])Cc1nc(-c2ccccc2[N+](=O)[O-])cs1	ZINC000020526033	171238969	/nfs/dbraw/zinc/23/89/69/171238969.db2.gz	POWNQJQFMBYIQZ-UHFFFAOYSA-N	-1	0	264.262	2.345	10	5		CEBERM
CCN(CC(=O)[O-])c1ccc([N+](=O)[O-])cc1Cl	ZINC000038017392	173991180	/nfs/dbraw/zinc/99/11/80/173991180.db2.gz	LVOBLOFRBNERGH-UHFFFAOYSA-N	-1	0	258.661	2.159	10	5		CEBERM
CCCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000043570399	175068015	/nfs/dbraw/zinc/06/80/15/175068015.db2.gz	PMILFYUHPZFSBU-LLVKDONJSA-N	-1	0	298.270	2.107	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)cc1Cl	ZINC000080010067	177594366	/nfs/dbraw/zinc/59/43/66/177594366.db2.gz	ABHCXNOGNOLSOI-UHFFFAOYSA-N	-1	0	281.655	2.441	10	5		CEBERM
Cc1cc(O)c2c(c1)oc1cc(O)cc(C(=O)[O-])c1c2=O	ZINC000013335390	301369682	/nfs/dbraw/zinc/36/96/82/301369682.db2.gz	XSPSQSXYKJASKD-UHFFFAOYSA-N	-1	0	286.239	2.364	10	5		CEBERM
CCO[C@H](CCOc1ccc([N+](=O)[O-])c(C)c1)C(=O)[O-]	ZINC000062763685	520513885	/nfs/dbraw/zinc/51/38/85/520513885.db2.gz	RXMPURQLHZVGNI-GFCCVEGCSA-N	-1	0	283.280	2.162	10	5		CEBERM
CC(C)CN(CC(=O)[O-])c1cc(F)cc([N+](=O)[O-])c1	ZINC000062742576	519712383	/nfs/dbraw/zinc/71/23/83/519712383.db2.gz	DGUMKEJCCOUXFY-UHFFFAOYSA-N	-1	0	270.260	2.281	10	5		CEBERM
CN(c1ccc([N+](=O)[O-])c2cccnc21)C(C)(C)C(=O)[O-]	ZINC000061171199	523642827	/nfs/dbraw/zinc/64/28/27/523642827.db2.gz	IBYUENQENSDYEU-UHFFFAOYSA-N	-1	0	289.291	2.442	10	5		CEBERM
CC[C@@]1(C(=O)[O-])CCN(c2cccc(F)c2[N+](=O)[O-])C1	ZINC000062933644	523704539	/nfs/dbraw/zinc/70/45/39/523704539.db2.gz	WIOXGIPUAAYAII-CYBMUJFWSA-N	-1	0	282.271	2.425	10	5		CEBERM
C[C@]1(C(=O)[O-])CCN(c2cc(F)ccc2[N+](=O)[O-])C1	ZINC000062933101	525231553	/nfs/dbraw/zinc/23/15/53/525231553.db2.gz	PTQCNBPHPPJLGV-LBPRGKRZSA-N	-1	0	268.244	2.035	10	5		CEBERM
Cc1cc(Sc2ccc(C(=O)[O-])cc2[N+](=O)[O-])n(C)n1	ZINC000052308234	525440144	/nfs/dbraw/zinc/44/01/44/525440144.db2.gz	MTWCDGXZZVWPMP-UHFFFAOYSA-N	-1	0	293.304	2.486	10	5		CEBERM
O=C([O-])c1cc(NC2CCC2)c(F)cc1[N+](=O)[O-]	ZINC000052212131	526352849	/nfs/dbraw/zinc/35/28/49/526352849.db2.gz	AWGCTYHSHORVJP-UHFFFAOYSA-N	-1	0	254.217	2.397	10	5		CEBERM
O=C([O-])/C=C/c1ccc([N+](=O)[O-])c(OCC2CC2)c1	ZINC000050518135	527546827	/nfs/dbraw/zinc/54/68/27/527546827.db2.gz	YWUSSICJOGXFCC-GQCTYLIASA-N	-1	0	263.249	2.481	10	5		CEBERM
Cc1nn(C)c(Oc2cc(C(=O)[O-])ccc2C)c1[N+](=O)[O-]	ZINC000048804215	527680372	/nfs/dbraw/zinc/68/03/72/527680372.db2.gz	XBKBARUITPROJE-UHFFFAOYSA-N	-1	0	291.263	2.436	10	5		CEBERM
Cc1nn(C)c(Oc2ccc(C)cc2C(=O)[O-])c1[N+](=O)[O-]	ZINC000048804037	527680522	/nfs/dbraw/zinc/68/05/22/527680522.db2.gz	URITUDKSLCDRBK-UHFFFAOYSA-N	-1	0	291.263	2.436	10	5		CEBERM
Cc1cccc([N+](=O)[O-])c1N1C[C@@H](C)[C@H](C(=O)[O-])C1	ZINC000158624760	344452177	/nfs/dbraw/zinc/45/21/77/344452177.db2.gz	MTYKMSQARRJZDJ-NXEZZACHSA-N	-1	0	264.281	2.060	10	5		CEBERM
O=c1[n-]c(-c2cccc([N+](=O)[O-])c2)ncc1Br	ZINC000090747604	180035385	/nfs/dbraw/zinc/03/53/85/180035385.db2.gz	OUUYBCMLYMXQJR-UHFFFAOYSA-N	-1	0	296.080	2.108	10	5		CEBERM
C[C@@H](CCO)Sc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000091261752	180116079	/nfs/dbraw/zinc/11/60/79/180116079.db2.gz	UWOOIOZOMAGNCU-ZETCQYMHSA-N	-1	0	271.294	2.156	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CC[C@H](C(=O)[O-])C1	ZINC000091555935	180190116	/nfs/dbraw/zinc/19/01/16/180190116.db2.gz	MNUQLUSXQXYTIO-UWVGGRQHSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N(CC)C[C@@H](C)C(=O)[O-]	ZINC000091555375	180190487	/nfs/dbraw/zinc/19/04/87/180190487.db2.gz	LPCPAWBMELIBPE-SECBINFHSA-N	-1	0	298.343	2.057	10	5		CEBERM
CC(C)c1nn(C)c(N[C@@H](C)CCC(=O)[O-])c1[N+](=O)[O-]	ZINC000091583387	180198951	/nfs/dbraw/zinc/19/89/51/180198951.db2.gz	DYGPTJGFDSCLKB-QMMMGPOBSA-N	-1	0	284.316	2.117	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1NC[C@H]1CCC[C@H]1C(=O)[O-]	ZINC000091550257	180188695	/nfs/dbraw/zinc/18/86/95/180188695.db2.gz	GMACKTZCMWFGFC-NXEZZACHSA-N	-1	0	296.327	2.032	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1C(=O)N(CC(=O)[O-])C(C)(C)C	ZINC000092447032	180386324	/nfs/dbraw/zinc/38/63/24/180386324.db2.gz	RPXFQFALBQBECM-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])c1cccc(F)c1[N+](=O)[O-]	ZINC000092448927	180387121	/nfs/dbraw/zinc/38/71/21/180387121.db2.gz	GBDWWRZMGBYVSC-UHFFFAOYSA-N	-1	0	270.260	2.423	10	5		CEBERM
CCCOCCOc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000111106695	186352523	/nfs/dbraw/zinc/35/25/23/186352523.db2.gz	BLZKINRSLKZBIB-UHFFFAOYSA-N	-1	0	269.253	2.098	10	5		CEBERM
O=C([O-])c1cnn(-c2ccc([N+](=O)[O-])cc2)c1Cl	ZINC000132785009	540161909	/nfs/dbraw/zinc/16/19/09/540161909.db2.gz	WSOAQUFEVNUKSW-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
CCOc1c(OC(F)F)cc(CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000575656022	366315621	/nfs/dbraw/zinc/31/56/21/366315621.db2.gz	BPWMUAWYIHVJQO-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1cc(C(=O)[O-])c(OC(F)F)cc1[N+](=O)[O-]	ZINC000575659573	366319915	/nfs/dbraw/zinc/31/99/15/366319915.db2.gz	NMDMEGPHWLCPKP-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCc1cc([N+](=O)[O-])c(OC(F)F)cc1C(=O)[O-]	ZINC000575660565	366320417	/nfs/dbraw/zinc/32/04/17/366320417.db2.gz	YUUAIGZZMFGTCA-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1cc(F)c(OC(F)F)cc1[N+](=O)[O-]	ZINC000575660943	366321141	/nfs/dbraw/zinc/32/11/41/366321141.db2.gz	DQBCAPTUSXIESL-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])c1c(F)ccc(OC(F)(F)F)c1[N+](=O)[O-]	ZINC000575711348	366340113	/nfs/dbraw/zinc/34/01/13/366340113.db2.gz	RVCYKZGORJLGHM-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
CC(=O)c1c([O-])cc([N+](=O)[O-])cc1Br	ZINC000575691145	366330063	/nfs/dbraw/zinc/33/00/63/366330063.db2.gz	IUUXKULQWMDZED-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CC(=O)c1c(Br)cc([O-])cc1[N+](=O)[O-]	ZINC000575692257	366330080	/nfs/dbraw/zinc/33/00/80/366330080.db2.gz	WKIJMCHYEAQIME-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(Cl)cc(C(F)(F)F)c1[N+](=O)[O-]	ZINC000575693570	366331552	/nfs/dbraw/zinc/33/15/52/366331552.db2.gz	BGLANGBLKLHLMW-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc([N+](=O)[O-])c(C(F)(F)F)cc1Cl	ZINC000575694260	366331772	/nfs/dbraw/zinc/33/17/72/366331772.db2.gz	KWTJECBOYKXZMU-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(C(F)(F)F)cc(Cl)c1[N+](=O)[O-]	ZINC000575696598	366332632	/nfs/dbraw/zinc/33/26/32/366332632.db2.gz	XQOHOFFHZTXZOX-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)Cc1cc([O-])c(Cl)cc1[N+](=O)[O-]	ZINC000575701356	366334501	/nfs/dbraw/zinc/33/45/01/366334501.db2.gz	WMGFDLIVEIIGHP-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
CCC[C@H](Nc1cc(OC)c([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000227855236	189788755	/nfs/dbraw/zinc/78/87/55/189788755.db2.gz	GTUSRDIWPIRJFF-QMMMGPOBSA-N	-1	0	286.259	2.408	10	5		CEBERM
CC[C@@](C)(Nc1ccc(F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000094221527	184765047	/nfs/dbraw/zinc/76/50/47/184765047.db2.gz	NHRBDZZRPIKXAV-LLVKDONJSA-N	-1	0	256.233	2.399	10	5		CEBERM
CC[C@@](C)(Nc1cc(F)cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000094221795	184765082	/nfs/dbraw/zinc/76/50/82/184765082.db2.gz	ZZFGFQGWXNFTJP-LLVKDONJSA-N	-1	0	256.233	2.399	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(N2CCC[C@@]2(C)C(=O)[O-])c1	ZINC000094659119	184836560	/nfs/dbraw/zinc/83/65/60/184836560.db2.gz	RBAROFZZUWAOTN-ZDUSSCGKSA-N	-1	0	264.281	2.347	10	5		CEBERM
Cc1cc(N2CCSC[C@@H]2CC(=O)[O-])ccc1[N+](=O)[O-]	ZINC000091130428	135066978	/nfs/dbraw/zinc/06/69/78/135066978.db2.gz	OEFRIRSVEVQKCD-NSHDSACASA-N	-1	0	296.348	2.300	10	5		CEBERM
O=C([O-])CC1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000093680004	135082145	/nfs/dbraw/zinc/08/21/45/135082145.db2.gz	AAODHGPBABNZJU-UHFFFAOYSA-N	-1	0	282.271	2.425	10	5		CEBERM
CCCN(CC(=O)[O-])c1cc([N+](=O)[O-])ccc1C(C)=O	ZINC000263411834	154081435	/nfs/dbraw/zinc/08/14/35/154081435.db2.gz	MQSUZHSEXARABI-UHFFFAOYSA-N	-1	0	280.280	2.098	10	5		CEBERM
O=C([O-])Cc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000006883630	170252965	/nfs/dbraw/zinc/25/29/65/170252965.db2.gz	GPTQNJCREFKEEC-UHFFFAOYSA-N	-1	0	264.262	2.345	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(C)c1C(=O)[O-]	ZINC000019518443	170824453	/nfs/dbraw/zinc/82/44/53/170824453.db2.gz	YGOOBXFBPYHNJT-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1OCc1cscn1	ZINC000021951767	171340169	/nfs/dbraw/zinc/34/01/69/171340169.db2.gz	FRGYIDHLZJUGCW-UHFFFAOYSA-N	-1	0	280.261	2.329	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1OCC(F)(F)F	ZINC000022216858	171375997	/nfs/dbraw/zinc/37/59/97/171375997.db2.gz	OPNWZBDKQMKXHV-UHFFFAOYSA-N	-1	0	265.143	2.234	10	5		CEBERM
Cc1nc2cc(NCC(=O)[O-])c([N+](=O)[O-])cc2s1	ZINC000035342354	172134872	/nfs/dbraw/zinc/13/48/72/172134872.db2.gz	LOWSTVNNIZFJGD-UHFFFAOYSA-N	-1	0	267.266	2.009	10	5		CEBERM
O=C([O-])CCNc1ccc2scnc2c1[N+](=O)[O-]	ZINC000035344165	172136031	/nfs/dbraw/zinc/13/60/31/172136031.db2.gz	UYFGVVXHJRGCLB-UHFFFAOYSA-N	-1	0	267.266	2.091	10	5		CEBERM
CCN(CCC(=O)[O-])c1ccc([N+](=O)[O-])c2ncccc12	ZINC000038023872	174006088	/nfs/dbraw/zinc/00/60/88/174006088.db2.gz	NFCHJIYEJTUEQJ-UHFFFAOYSA-N	-1	0	289.291	2.444	10	5		CEBERM
Cc1ccnc([N-]c2ncnc(Cl)c2[N+](=O)[O-])c1	ZINC000040571151	174338547	/nfs/dbraw/zinc/33/85/47/174338547.db2.gz	NGLSMESERGCBBJ-UHFFFAOYSA-N	-1	0	265.660	2.485	10	5		CEBERM
CNc1ncnc([N-]c2nc(C)c(C)s2)c1[N+](=O)[O-]	ZINC000040595795	174348367	/nfs/dbraw/zinc/34/83/67/174348367.db2.gz	JWPRVOGIKQENOX-UHFFFAOYSA-N	-1	0	280.313	2.243	10	5		CEBERM
O=C([O-])c1ccc(Sc2ncccc2[N+](=O)[O-])nc1	ZINC000041669630	174599618	/nfs/dbraw/zinc/59/96/18/174599618.db2.gz	GBPCBVAJWOSWBI-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
Cc1cc(CNc2ccc([N+](=O)[O-])cc2C(=O)[O-])on1	ZINC000045010875	175289793	/nfs/dbraw/zinc/28/97/93/175289793.db2.gz	AHNKYQLEHOZRKI-UHFFFAOYSA-N	-1	0	277.236	2.202	10	5		CEBERM
Cc1cccc(Oc2cnc(C(=O)[O-])cn2)c1[N+](=O)[O-]	ZINC000071182464	176057600	/nfs/dbraw/zinc/05/76/00/176057600.db2.gz	WOPDOCSNSONIMH-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
C[C@H]1OCCC[C@H]1C(=O)Nc1ccc([O-])c([N+](=O)[O-])c1	ZINC000191275100	300588449	/nfs/dbraw/zinc/58/84/49/300588449.db2.gz	CRULMSXPKHHXSJ-PSASIEDQSA-N	-1	0	280.280	2.054	10	5		CEBERM
CCO[C@H](CSc1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000062765968	520522817	/nfs/dbraw/zinc/52/28/17/520522817.db2.gz	JDQNTRVHATZYSU-SNVBAGLBSA-N	-1	0	271.294	2.177	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1cccc(F)c1[N+](=O)[O-]	ZINC000061217485	521199937	/nfs/dbraw/zinc/19/99/37/521199937.db2.gz	WAGRYOLONRMPIO-MRVPVSSYSA-N	-1	0	270.260	2.281	10	5		CEBERM
CCN(c1cc(F)cc([N+](=O)[O-])c1)C(C)(C)C(=O)[O-]	ZINC000061171383	521479631	/nfs/dbraw/zinc/47/96/31/521479631.db2.gz	JDKBQUBXUACLIE-UHFFFAOYSA-N	-1	0	270.260	2.423	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1O[C@H](C(=O)[O-])C(C)C	ZINC000050504929	522983555	/nfs/dbraw/zinc/98/35/55/522983555.db2.gz	GNJREKKZVOJXOW-NSHDSACASA-N	-1	0	269.253	2.091	10	5		CEBERM
CC[C@@H](Oc1ccc([N+](=O)[O-])c(Cl)c1)C(=O)[O-]	ZINC000050469929	523045104	/nfs/dbraw/zinc/04/51/04/523045104.db2.gz	LEMBXQXVXYNAKP-SECBINFHSA-N	-1	0	259.645	2.490	10	5		CEBERM
C[C@H]1CCCN1c1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000050030590	524122457	/nfs/dbraw/zinc/12/24/57/524122457.db2.gz	SQYPYNPFJZKBRH-ZETCQYMHSA-N	-1	0	268.244	2.421	10	5		CEBERM
Cc1ccc(N2CCC[C@H](C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000061700530	524954941	/nfs/dbraw/zinc/95/49/41/524954941.db2.gz	FOMLUJTWWFHQIU-JTQLQIEISA-N	-1	0	264.281	2.204	10	5		CEBERM
Cc1ccc(N[C@H](C(=O)[O-])C(C)C)cc1[N+](=O)[O-]	ZINC000061700602	525315234	/nfs/dbraw/zinc/31/52/34/525315234.db2.gz	WGECEAISWWQECP-NSHDSACASA-N	-1	0	252.270	2.424	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1O[C@H](C)CCC(=O)[O-]	ZINC000050954785	525472787	/nfs/dbraw/zinc/47/27/87/525472787.db2.gz	CGUNQDGANCMTPU-MRVPVSSYSA-N	-1	0	269.253	2.236	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N[C@H](CC(C)C)C(=O)[O-]	ZINC000052812097	525577727	/nfs/dbraw/zinc/57/77/27/525577727.db2.gz	YDHNBLUGOYUWBV-SNVBAGLBSA-N	-1	0	267.285	2.209	10	5		CEBERM
O=C([O-])/C=C/COc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000051858557	527545004	/nfs/dbraw/zinc/54/50/04/527545004.db2.gz	RUFRQABFWGAWQW-OWOJBTEDSA-N	-1	0	257.629	2.268	10	5		CEBERM
Cc1cccc(N2C[C@H](C(=O)[O-])[C@H](C)C2)c1[N+](=O)[O-]	ZINC000235369908	624715006	/nfs/dbraw/zinc/71/50/06/624715006.db2.gz	KXHVKSBJXLSGNL-ZJUUUORDSA-N	-1	0	264.281	2.060	10	5		CEBERM
O=C(Nc1cc([N+](=O)[O-])ccc1[O-])[C@@H]1C[C@H]2C[C@H]2C1	ZINC000300439144	344700155	/nfs/dbraw/zinc/70/01/55/344700155.db2.gz	GPSUSKVUHXMJRV-AYMMMOKOSA-N	-1	0	262.265	2.285	10	5		CEBERM
Cc1cc(CC(=O)[O-])cc([N+](=O)[O-])c1Br	ZINC000396144976	344845937	/nfs/dbraw/zinc/84/59/37/344845937.db2.gz	RKNAXKOIHJJJSY-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
Cc1c(SC[C@H](C)CO)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000097458443	185609964	/nfs/dbraw/zinc/60/99/64/185609964.db2.gz	JBLQNAYWCYVYQH-SSDOTTSWSA-N	-1	0	285.321	2.322	10	5		CEBERM
C[C@H](CSCc1nc2ccccn2c1[N+](=O)[O-])C(=O)[O-]	ZINC000086108211	179231333	/nfs/dbraw/zinc/23/13/33/179231333.db2.gz	AOSXCHQGQYWSTH-MRVPVSSYSA-N	-1	0	295.320	2.196	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])cn1	ZINC000089382171	179776029	/nfs/dbraw/zinc/77/60/29/179776029.db2.gz	WGCKLRLLBGWASL-GXSJLCMTSA-N	-1	0	279.296	2.293	10	5		CEBERM
O=C([O-])C[C@H]1CCN(c2c(F)c(F)ccc2[N+](=O)[O-])C1	ZINC000089712983	179852062	/nfs/dbraw/zinc/85/20/62/179852062.db2.gz	SNAZDWRHSIHKGA-SSDOTTSWSA-N	-1	0	286.234	2.174	10	5		CEBERM
O=C([O-])c1csc(CCNc2ccc([N+](=O)[O-])cc2)n1	ZINC000090943829	180068558	/nfs/dbraw/zinc/06/85/58/180068558.db2.gz	HIXLCPAJTFWKCN-UHFFFAOYSA-N	-1	0	293.304	2.404	10	5		CEBERM
CCCc1nn(C)c(NC(C)(C)CCC(=O)[O-])c1[N+](=O)[O-]	ZINC000091562426	180192897	/nfs/dbraw/zinc/19/28/97/180192897.db2.gz	URBBAUUJSGQBSF-UHFFFAOYSA-N	-1	0	298.343	2.336	10	5		CEBERM
Cc1ccc(N(CC(=O)[O-])CC(F)(F)F)c([N+](=O)[O-])c1	ZINC000092436805	180384783	/nfs/dbraw/zinc/38/47/83/180384783.db2.gz	BFWYTBLXANKHMS-UHFFFAOYSA-N	-1	0	292.213	2.357	10	5		CEBERM
Cc1cc(N(CC(=O)[O-])CC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000092436498	180385482	/nfs/dbraw/zinc/38/54/82/180385482.db2.gz	FPWPNMNWNYBJCT-UHFFFAOYSA-N	-1	0	292.213	2.357	10	5		CEBERM
CC(C)[C@H](Oc1cc(F)c([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000110622852	186306292	/nfs/dbraw/zinc/30/62/92/186306292.db2.gz	YCSQFIVLKWSOAM-JTQLQIEISA-N	-1	0	275.207	2.361	10	5		CEBERM
CCCOCCOc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000111106714	186352331	/nfs/dbraw/zinc/35/23/31/186352331.db2.gz	KNUBZRJTYSVQBI-UHFFFAOYSA-N	-1	0	283.280	2.407	10	5		CEBERM
O=[N+]([O-])c1cc(Cl)c(Cl)c([S@](=O)[O-])c1	ZINC000675061365	540081878	/nfs/dbraw/zinc/08/18/78/540081878.db2.gz	FPFZWQLJRCMWQO-UHFFFAOYSA-N	-1	0	256.066	2.482	10	5		CEBERM
COc1cc([N+](=O)[O-])c(CC(=O)[O-])c(C(F)(F)F)c1	ZINC000575677575	366324651	/nfs/dbraw/zinc/32/46/51/366324651.db2.gz	ALXYWCWWRCNBIH-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
COc1cc([N+](=O)[O-])cc(C(F)(F)F)c1C(=O)[O-]	ZINC000575675012	366325145	/nfs/dbraw/zinc/32/51/45/366325145.db2.gz	WFWDBTQGDRWQAD-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
COc1cc(C(F)(F)F)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575679237	366326312	/nfs/dbraw/zinc/32/63/12/366326312.db2.gz	PRRMNIKREMHGDZ-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
COc1cc(C(F)(F)F)c(CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000575679562	366326376	/nfs/dbraw/zinc/32/63/76/366326376.db2.gz	XSPKWXXCRBEWSA-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
CCc1ccc(OC(F)F)c(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575659562	366320398	/nfs/dbraw/zinc/32/03/98/366320398.db2.gz	IPTUUCJZLMCART-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=C([O-])c1c(F)cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575708531	366339426	/nfs/dbraw/zinc/33/94/26/366339426.db2.gz	LUUMBHUDFXVDBU-UHFFFAOYSA-N	-1	0	253.107	2.451	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc([N+](=O)[O-])cc(Cl)c1C(F)(F)F	ZINC000575696624	366332613	/nfs/dbraw/zinc/33/26/13/366332613.db2.gz	YCHZYYLJIZNSPS-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)Cc1cc([N+](=O)[O-])cc(Cl)c1[O-]	ZINC000575700010	366333453	/nfs/dbraw/zinc/33/34/53/366333453.db2.gz	GGJUCRMXJADFOG-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
O=C([O-])c1cc(C(=O)N2CCC23CCC3)cc([N+](=O)[O-])c1	ZINC000262440548	304221520	/nfs/dbraw/zinc/22/15/20/304221520.db2.gz	UNQPQXMUWZMFBN-UHFFFAOYSA-N	-1	0	290.275	2.062	10	5		CEBERM
CC[C@@](C)(Nc1cccc(F)c1[N+](=O)[O-])C(=O)[O-]	ZINC000094221491	184765197	/nfs/dbraw/zinc/76/51/97/184765197.db2.gz	IEGXUJOCNIWTGR-LLVKDONJSA-N	-1	0	256.233	2.399	10	5		CEBERM
Cc1c([N+](=O)[O-])cccc1N1CCSC[C@H]1CC(=O)[O-]	ZINC000091130491	135067003	/nfs/dbraw/zinc/06/70/03/135067003.db2.gz	XEIOHCFIRHUYQR-SNVBAGLBSA-N	-1	0	296.348	2.300	10	5		CEBERM
CCCC[C@@H](Nc1ncccc1[N+](=O)[O-])C(=O)[O-]	ZINC000019754036	170854358	/nfs/dbraw/zinc/85/43/58/170854358.db2.gz	JTRYSOPVPRKLIQ-MRVPVSSYSA-N	-1	0	253.258	2.045	10	5		CEBERM
O=C([O-])[C@H]1C[C@H]2CCCC[C@@H]2N1c1ccc([N+](=O)[O-])cn1	ZINC000022162256	171364195	/nfs/dbraw/zinc/36/41/95/171364195.db2.gz	KSQYMMLYEFTJBP-ADEWGFFLSA-N	-1	0	291.307	2.212	10	5		CEBERM
COCCSc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000035321790	172124911	/nfs/dbraw/zinc/12/49/11/172124911.db2.gz	TVZSFOCXYQQOEB-UHFFFAOYSA-N	-1	0	257.267	2.032	10	5		CEBERM
CCN(CCC(=O)[O-])C(=O)Nc1ccc(C)c([N+](=O)[O-])c1	ZINC000040546333	174325143	/nfs/dbraw/zinc/32/51/43/174325143.db2.gz	NLCTZUILMBQTPY-UHFFFAOYSA-N	-1	0	295.295	2.232	10	5		CEBERM
CCc1ccc(Oc2nc[n-]c(=NN)c2[N+](=O)[O-])cc1	ZINC000040656830	174365366	/nfs/dbraw/zinc/36/53/66/174365366.db2.gz	LCKXVCQMHJCORL-UHFFFAOYSA-N	-1	0	275.268	2.025	10	5		CEBERM
CC(C)(Nc1ccc([N+](=O)[O-])c2cnccc12)C(=O)[O-]	ZINC000040911005	174432617	/nfs/dbraw/zinc/43/26/17/174432617.db2.gz	CWTLPBKHMUJPNI-UHFFFAOYSA-N	-1	0	275.264	2.418	10	5		CEBERM
Cc1nn(C)c(N[C@@]2(C(=O)[O-])CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000041035167	174458323	/nfs/dbraw/zinc/45/83/23/174458323.db2.gz	AQMBFSLATGHGOF-SDBXPKJASA-N	-1	0	296.327	2.082	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])c(C)c2)c(C)c1CC(=O)[O-]	ZINC000043299240	175000069	/nfs/dbraw/zinc/00/00/69/175000069.db2.gz	JLLODQUTCHDCFF-UHFFFAOYSA-N	-1	0	289.291	2.333	10	5		CEBERM
Cc1c(OC[C@@H]2CCCO2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386570	175032640	/nfs/dbraw/zinc/03/26/40/175032640.db2.gz	IMHZBVHWJNFSPR-JTQLQIEISA-N	-1	0	281.264	2.159	10	5		CEBERM
O=C([O-])c1ccc(N2CCCCCC2=O)c([N+](=O)[O-])c1	ZINC000071278176	176107731	/nfs/dbraw/zinc/10/77/31/176107731.db2.gz	VJSAARBXODOSNB-UHFFFAOYSA-N	-1	0	278.264	2.200	10	5		CEBERM
O=[N+]([O-])c1cc(-c2n[nH]c(-c3cccc(O)c3)n2)ccc1[O-]	ZINC000072237683	176346534	/nfs/dbraw/zinc/34/65/34/176346534.db2.gz	COCSGGVRQQHGBV-UHFFFAOYSA-N	-1	0	298.258	2.458	10	5		CEBERM
CC(C)Cc1nc(-c2cc([N+](=O)[O-])ccc2[O-])n[nH]1	ZINC000072237767	176346802	/nfs/dbraw/zinc/34/68/02/176346802.db2.gz	BIQGOHYRVWUGDU-UHFFFAOYSA-N	-1	0	262.269	2.284	10	5		CEBERM
Cc1nn(Cc2ccc([N+](=O)[O-])cc2Cl)cc1C(=O)[O-]	ZINC000080044366	177600494	/nfs/dbraw/zinc/60/04/94/177600494.db2.gz	NBRUMPVRKPJKEG-UHFFFAOYSA-N	-1	0	295.682	2.500	10	5		CEBERM
CCN(C(=O)c1cccc([N+](=O)[O-])c1C)[C@@H](C)CC(=O)[O-]	ZINC000061178229	520100790	/nfs/dbraw/zinc/10/07/90/520100790.db2.gz	JOSRQFZQTLGYII-VIFPVBQESA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1c(F)c(F)ccc1[N+](=O)[O-]	ZINC000061217558	521198573	/nfs/dbraw/zinc/19/85/73/521198573.db2.gz	BTVVPYRSTYZGKX-SSDOTTSWSA-N	-1	0	288.250	2.420	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])C(=O)c1cccc([N+](=O)[O-])c1C	ZINC000061215060	521198741	/nfs/dbraw/zinc/19/87/41/521198741.db2.gz	VHCHLNOYLNJXKL-SECBINFHSA-N	-1	0	294.307	2.086	10	5		CEBERM
CCN(c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](C)CC(=O)[O-]	ZINC000061181778	521493255	/nfs/dbraw/zinc/49/32/55/521493255.db2.gz	HEKOLPULNWDJGO-MRVPVSSYSA-N	-1	0	297.267	2.193	10	5		CEBERM
CCN(c1cccc([N+](=O)[O-])c1)C(C)(C)C(=O)[O-]	ZINC000061171469	521497006	/nfs/dbraw/zinc/49/70/06/521497006.db2.gz	VKIDIXGZZSSOQI-UHFFFAOYSA-N	-1	0	252.270	2.284	10	5		CEBERM
COc1ccc(CC(C)(C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000054631487	523913730	/nfs/dbraw/zinc/91/37/30/523913730.db2.gz	JNPSFKINEGHWTF-UHFFFAOYSA-N	-1	0	253.254	2.257	10	5		CEBERM
Cc1cc(C)c(OC[C@H]2CC[C@@H](C(=O)[O-])O2)c([N+](=O)[O-])c1	ZINC000051393958	524311066	/nfs/dbraw/zinc/31/10/66/524311066.db2.gz	CEBNUZQHNALIME-PWSUYJOCSA-N	-1	0	295.291	2.223	10	5		CEBERM
O=C([O-])[C@H](Nc1c(F)c(F)ccc1[N+](=O)[O-])C1CC1	ZINC000054505926	526313671	/nfs/dbraw/zinc/31/36/71/526313671.db2.gz	FEGUQDWPPBZGMJ-SECBINFHSA-N	-1	0	272.207	2.148	10	5		CEBERM
O=C([O-])[C@H]1CC[C@H](CSc2ccc([N+](=O)[O-])cc2)O1	ZINC000051394196	526330586	/nfs/dbraw/zinc/33/05/86/526330586.db2.gz	YXTRNMFDTUHAIZ-MWLCHTKSSA-N	-1	0	283.305	2.319	10	5		CEBERM
O=C([O-])c1c(Cl)cccc1-n1cnc([N+](=O)[O-])c1	ZINC000054552447	526339713	/nfs/dbraw/zinc/33/97/13/526339713.db2.gz	SUMUAXITFIFWHY-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
O=C([O-])c1ccc(Cl)cc1-n1cnc([N+](=O)[O-])c1	ZINC000062787692	526369781	/nfs/dbraw/zinc/36/97/81/526369781.db2.gz	MPBWBJLSZUGJGE-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
O=C([O-])CC[C@@H]1CCCCN1c1ccc([N+](=O)[O-])nc1	ZINC000050923875	527596463	/nfs/dbraw/zinc/59/64/63/527596463.db2.gz	OTCDQFBASJXWEP-JTQLQIEISA-N	-1	0	279.296	2.214	10	5		CEBERM
CC[C@H]1OCC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000234103323	623159039	/nfs/dbraw/zinc/15/90/39/623159039.db2.gz	HQPPSDLCSSCDFB-JOYOIKCWSA-N	-1	0	280.280	2.054	10	5		CEBERM
CC(C)(CC(=O)[O-])NC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000084155950	178805980	/nfs/dbraw/zinc/80/59/80/178805980.db2.gz	QMLCRNKJJXIWQY-UHFFFAOYSA-N	-1	0	299.258	2.109	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H]1Nc1cc(F)ccc1[N+](=O)[O-]	ZINC000085329483	179019684	/nfs/dbraw/zinc/01/96/84/179019684.db2.gz	XFYCJXDIMWDFMQ-DTWKUNHWSA-N	-1	0	268.244	2.399	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1F	ZINC000085329544	179019731	/nfs/dbraw/zinc/01/97/31/179019731.db2.gz	NSVIQKJECBVHJZ-WCBMZHEXSA-N	-1	0	268.244	2.399	10	5		CEBERM
CC1(C)[C@H](C(=O)Nc2ccc(F)cc2[N+](=O)[O-])[C@@H]1C(=O)[O-]	ZINC000085407816	179055536	/nfs/dbraw/zinc/05/55/36/179055536.db2.gz	JSERXHKNMFZOAQ-VHSXEESVSA-N	-1	0	296.254	2.029	10	5		CEBERM
CC[C@@H](Sc1c([N+](=O)[O-])c(C(C)C)nn1C)C(=O)[O-]	ZINC000097824134	185671840	/nfs/dbraw/zinc/67/18/40/185671840.db2.gz	KIEMYCUCOZOIQK-SSDOTTSWSA-N	-1	0	287.341	2.407	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCC[C@H]1O	ZINC000086016922	179216567	/nfs/dbraw/zinc/21/65/67/179216567.db2.gz	STTXLGDYXIENMN-TVQRCGJNSA-N	-1	0	294.307	2.256	10	5		CEBERM
Cc1c(O[C@@H](C(=O)[O-])C2CC2)cccc1[N+](=O)[O-]	ZINC000088793733	179673069	/nfs/dbraw/zinc/67/30/69/179673069.db2.gz	DBSKMMGSYAPKOA-LLVKDONJSA-N	-1	0	251.238	2.145	10	5		CEBERM
COc1cc(N[C@@H](C(=O)[O-])C(C)C)ccc1[N+](=O)[O-]	ZINC000104246489	185941963	/nfs/dbraw/zinc/94/19/63/185941963.db2.gz	JWXRTIHSYRVJNO-LLVKDONJSA-N	-1	0	268.269	2.125	10	5		CEBERM
C[C@@H](CCO)Sc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000091261744	180115782	/nfs/dbraw/zinc/11/57/82/180115782.db2.gz	WATIDPTXPMGFJX-ZETCQYMHSA-N	-1	0	271.294	2.156	10	5		CEBERM
CCc1nn(C)c(Oc2ccc(C(=O)[O-])cc2)c1[N+](=O)[O-]	ZINC000091559633	180191195	/nfs/dbraw/zinc/19/11/95/180191195.db2.gz	VETQLBMVBZBRPX-UHFFFAOYSA-N	-1	0	291.263	2.381	10	5		CEBERM
Cc1cc(NC2(C(=O)[O-])CCCC2)ncc1[N+](=O)[O-]	ZINC000092026377	180308859	/nfs/dbraw/zinc/30/88/59/180308859.db2.gz	LDRSLZOGNYACAE-UHFFFAOYSA-N	-1	0	265.269	2.108	10	5		CEBERM
CCOc1cc(N[C@@H]2C=C[C@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092182944	180339583	/nfs/dbraw/zinc/33/95/83/180339583.db2.gz	RTQMLHXVXZYJRS-VHSXEESVSA-N	-1	0	292.291	2.435	10	5		CEBERM
O=C([O-])CN(CC(F)(F)F)c1cc(F)cc([N+](=O)[O-])c1	ZINC000092436740	180385227	/nfs/dbraw/zinc/38/52/27/180385227.db2.gz	AWMMPESPADGFPS-UHFFFAOYSA-N	-1	0	296.176	2.187	10	5		CEBERM
Cc1ccc(C(=O)N(CC(=O)[O-])C(C)(C)C)cc1[N+](=O)[O-]	ZINC000092447955	180386986	/nfs/dbraw/zinc/38/69/86/180386986.db2.gz	RRHKGXHTDSYEMP-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
O=C([O-])c1cc(-n2cc([N+](=O)[O-])cn2)c2ccccc2n1	ZINC000109586651	186263465	/nfs/dbraw/zinc/26/34/65/186263465.db2.gz	LECIMFAQLGRUKU-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
O=C([O-])/C=C(\Br)c1ccc([N+](=O)[O-])cc1	ZINC000000158062	304023421	/nfs/dbraw/zinc/02/34/21/304023421.db2.gz	XKZDUCREGROOCM-YVMONPNESA-N	-1	0	272.054	2.415	10	5		CEBERM
CCOc1cc([N+](=O)[O-])cc(C(=O)[O-])c1OC(F)F	ZINC000575657510	366316663	/nfs/dbraw/zinc/31/66/63/366316663.db2.gz	NYGRUHKIYALJEC-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1ccc(CC(=O)[O-])c(OC(F)F)c1[N+](=O)[O-]	ZINC000575657857	366317878	/nfs/dbraw/zinc/31/78/78/366317878.db2.gz	MOZADXSLQTUJMD-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1cc([N+](=O)[O-])cc(OC(F)F)c1CC(=O)[O-]	ZINC000575660133	366320311	/nfs/dbraw/zinc/32/03/11/366320311.db2.gz	NDOZKIWJNIZEDC-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=C([O-])Cc1ccc(F)c([N+](=O)[O-])c1C(F)(F)F	ZINC000575711289	366340083	/nfs/dbraw/zinc/34/00/83/366340083.db2.gz	QIEINCDUCDIRPB-UHFFFAOYSA-N	-1	0	267.134	2.380	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(C(F)(F)F)c(Cl)cc1[N+](=O)[O-]	ZINC000575694797	366331270	/nfs/dbraw/zinc/33/12/70/366331270.db2.gz	NWGRJAFBYGFNAK-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
O=C([O-])[C@@H](O)c1c(Cl)cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575696608	366332568	/nfs/dbraw/zinc/33/25/68/366332568.db2.gz	XRSVVYALLUFOJV-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
O=C([O-])[C@H]1CS[C@H](c2cc([N+](=O)[O-])ccc2Cl)N1	ZINC000017724496	304202318	/nfs/dbraw/zinc/20/23/18/304202318.db2.gz	OGIOOLRVHUYVLO-RKDXNWHRSA-N	-1	0	288.712	2.036	10	5		CEBERM
O=C([O-])[C@@]1(Cc2cc(Cl)ccc2[N+](=O)[O-])CCOC1	ZINC000093633603	184699777	/nfs/dbraw/zinc/69/97/77/184699777.db2.gz	GTIAELHPVDDLIM-GFCCVEGCSA-N	-1	0	285.683	2.282	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000005584085	170116263	/nfs/dbraw/zinc/11/62/63/170116263.db2.gz	LKPLYMRJMSBEIO-UWVGGRQHSA-N	-1	0	292.291	2.424	10	5		CEBERM
CC(C)[C@@H](Oc1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000037064742	172927791	/nfs/dbraw/zinc/92/77/91/172927791.db2.gz	ZBNITYQXSMBTSW-SNVBAGLBSA-N	-1	0	257.217	2.222	10	5		CEBERM
CCN(CCC(=O)[O-])c1ccc([N+](=O)[O-])cc1C	ZINC000038024081	174006471	/nfs/dbraw/zinc/00/64/71/174006471.db2.gz	OXHFHYJPUPBJFJ-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
COc1ccc(Nc2ncccc2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000040384918	174251484	/nfs/dbraw/zinc/25/14/84/174251484.db2.gz	YELAIHFKFXNYLQ-UHFFFAOYSA-N	-1	0	289.247	2.440	10	5		CEBERM
CCC[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1F)C(=O)[O-]	ZINC000040574485	174340260	/nfs/dbraw/zinc/34/02/60/174340260.db2.gz	ZPNNLCXJPAZHJJ-SECBINFHSA-N	-1	0	299.258	2.109	10	5		CEBERM
CN(C)c1ncnc([N-]c2cccnc2Cl)c1[N+](=O)[O-]	ZINC000040608646	174353398	/nfs/dbraw/zinc/35/33/98/174353398.db2.gz	VQAQWLPQABFKCY-UHFFFAOYSA-N	-1	0	294.702	2.243	10	5		CEBERM
CCOC(=O)CSc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043387293	175032461	/nfs/dbraw/zinc/03/24/61/175032461.db2.gz	GJRWOCGANLFLGU-UHFFFAOYSA-N	-1	0	299.304	2.257	10	5		CEBERM
COCCN(c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C)C1CC1	ZINC000043387137	175032713	/nfs/dbraw/zinc/03/27/13/175032713.db2.gz	GDKOOUCOZMLIJU-UHFFFAOYSA-N	-1	0	294.307	2.217	10	5		CEBERM
CC(C)Cc1nc(C(=O)[O-])nn1-c1ccccc1[N+](=O)[O-]	ZINC000536959873	419416651	/nfs/dbraw/zinc/41/66/51/419416651.db2.gz	QTFJZXFFEUIGNM-UHFFFAOYSA-N	-1	0	290.279	2.072	10	5		CEBERM
CC(C)[C@@H](Nc1c(F)c(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000053162465	519799826	/nfs/dbraw/zinc/79/98/26/519799826.db2.gz	WTFINLMQMXTBRX-SECBINFHSA-N	-1	0	274.223	2.394	10	5		CEBERM
CCN(C(=O)c1cccc([N+](=O)[O-])c1C)C(C)(C)C(=O)[O-]	ZINC000061149060	520102352	/nfs/dbraw/zinc/10/23/52/520102352.db2.gz	OAAPUODQLNSHAZ-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCO[C@@H](CSc1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000062766002	520315050	/nfs/dbraw/zinc/31/50/50/520315050.db2.gz	OBAGUCGHCZJQEN-VIFPVBQESA-N	-1	0	271.294	2.177	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])C(=O)c1cccc(C)c1[N+](=O)[O-]	ZINC000061215085	521245645	/nfs/dbraw/zinc/24/56/45/521245645.db2.gz	HDRAWXPLXSLSLV-JTQLQIEISA-N	-1	0	294.307	2.086	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1cccc([N+](=O)[O-])c1C	ZINC000062723597	521248109	/nfs/dbraw/zinc/24/81/09/521248109.db2.gz	SGJWSLSTDTYNCR-VIFPVBQESA-N	-1	0	266.297	2.450	10	5		CEBERM
CCC[C@]1(C(=O)[O-])CCCN(c2ccncc2[N+](=O)[O-])C1	ZINC000062875396	521301934	/nfs/dbraw/zinc/30/19/34/521301934.db2.gz	BKZHZYUMXLPIAV-AWEZNQCLSA-N	-1	0	293.323	2.461	10	5		CEBERM
CCN(c1cccc([N+](=O)[O-])c1)[C@@H](C)CC(=O)[O-]	ZINC000061182023	521497116	/nfs/dbraw/zinc/49/71/16/521497116.db2.gz	OQDSAWOGCBRKSH-VIFPVBQESA-N	-1	0	252.270	2.284	10	5		CEBERM
Cc1ccc(N(CC(=O)[O-])C(C)C)cc1[N+](=O)[O-]	ZINC000061700567	524895928	/nfs/dbraw/zinc/89/59/28/524895928.db2.gz	OBNIKCJCXFGJFE-UHFFFAOYSA-N	-1	0	252.270	2.203	10	5		CEBERM
CSCCCNc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000069456134	525484516	/nfs/dbraw/zinc/48/45/16/525484516.db2.gz	PVZCLZJFWQCAPL-UHFFFAOYSA-N	-1	0	270.310	2.458	10	5		CEBERM
Cc1c(CC2(C(=O)[O-])CCOCC2)cccc1[N+](=O)[O-]	ZINC000061674721	525695015	/nfs/dbraw/zinc/69/50/15/525695015.db2.gz	FHLAERLNKUANTF-UHFFFAOYSA-N	-1	0	279.292	2.327	10	5		CEBERM
C[C@@H](Nc1cc([N+](=O)[O-])ccc1C(=O)[O-])[C@H]1CCCO1	ZINC000070232346	525699762	/nfs/dbraw/zinc/69/97/62/525699762.db2.gz	HWCUJGZUEXQEDW-PRHODGIISA-N	-1	0	280.280	2.272	10	5		CEBERM
O=C([O-])c1cnn(-c2ccc([N+](=O)[O-])cc2)c1C(F)F	ZINC000061630035	526405156	/nfs/dbraw/zinc/40/51/56/526405156.db2.gz	RXXVINQUZFBUTP-UHFFFAOYSA-N	-1	0	283.190	2.416	10	5		CEBERM
O=C([O-])CCC1CCN(c2cc([N+](=O)[O-])ccn2)CC1	ZINC000050924083	527574811	/nfs/dbraw/zinc/57/48/11/527574811.db2.gz	HBYMGLCBAZQPAP-UHFFFAOYSA-N	-1	0	279.296	2.071	10	5		CEBERM
O=C([O-])c1cnc(NCc2ccccc2)c([N+](=O)[O-])c1	ZINC000082578361	178118305	/nfs/dbraw/zinc/11/83/05/178118305.db2.gz	LNEPOAPSZXDJRL-UHFFFAOYSA-N	-1	0	273.248	2.300	10	5		CEBERM
O=C([O-])[C@H](F)c1ccc(Br)cc1[N+](=O)[O-]	ZINC000584625514	344968291	/nfs/dbraw/zinc/96/82/91/344968291.db2.gz	ZYJFVYBDVURTPZ-SSDOTTSWSA-N	-1	0	278.033	2.453	10	5		CEBERM
Cc1cc(N[C@@H]2CCO[C@H]2C)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000592973982	345417773	/nfs/dbraw/zinc/41/77/73/345417773.db2.gz	QMFRITJVUMDKLG-WCBMZHEXSA-N	-1	0	280.280	2.191	10	5		CEBERM
Cc1ccnc(N[C@@H]2CCCC[C@@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000085329840	179020221	/nfs/dbraw/zinc/02/02/21/179020221.db2.gz	LLWYYQQLKJJVPS-VHSXEESVSA-N	-1	0	279.296	2.354	10	5		CEBERM
COc1cc(SC[C@@H](C)C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000086111183	179233066	/nfs/dbraw/zinc/23/30/66/179233066.db2.gz	IIGAVJMTIZXJOD-SSDOTTSWSA-N	-1	0	271.294	2.416	10	5		CEBERM
CCCC[C@H](Nc1c([N+](=O)[O-])c(C)nn1CC)C(=O)[O-]	ZINC000091557537	180190765	/nfs/dbraw/zinc/19/07/65/180190765.db2.gz	ZRHVTRJLRQXOTE-VIFPVBQESA-N	-1	0	284.316	2.175	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@H](Nc2ccc([N+](=O)[O-])cc2F)C1	ZINC000092182875	180339292	/nfs/dbraw/zinc/33/92/92/180339292.db2.gz	SQEKGFOQJLYGOC-YUMQZZPRSA-N	-1	0	266.228	2.175	10	5		CEBERM
Cc1cc(CC(=O)[O-])c(OC(F)F)cc1[N+](=O)[O-]	ZINC000575669121	366323843	/nfs/dbraw/zinc/32/38/43/366323843.db2.gz	YQFWRLKOACFPDU-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
Cc1cc([C@@H](O)C(=O)[O-])c([N+](=O)[O-])cc1C(F)(F)F	ZINC000575676050	366325028	/nfs/dbraw/zinc/32/50/28/366325028.db2.gz	ZGOWLHYBAZPFSU-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
Cc1cc(CC(=O)[O-])c(OC(F)(F)F)c([N+](=O)[O-])c1	ZINC000575675600	366325153	/nfs/dbraw/zinc/32/51/53/366325153.db2.gz	WMFPFLYPBOCKIS-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
CCOc1cc(OC(F)F)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575656756	366316742	/nfs/dbraw/zinc/31/67/42/366316742.db2.gz	JWFHDIKWBMBLSD-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCc1c(OC(F)F)cc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000575658710	366319076	/nfs/dbraw/zinc/31/90/76/366319076.db2.gz	HTEBFAOQRHSXOK-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])Cc1cc([N+](=O)[O-])c(F)cc1OC(F)(F)F	ZINC000575709917	366338803	/nfs/dbraw/zinc/33/88/03/366338803.db2.gz	COGZFBHENBBAMS-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(Cl)cc(C(F)(F)F)c1[N+](=O)[O-]	ZINC000575693565	366330949	/nfs/dbraw/zinc/33/09/49/366330949.db2.gz	BGLANGBLKLHLMW-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCCCS(=O)(=O)c1nc2c(cccc2[N+](=O)[O-])[n-]1	ZINC000089195079	363947282	/nfs/dbraw/zinc/94/72/82/363947282.db2.gz	UZVNLYAZXTZTCB-UHFFFAOYSA-N	-1	0	283.309	2.045	10	5		CEBERM
CC[C@H](NC(=O)C(F)F)c1cccc([N+](=O)[O-])c1	ZINC000194726550	370068361	/nfs/dbraw/zinc/06/83/61/370068361.db2.gz	LYIMWJSTLJGSIG-VIFPVBQESA-N	-1	0	258.224	2.427	10	5		CEBERM
C[C@@H](C(=O)[O-])[C@@H](C)C(=O)c1ccccc1[N+](=O)[O-]	ZINC000093040924	184644943	/nfs/dbraw/zinc/64/49/43/184644943.db2.gz	TZZZDZQOTLWZQQ-HTQZYQBOSA-N	-1	0	251.238	2.134	10	5		CEBERM
O=C([O-])C[C@@H]1CCCCN1c1cccc([N+](=O)[O-])c1	ZINC000038027161	134852232	/nfs/dbraw/zinc/85/22/32/134852232.db2.gz	TYYUORLIJCNFSS-NSHDSACASA-N	-1	0	264.281	2.428	10	5		CEBERM
O=C([O-])CC1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000093679989	135082003	/nfs/dbraw/zinc/08/20/03/135082003.db2.gz	CKEJGEXDWZOHKN-UHFFFAOYSA-N	-1	0	282.271	2.425	10	5		CEBERM
O=C([O-])[C@H]1C[C@H]2CCCC[C@@H]2N1c1ccc([N+](=O)[O-])nc1	ZINC000019868379	170900271	/nfs/dbraw/zinc/90/02/71/170900271.db2.gz	AMEFCMDXBROEBQ-ADEWGFFLSA-N	-1	0	291.307	2.212	10	5		CEBERM
Cc1nn(-c2ccccc2[N+](=O)[O-])c(Cl)c1C(=O)[O-]	ZINC000037326903	173127879	/nfs/dbraw/zinc/12/78/79/173127879.db2.gz	WPORECFTMXEVJB-UHFFFAOYSA-N	-1	0	281.655	2.441	10	5		CEBERM
COc1ccc(N[C@H](C(=O)[O-])C(C)C)c([N+](=O)[O-])c1	ZINC000037453291	173219154	/nfs/dbraw/zinc/21/91/54/173219154.db2.gz	XXUJUBQKQOEHTG-NSHDSACASA-N	-1	0	268.269	2.125	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1Nc1ncccc1C(=O)[O-]	ZINC000040384915	174251643	/nfs/dbraw/zinc/25/16/43/174251643.db2.gz	UCKIUSHZWWDDMY-UHFFFAOYSA-N	-1	0	289.247	2.440	10	5		CEBERM
CCN(c1ccc([N+](=O)[O-])c(C(=O)[O-])c1)[C@@H](C)COC	ZINC000042781492	174877370	/nfs/dbraw/zinc/87/73/70/174877370.db2.gz	NWFGLCGJLZBLML-VIFPVBQESA-N	-1	0	282.296	2.154	10	5		CEBERM
COc1ccc(-n2nc(C)c(C(=O)[O-])c2C)c([N+](=O)[O-])c1	ZINC000043299302	175000157	/nfs/dbraw/zinc/00/01/57/175000157.db2.gz	ITDBTCZIJSQGEZ-UHFFFAOYSA-N	-1	0	291.263	2.104	10	5		CEBERM
O=C([O-])c1ncoc1-c1cc(F)ccc1[N+](=O)[O-]	ZINC000043304694	175003369	/nfs/dbraw/zinc/00/33/69/175003369.db2.gz	BUKFAFGHGISUGA-UHFFFAOYSA-N	-1	0	252.157	2.087	10	5		CEBERM
COCCCNc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043386849	175032605	/nfs/dbraw/zinc/03/26/05/175032605.db2.gz	MSXSERGZPUAWSX-UHFFFAOYSA-N	-1	0	268.269	2.050	10	5		CEBERM
O=C([O-])[C@H]1CC[C@H](Cn2ccc3c2cccc3[N+](=O)[O-])O1	ZINC000071163704	176047163	/nfs/dbraw/zinc/04/71/63/176047163.db2.gz	WIQBDWBLDXJTMJ-NOZJJQNGSA-N	-1	0	290.275	2.182	10	5		CEBERM
C/C(C(=O)[O-])=C(\C)C(=O)Nc1ccc(F)cc1[N+](=O)[O-]	ZINC000071164578	176047603	/nfs/dbraw/zinc/04/76/03/176047603.db2.gz	ZQROWENYMMJADZ-SREVYHEPSA-N	-1	0	282.227	2.093	10	5		CEBERM
CCCCC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000060959646	519915104	/nfs/dbraw/zinc/91/51/04/519915104.db2.gz	BMDMFNZYRVCLQA-UHFFFAOYSA-N	-1	0	266.253	2.422	10	5		CEBERM
CCN(CC)c1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000050019547	520876293	/nfs/dbraw/zinc/87/62/93/520876293.db2.gz	NXHYHVMYMHVUFB-UHFFFAOYSA-N	-1	0	256.233	2.278	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])C(=O)c1cccc(C)c1[N+](=O)[O-]	ZINC000061215084	521197363	/nfs/dbraw/zinc/19/73/63/521197363.db2.gz	HDRAWXPLXSLSLV-SNVBAGLBSA-N	-1	0	294.307	2.086	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000061217497	521200297	/nfs/dbraw/zinc/20/02/97/521200297.db2.gz	HODLXEQLBCDPHD-MRVPVSSYSA-N	-1	0	297.267	2.050	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1Oc1ccc(C(=O)[O-])cn1	ZINC000050505029	522985115	/nfs/dbraw/zinc/98/51/15/522985115.db2.gz	CDSHITKCBJZSDW-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
C[C@@H](CCC(=O)[O-])Oc1ccc([N+](=O)[O-])c(F)c1	ZINC000050955538	524442564	/nfs/dbraw/zinc/44/25/64/524442564.db2.gz	JSSCODKIBPLUSS-ZETCQYMHSA-N	-1	0	257.217	2.366	10	5		CEBERM
Cc1c([N+](=O)[O-])cccc1N1CCC[C@@H](C(=O)[O-])C1	ZINC000062723398	525930108	/nfs/dbraw/zinc/93/01/08/525930108.db2.gz	CJESLUZFGQTVHI-SNVBAGLBSA-N	-1	0	264.281	2.204	10	5		CEBERM
O=C([O-])c1ccc(-c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)o1	ZINC000051041464	526357507	/nfs/dbraw/zinc/35/75/07/526357507.db2.gz	QLAODOIANGKXAD-UHFFFAOYSA-N	-1	0	278.176	2.461	10	5		CEBERM
O=C([O-])C[C@@H](Oc1ccccc1[N+](=O)[O-])C(F)(F)F	ZINC000062763583	527626376	/nfs/dbraw/zinc/62/63/76/527626376.db2.gz	XIDVQKLBQZSIFP-MRVPVSSYSA-N	-1	0	279.170	2.379	10	5		CEBERM
CCC[C@@H]1C[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000155588739	527829419	/nfs/dbraw/zinc/82/94/19/527829419.db2.gz	BTFNDGKBLSHBSK-SCZZXKLOSA-N	-1	0	264.281	2.219	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N1C[C@@H](C)[C@H](C(=O)[O-])C1	ZINC000113394649	644371931	/nfs/dbraw/zinc/37/19/31/644371931.db2.gz	RLMHLZHWXQNWPR-MWLCHTKSSA-N	-1	0	264.281	2.060	10	5		CEBERM
O=C([O-])c1ccc(Br)c(F)c1[N+](=O)[O-]	ZINC000307668554	344723844	/nfs/dbraw/zinc/72/38/44/344723844.db2.gz	KKEMUOWWDKIXHM-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
Cc1c(Br)c(CC(=O)[O-])ccc1[N+](=O)[O-]	ZINC000396139714	344846089	/nfs/dbraw/zinc/84/60/89/344846089.db2.gz	VSGLTTVSSBSDQJ-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])cn1	ZINC000085329852	179020351	/nfs/dbraw/zinc/02/03/51/179020351.db2.gz	VOHSCYISRKJUCT-ZJUUUORDSA-N	-1	0	265.269	2.045	10	5		CEBERM
O=C([O-])[C@H](F)Oc1ccc(Br)cc1[N+](=O)[O-]	ZINC000086242195	179254989	/nfs/dbraw/zinc/25/49/89/179254989.db2.gz	WFUUQMDRXDTHLI-SSDOTTSWSA-N	-1	0	294.032	2.116	10	5		CEBERM
COC[C@H](Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-])C(C)C	ZINC000086703000	179321612	/nfs/dbraw/zinc/32/16/12/179321612.db2.gz	AIOVLLKEUKOOQU-NSHDSACASA-N	-1	0	282.296	2.376	10	5		CEBERM
CCC[C@@]1(C(=O)[O-])CCN(c2ncc(C)cc2[N+](=O)[O-])C1	ZINC000090691744	180024380	/nfs/dbraw/zinc/02/43/80/180024380.db2.gz	UZNCXOAAAWMWFI-CQSZACIVSA-N	-1	0	293.323	2.379	10	5		CEBERM
Cc1cnc(S[C@@H](C)CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691876	180024916	/nfs/dbraw/zinc/02/49/16/180024916.db2.gz	WUJCXMQUASKJGE-ZETCQYMHSA-N	-1	0	256.283	2.254	10	5		CEBERM
Nc1ccc(S(=O)(=O)[N-]c2ccsc2)c([N+](=O)[O-])c1	ZINC000090868437	180048972	/nfs/dbraw/zinc/04/89/72/180048972.db2.gz	HMPVDSJXQJOFTP-UHFFFAOYSA-N	-1	0	299.333	2.039	10	5		CEBERM
Cc1ccc(Oc2cncc(C(=O)[O-])n2)c([N+](=O)[O-])c1	ZINC000091417448	180150335	/nfs/dbraw/zinc/15/03/35/180150335.db2.gz	CDYLXHMJSWVTJT-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@](C)(C(=O)[O-])C1CC1	ZINC000091555887	180190055	/nfs/dbraw/zinc/19/00/55/180190055.db2.gz	BNNMMVIPFFHOGH-ZDUSSCGKSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCC[C@@H](CNc1c([N+](=O)[O-])c(C(C)C)nn1C)C(=O)[O-]	ZINC000091576851	180197924	/nfs/dbraw/zinc/19/79/24/180197924.db2.gz	XADMCRAMCHWIMM-VIFPVBQESA-N	-1	0	298.343	2.365	10	5		CEBERM
CCC[C@H](Nc1c([N+](=O)[O-])c(C)nn1CCC)C(=O)[O-]	ZINC000091554368	180189396	/nfs/dbraw/zinc/18/93/96/180189396.db2.gz	MSTLMCCQYYTGDG-VIFPVBQESA-N	-1	0	284.316	2.175	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N(CC(=O)[O-])[C@@H](C)CC	ZINC000091554824	180189625	/nfs/dbraw/zinc/18/96/25/180189625.db2.gz	PJNUDCPHRODXRS-VIFPVBQESA-N	-1	0	298.343	2.199	10	5		CEBERM
C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2C(=O)[O-])C[C@H]1C	ZINC000092085944	180320103	/nfs/dbraw/zinc/32/01/03/180320103.db2.gz	WQSLTHPASPFRCY-RKDXNWHRSA-N	-1	0	264.281	2.385	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000092448242	180386948	/nfs/dbraw/zinc/38/69/48/180386948.db2.gz	JXPKHLGDYICXQZ-UHFFFAOYSA-N	-1	0	295.295	2.312	10	5		CEBERM
O=C([O-])C1(Nc2ccc([N+](=O)[O-])c3cccnc23)CC1	ZINC000116359743	186709015	/nfs/dbraw/zinc/70/90/15/186709015.db2.gz	QSASQMFCQDLWFQ-UHFFFAOYSA-N	-1	0	273.248	2.172	10	5		CEBERM
Cc1cc(OC(F)(F)F)cc(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575675469	366324743	/nfs/dbraw/zinc/32/47/43/366324743.db2.gz	UYXXJCBYJXWWEU-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
CCOc1cc(OC(F)F)cc([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575657879	366317623	/nfs/dbraw/zinc/31/76/23/366317623.db2.gz	MRVBCJIAABQMQP-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1ccc(CC(=O)[O-])c([N+](=O)[O-])c1OC(F)F	ZINC000575660740	366320869	/nfs/dbraw/zinc/32/08/69/366320869.db2.gz	VKIRHHXADRHEJK-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
COc1cc([N+](=O)[O-])c(OC(F)F)cc1[S-]	ZINC000575664495	366322385	/nfs/dbraw/zinc/32/23/85/366322385.db2.gz	GVFYGPKAVZICSL-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(OC(F)(F)F)c1F	ZINC000575709757	366338755	/nfs/dbraw/zinc/33/87/55/366338755.db2.gz	AUGKSSQUSQDIMV-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
CCOc1cc(CC)cc(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575697550	366332313	/nfs/dbraw/zinc/33/23/13/366332313.db2.gz	YIVARDKRLJIRAN-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
CCOC(=O)Cc1cc([O-])cc(Cl)c1[N+](=O)[O-]	ZINC000575699677	366333934	/nfs/dbraw/zinc/33/39/34/366333934.db2.gz	BVOLXFUPQFOFCS-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
Cc1onc(C(=O)[O-])c1COc1cccc([N+](=O)[O-])c1	ZINC000024548713	361611742	/nfs/dbraw/zinc/61/17/42/361611742.db2.gz	BZNTXHVYAJZGMZ-UHFFFAOYSA-N	-1	0	278.220	2.168	10	5		CEBERM
COc1cc(N[C@@H](C(=O)[O-])C(C)C)c(F)cc1[N+](=O)[O-]	ZINC000227855344	295002979	/nfs/dbraw/zinc/00/29/79/295002979.db2.gz	GYZRYYDRVAMMEI-LLVKDONJSA-N	-1	0	286.259	2.264	10	5		CEBERM
O=C([O-])CC1C[C@H]2CC[C@@H](C1)N2c1ccncc1[N+](=O)[O-]	ZINC000093680113	184705332	/nfs/dbraw/zinc/70/53/32/184705332.db2.gz	JYXXIMYOTMDLDR-FGWVZKOKSA-N	-1	0	291.307	2.212	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@](C)(CC)C(=O)[O-]	ZINC000094221719	184765042	/nfs/dbraw/zinc/76/50/42/184765042.db2.gz	WVTMDJMHLOWINX-GFCCVEGCSA-N	-1	0	284.316	2.175	10	5		CEBERM
CC[C@H](C)CNC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000263164910	154029545	/nfs/dbraw/zinc/02/95/45/154029545.db2.gz	IRSHJTMKIIMKMY-QMMMGPOBSA-N	-1	0	280.280	2.069	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1OCc1ccc(C(=O)[O-])o1	ZINC000022170393	171367688	/nfs/dbraw/zinc/36/76/88/171367688.db2.gz	SRGRAUJLLSYQNQ-UHFFFAOYSA-N	-1	0	293.231	2.474	10	5		CEBERM
CN(Cc1ccncc1)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000035207373	172052280	/nfs/dbraw/zinc/05/22/80/172052280.db2.gz	QVSYIDJHVFDZMS-UHFFFAOYSA-N	-1	0	287.275	2.324	10	5		CEBERM
Cc1c(O[C@@H](C(=O)[O-])C(C)C)cccc1[N+](=O)[O-]	ZINC000035282919	172101091	/nfs/dbraw/zinc/10/10/91/172101091.db2.gz	NLMMVZCQSYTPKQ-LLVKDONJSA-N	-1	0	253.254	2.391	10	5		CEBERM
CC[C@@H](C)Oc1cc([N+](=O)[O-])c(C(=O)[O-])cc1OC	ZINC000037226496	173046657	/nfs/dbraw/zinc/04/66/57/173046657.db2.gz	ODXYZINWDWQQKF-SSDOTTSWSA-N	-1	0	269.253	2.479	10	5		CEBERM
CCN(CC(=O)[O-])c1ccc([N+](=O)[O-])c2cnccc21	ZINC000038017284	173991209	/nfs/dbraw/zinc/99/12/09/173991209.db2.gz	QNAVKLJGNPFFRR-UHFFFAOYSA-N	-1	0	275.264	2.054	10	5		CEBERM
CCC[C@@H](NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000040546325	174325139	/nfs/dbraw/zinc/32/51/39/174325139.db2.gz	NBLXFJPHMHWRIU-SNVBAGLBSA-N	-1	0	295.295	2.278	10	5		CEBERM
O=C([O-])Cc1csc(Sc2ncccc2[N+](=O)[O-])n1	ZINC000071300797	176113573	/nfs/dbraw/zinc/11/35/73/176113573.db2.gz	JYVNCZSCPGDOIZ-UHFFFAOYSA-N	-1	0	297.317	2.225	10	5		CEBERM
O=C([O-])c1ccn(-c2ccc3ncccc3c2[N+](=O)[O-])n1	ZINC000080051417	177603168	/nfs/dbraw/zinc/60/31/68/177603168.db2.gz	OJHVGKLMQLOIJM-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
CCO[C@@H](CSc1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000062765967	520315154	/nfs/dbraw/zinc/31/51/54/520315154.db2.gz	JDQNTRVHATZYSU-JTQLQIEISA-N	-1	0	271.294	2.177	10	5		CEBERM
CC[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000060362177	521924301	/nfs/dbraw/zinc/92/43/01/521924301.db2.gz	NRYDYIQSIBJHCR-SSDOTTSWSA-N	-1	0	266.253	2.278	10	5		CEBERM
CN(C[C@@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000048553522	523034235	/nfs/dbraw/zinc/03/42/35/523034235.db2.gz	OQGJOWXJSKZRHW-NSHDSACASA-N	-1	0	294.307	2.298	10	5		CEBERM
CCn1cc(COc2cc(C(=O)[O-])ccc2[N+](=O)[O-])cn1	ZINC000050540000	523391511	/nfs/dbraw/zinc/39/15/11/523391511.db2.gz	KEBUYQHZWMRFGF-UHFFFAOYSA-N	-1	0	291.263	2.088	10	5		CEBERM
Cc1ccc(N(CCC(=O)[O-])C2CC2)cc1[N+](=O)[O-]	ZINC000061700566	524897391	/nfs/dbraw/zinc/89/73/91/524897391.db2.gz	WAZCTBYJWYPTKB-UHFFFAOYSA-N	-1	0	264.281	2.347	10	5		CEBERM
COc1cccc(C(=O)[O-])c1Oc1ccc([N+](=O)[O-])cn1	ZINC000048803274	525839012	/nfs/dbraw/zinc/83/90/12/525839012.db2.gz	LIJKFYUBSKKIRV-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
O=C([O-])c1cc(OC2CCC2)c(F)cc1[N+](=O)[O-]	ZINC000050519610	526354164	/nfs/dbraw/zinc/35/41/64/526354164.db2.gz	MRNJWEPBMVCAQO-UHFFFAOYSA-N	-1	0	255.201	2.363	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NC(=O)C1CCC1	ZINC000060362161	526355419	/nfs/dbraw/zinc/35/54/19/526355419.db2.gz	SURDQSSWXYGDLY-UHFFFAOYSA-N	-1	0	264.237	2.032	10	5		CEBERM
Cc1nn(-c2cc([N+](=O)[O-])c(Cl)cc2Cl)c(=O)[n-]1	ZINC000022013082	282236845	/nfs/dbraw/zinc/23/68/45/282236845.db2.gz	PQYWWCIZMOEWAM-UHFFFAOYSA-N	-1	0	289.078	2.084	10	5		CEBERM
Cc1cc(CC(=O)[O-])c(Br)c([N+](=O)[O-])c1	ZINC000396137817	344846225	/nfs/dbraw/zinc/84/62/25/344846225.db2.gz	QBYVMIWKPXUGTH-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
O=C(N[C@@H]1CCC[C@H]2C[C@H]21)c1cccc([N+](=O)[O-])c1[O-]	ZINC000592898353	345413414	/nfs/dbraw/zinc/41/34/14/345413414.db2.gz	XEJTUIDFVDCIRM-JMJZKYOTSA-N	-1	0	276.292	2.219	10	5		CEBERM
O=C([O-])[C@@H]1CCCN1c1cc(F)c(Cl)cc1[N+](=O)[O-]	ZINC000097355439	185588217	/nfs/dbraw/zinc/58/82/17/185588217.db2.gz	ITEZIAJZHFGSMM-QMMMGPOBSA-N	-1	0	288.662	2.441	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1	ZINC000085328638	179019345	/nfs/dbraw/zinc/01/93/45/179019345.db2.gz	CVQZOJKHRFYTHG-QWRGUYRKSA-N	-1	0	250.254	2.260	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1NC[C@H]1CCCC[C@@H]1O	ZINC000086017042	179216447	/nfs/dbraw/zinc/21/64/47/179216447.db2.gz	WGKQRCKEAAUFSD-RNCFNFMXSA-N	-1	0	294.307	2.256	10	5		CEBERM
C[C@H](CC(=O)[O-])SCc1nc2ccccn2c1[N+](=O)[O-]	ZINC000090097515	179913551	/nfs/dbraw/zinc/91/35/51/179913551.db2.gz	QCFBVDJYFTTYNH-MRVPVSSYSA-N	-1	0	295.320	2.339	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1S[C@@H](C)CC(=O)[O-]	ZINC000090098749	179914424	/nfs/dbraw/zinc/91/44/24/179914424.db2.gz	OREZPODSPTWNAC-LURJTMIESA-N	-1	0	273.314	2.075	10	5		CEBERM
Nc1ccc([N+](=O)[O-])c(S(=O)(=O)[N-]c2ccsc2)c1	ZINC000090868462	180049487	/nfs/dbraw/zinc/04/94/87/180049487.db2.gz	XZFUZCPSMXDLNL-UHFFFAOYSA-N	-1	0	299.333	2.039	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1C[C@@H]1Cc2ccccc2O1	ZINC000090875547	180050846	/nfs/dbraw/zinc/05/08/46/180050846.db2.gz	BILRUNKBBOGXAR-NSHDSACASA-N	-1	0	288.259	2.098	10	5		CEBERM
CC(C)c1nn(C)c(N[C@H]2CCC[C@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000091584426	180199575	/nfs/dbraw/zinc/19/95/75/180199575.db2.gz	ATCWXTZRSZQMDU-BDAKNGLRSA-N	-1	0	296.327	2.117	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NC(=O)N1CCCCC1	ZINC000091968983	180294641	/nfs/dbraw/zinc/29/46/41/180294641.db2.gz	WEPOWYVESIRYJV-UHFFFAOYSA-N	-1	0	293.279	2.311	10	5		CEBERM
C[C@H]1CN(c2cc([N+](=O)[O-])ccc2C(=O)[O-])C[C@H]1C	ZINC000092090969	180322000	/nfs/dbraw/zinc/32/20/00/180322000.db2.gz	PVSBRSHKKIHRHO-DTORHVGOSA-N	-1	0	264.281	2.385	10	5		CEBERM
O=C([O-])CN(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F	ZINC000092443406	180385796	/nfs/dbraw/zinc/38/57/96/180385796.db2.gz	TWUCDNCWLMOPIL-UHFFFAOYSA-N	-1	0	292.213	2.044	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1-c1nc([O-])c(C(C)C)c(=O)[nH]1	ZINC000110620206	186305985	/nfs/dbraw/zinc/30/59/85/186305985.db2.gz	NDAKYHIULKVSKW-UHFFFAOYSA-N	-1	0	289.291	2.483	10	5		CEBERM
Cc1ccc(Nc2c([N+](=O)[O-])ncn2C)cc1C(=O)[O-]	ZINC000110988993	186340480	/nfs/dbraw/zinc/34/04/80/186340480.db2.gz	MSAVLXPSZCULBW-UHFFFAOYSA-N	-1	0	276.252	2.079	10	5		CEBERM
COc1cc([N+](=O)[O-])cc(C(=O)[O-])c1C(F)(F)F	ZINC000575673628	366323239	/nfs/dbraw/zinc/32/32/39/366323239.db2.gz	LMSLEXFTTVTAKT-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(OC(F)(F)F)cc1CC(=O)[O-]	ZINC000575673427	366323774	/nfs/dbraw/zinc/32/37/74/366323774.db2.gz	JSKSTARGOJYHDU-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
Cc1cc([C@@H](O)C(=O)[O-])c(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575673742	366325132	/nfs/dbraw/zinc/32/51/32/366325132.db2.gz	MXUKPICKVCYXAS-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
Cc1cc(C(F)(F)F)cc([C@@H](O)C(=O)[O-])c1[N+](=O)[O-]	ZINC000575675582	366325202	/nfs/dbraw/zinc/32/52/02/366325202.db2.gz	WMCOWCCJXRWHJE-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCOc1cc(CC(=O)[O-])c(OC(F)F)cc1[N+](=O)[O-]	ZINC000575657604	366316343	/nfs/dbraw/zinc/31/63/43/366316343.db2.gz	KQCDGNQRVFPYEW-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
O=C([O-])Cc1cc(F)c([N+](=O)[O-])cc1C(F)(F)F	ZINC000575709648	366338773	/nfs/dbraw/zinc/33/87/73/366338773.db2.gz	AICUQQYPJIJOON-UHFFFAOYSA-N	-1	0	267.134	2.380	10	5		CEBERM
O=C([O-])c1ccc(F)c([N+](=O)[O-])c1C(F)(F)F	ZINC000575711692	366340205	/nfs/dbraw/zinc/34/02/05/366340205.db2.gz	VLRCXSWFHGTGOH-UHFFFAOYSA-N	-1	0	253.107	2.451	10	5		CEBERM
CCOc1c(CC)cc([N+](=O)[O-])cc1CC(=O)[O-]	ZINC000575695504	366331632	/nfs/dbraw/zinc/33/16/32/366331632.db2.gz	JJKKXFXXJDVYHV-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(Cl)c(C(F)(F)F)c([N+](=O)[O-])c1	ZINC000575696572	366332295	/nfs/dbraw/zinc/33/22/95/366332295.db2.gz	XJNHOQMCGIDUTD-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
C[C@]1(C(=O)[O-])CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000079482150	363606519	/nfs/dbraw/zinc/60/65/19/363606519.db2.gz	QMOVRMPBKPCQFR-CYBMUJFWSA-N	-1	0	293.279	2.066	10	5		CEBERM
Cc1cc(C)n(-c2ccc(C(=O)[O-])cc2[N+](=O)[O-])n1	ZINC000004185038	361303731	/nfs/dbraw/zinc/30/37/31/361303731.db2.gz	BDVSUKLFJJBBRP-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
O=C([O-])c1cnc(-c2c(F)ccc([N+](=O)[O-])c2F)nc1	ZINC000094187352	184760802	/nfs/dbraw/zinc/76/08/02/184760802.db2.gz	AXIZYSOOZBPTMK-UHFFFAOYSA-N	-1	0	281.174	2.028	10	5		CEBERM
CCC(CC)(Nc1cc(C)c([N+](=O)[O-])cn1)C(=O)[O-]	ZINC000094240680	184768663	/nfs/dbraw/zinc/76/86/63/184768663.db2.gz	MWZJGNPHJDZQAA-UHFFFAOYSA-N	-1	0	267.285	2.354	10	5		CEBERM
CN(CC(=O)[O-])c1cc(Cl)c(Cl)cc1[N+](=O)[O-]	ZINC000095023967	184917936	/nfs/dbraw/zinc/91/79/36/184917936.db2.gz	KOEUFMQCIITOAW-UHFFFAOYSA-N	-1	0	279.079	2.422	10	5		CEBERM
Cc1ccnc(N2CCCC[C@H]2CC(=O)[O-])c1[N+](=O)[O-]	ZINC000070495565	134951109	/nfs/dbraw/zinc/95/11/09/134951109.db2.gz	BEJMQNADWZIIET-JTQLQIEISA-N	-1	0	279.296	2.132	10	5		CEBERM
CC(C)CN(C)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000037108805	172960185	/nfs/dbraw/zinc/96/01/85/172960185.db2.gz	BVKNEHMJBJOXAZ-UHFFFAOYSA-N	-1	0	252.270	2.385	10	5		CEBERM
Cc1c(Nc2cnn(C)c2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386946	175032544	/nfs/dbraw/zinc/03/25/44/175032544.db2.gz	IBGLSDKCPSDJHC-UHFFFAOYSA-N	-1	0	276.252	2.079	10	5		CEBERM
O=[N+]([O-])c1cc(-c2nnc(-c3cccnc3)[nH]2)ccc1[O-]	ZINC000072237685	176346773	/nfs/dbraw/zinc/34/67/73/176346773.db2.gz	PRZBMCWUKPGGRG-UHFFFAOYSA-N	-1	0	283.247	2.148	10	5		CEBERM
C[C@H](CCNc1cc([N+](=O)[O-])ccn1)CCC(=O)[O-]	ZINC000079066202	177426323	/nfs/dbraw/zinc/42/63/23/177426323.db2.gz	XPGCQARBIYVQPG-VIFPVBQESA-N	-1	0	267.285	2.293	10	5		CEBERM
CCN(C(=O)c1cc([N+](=O)[O-])ccc1C)[C@H](C)CC(=O)[O-]	ZINC000061180945	520072533	/nfs/dbraw/zinc/07/25/33/520072533.db2.gz	XTKSNVFKUCKXLQ-SNVBAGLBSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1cccc([N+](=O)[O-])c1	ZINC000061217741	521247368	/nfs/dbraw/zinc/24/73/68/521247368.db2.gz	OQYPEAJTLJWJKB-VIFPVBQESA-N	-1	0	252.270	2.142	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1Oc1ccnc(C(=O)[O-])c1	ZINC000050505016	522985752	/nfs/dbraw/zinc/98/57/52/522985752.db2.gz	MXRSHJMQKMXAKO-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
CC[C@H]1CO[C@@H](C)CN1c1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070232464	523347027	/nfs/dbraw/zinc/34/70/27/523347027.db2.gz	ZXOLOICPCFBDID-UWVGGRQHSA-N	-1	0	294.307	2.297	10	5		CEBERM
CN(c1ccc2ncccc2c1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061171091	523644712	/nfs/dbraw/zinc/64/47/12/523644712.db2.gz	NYSSTDQKRXSLQA-UHFFFAOYSA-N	-1	0	289.291	2.442	10	5		CEBERM
C[C@@H]1CSCCN1c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000070222716	525171488	/nfs/dbraw/zinc/17/14/88/525171488.db2.gz	DENZDZZCVNTUKQ-MRVPVSSYSA-N	-1	0	282.321	2.235	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(Oc2nccnc2C(=O)[O-])c1	ZINC000054553554	526066145	/nfs/dbraw/zinc/06/61/45/526066145.db2.gz	SESYNLDEXYTGSX-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
O=C([O-])[C@@H]1CC[C@H](Cn2ccc3cc([N+](=O)[O-])ccc32)O1	ZINC000051394663	526283441	/nfs/dbraw/zinc/28/34/41/526283441.db2.gz	NBSCISZNVQGBHE-YPMHNXCESA-N	-1	0	290.275	2.182	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc([N+](=O)[O-])c2cccnc12)C1CC1	ZINC000054521919	526315562	/nfs/dbraw/zinc/31/55/62/526315562.db2.gz	KMJWWVAQEQRHPO-GFCCVEGCSA-N	-1	0	287.275	2.418	10	5		CEBERM
O=C([O-])c1cc(COc2ccc([N+](=O)[O-])c(F)c2)ccn1	ZINC000068764943	526344759	/nfs/dbraw/zinc/34/47/59/526344759.db2.gz	OBUUFAQFAJRTCE-UHFFFAOYSA-N	-1	0	292.222	2.406	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1N1CCC[C@H]1CCCO	ZINC000052763842	526355592	/nfs/dbraw/zinc/35/55/92/526355592.db2.gz	IDVTUERXEAQOQI-JTQLQIEISA-N	-1	0	294.307	2.034	10	5		CEBERM
O=C([O-])c1coc(C[S@@](=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000051330115	526407223	/nfs/dbraw/zinc/40/72/23/526407223.db2.gz	SUAQFKDCTPAIAZ-FQEVSTJZSA-N	-1	0	295.272	2.194	10	5		CEBERM
O=C([O-])c1ncccc1COc1ccccc1[N+](=O)[O-]	ZINC000062763606	526408083	/nfs/dbraw/zinc/40/80/83/526408083.db2.gz	ORSGBXYBGYOEJT-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
O=C([O-])c1ncccc1COc1cccc([N+](=O)[O-])c1	ZINC000062763520	526408589	/nfs/dbraw/zinc/40/85/89/526408589.db2.gz	YOTYCARFZFJHIL-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
O=C([O-])c1nccnc1Oc1ccc([N+](=O)[O-])c(F)c1	ZINC000054553725	526410387	/nfs/dbraw/zinc/41/03/87/526410387.db2.gz	ILYVTBMFFXMASL-UHFFFAOYSA-N	-1	0	279.183	2.014	10	5		CEBERM
Cc1ncc([N+](=O)[O-])n1CCSc1ccc(C(=O)[O-])o1	ZINC000069334446	527316426	/nfs/dbraw/zinc/31/64/26/527316426.db2.gz	PXNVPVXKYLSGES-UHFFFAOYSA-N	-1	0	297.292	2.183	10	5		CEBERM
O=C([O-])CC[C@H]1CCCCN1c1ccncc1[N+](=O)[O-]	ZINC000050923896	527600280	/nfs/dbraw/zinc/60/02/80/527600280.db2.gz	MFIWUTNPSTVQHZ-SNVBAGLBSA-N	-1	0	279.296	2.214	10	5		CEBERM
O=C([O-])[C@@H](c1ccccc1)n1cc(Cl)c([N+](=O)[O-])n1	ZINC000070217006	527656992	/nfs/dbraw/zinc/65/69/92/527656992.db2.gz	VUXVZTKDKNZWIY-SECBINFHSA-N	-1	0	281.655	2.119	10	5		CEBERM
NC(=O)c1cccc(-c2ccc(C(=O)[O-])c([N+](=O)[O-])c2)c1	ZINC000095495156	184997983	/nfs/dbraw/zinc/99/79/83/184997983.db2.gz	ITAUVQNRKSPKJY-UHFFFAOYSA-N	-1	0	286.243	2.059	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(Br)c1F	ZINC000307346108	344721825	/nfs/dbraw/zinc/72/18/25/344721825.db2.gz	WLSATTJAPUFRHL-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(F)c1Br	ZINC000307339492	344721943	/nfs/dbraw/zinc/72/19/43/344721943.db2.gz	TXMKBDIIQVNRJP-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
COc1ccc(N[C@H]2CC[C@@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000097066335	185520514	/nfs/dbraw/zinc/52/05/14/185520514.db2.gz	SBOTWSUOEMCSDP-BDAKNGLRSA-N	-1	0	280.280	2.269	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H]1Nc1ccccc1[N+](=O)[O-]	ZINC000085328511	179019213	/nfs/dbraw/zinc/01/92/13/179019213.db2.gz	WFYHYCLMMUTYBE-DTWKUNHWSA-N	-1	0	250.254	2.260	10	5		CEBERM
COc1ccc(N[C@H]2CCC[C@@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000085329202	179019853	/nfs/dbraw/zinc/01/98/53/179019853.db2.gz	XEHFJTXRXSHRND-UWVGGRQHSA-N	-1	0	280.280	2.269	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@H]1Nc1cc(F)ccc1[N+](=O)[O-]	ZINC000085329487	179019895	/nfs/dbraw/zinc/01/98/95/179019895.db2.gz	XFYCJXDIMWDFMQ-RKDXNWHRSA-N	-1	0	268.244	2.399	10	5		CEBERM
O=C([O-])c1cc(NC[C@@H]2CCCC[C@@H]2O)ccc1[N+](=O)[O-]	ZINC000086016926	179216453	/nfs/dbraw/zinc/21/64/53/179216453.db2.gz	IWJHCCJCKSOZSC-ZANVPECISA-N	-1	0	294.307	2.256	10	5		CEBERM
C[C@H](CSc1ncnc2ccc([N+](=O)[O-])cc21)C(=O)[O-]	ZINC000086111089	179232861	/nfs/dbraw/zinc/23/28/61/179232861.db2.gz	FJNQENRUDOIPCO-SSDOTTSWSA-N	-1	0	293.304	2.351	10	5		CEBERM
Cc1cnc(N[C@H]2CCC[C@@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000090691731	180024757	/nfs/dbraw/zinc/02/47/57/180024757.db2.gz	CUCGKUYIICECPD-ZJUUUORDSA-N	-1	0	279.296	2.354	10	5		CEBERM
Cc1cnc(NCc2nc(C(=O)[O-])cs2)c([N+](=O)[O-])c1	ZINC000090933070	180066846	/nfs/dbraw/zinc/06/68/46/180066846.db2.gz	QCMWCWFBGCGFEC-UHFFFAOYSA-N	-1	0	294.292	2.065	10	5		CEBERM
Cc1ccnc(NCc2nc(C(=O)[O-])cs2)c1[N+](=O)[O-]	ZINC000090933302	180066516	/nfs/dbraw/zinc/06/65/16/180066516.db2.gz	AUUJDUSEUYCUJX-UHFFFAOYSA-N	-1	0	294.292	2.065	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](CC)C(=O)[O-]	ZINC000091555913	180190290	/nfs/dbraw/zinc/19/02/90/180190290.db2.gz	TZWNPDRUYYWSFN-SECBINFHSA-N	-1	0	284.316	2.032	10	5		CEBERM
CC(C)c1nn(C)c(N(CCC(=O)[O-])C(C)C)c1[N+](=O)[O-]	ZINC000091577847	180197913	/nfs/dbraw/zinc/19/79/13/180197913.db2.gz	YTRYVSRMNKHTBF-UHFFFAOYSA-N	-1	0	298.343	2.141	10	5		CEBERM
CC(C)c1nn(C)c(SC[C@H](C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091578795	180198615	/nfs/dbraw/zinc/19/86/15/180198615.db2.gz	KXINRGHNVNTRNA-ZETCQYMHSA-N	-1	0	287.341	2.265	10	5		CEBERM
Cc1cc(NC2(C(=O)[O-])CCCCC2)ncc1[N+](=O)[O-]	ZINC000092026378	180308597	/nfs/dbraw/zinc/30/85/97/180308597.db2.gz	XSUKQZVDCORCAX-UHFFFAOYSA-N	-1	0	279.296	2.498	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@@H](Nc2cccc(F)c2[N+](=O)[O-])C1	ZINC000092183847	180339913	/nfs/dbraw/zinc/33/99/13/180339913.db2.gz	ZXBUIDVOGCHCHD-JGVFFNPUSA-N	-1	0	266.228	2.175	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@@H](Nc2cc(F)ccc2[N+](=O)[O-])C1	ZINC000092183859	180339934	/nfs/dbraw/zinc/33/99/34/180339934.db2.gz	FZPNCEMPAFPQGW-IONNQARKSA-N	-1	0	266.228	2.175	10	5		CEBERM
O=C([O-])c1cc(NC(=O)c2csc([N+](=O)[O-])c2)ccn1	ZINC000110966143	186337596	/nfs/dbraw/zinc/33/75/96/186337596.db2.gz	OOYLVGLGEOLQPL-UHFFFAOYSA-N	-1	0	293.260	2.002	10	5		CEBERM
Cc1c(=O)n(-c2ccc([N+](=O)[O-])cc2)[n-]c1C(F)(F)F	ZINC000111308794	186395205	/nfs/dbraw/zinc/39/52/05/186395205.db2.gz	FWHTZGQCCBRMGG-ZCFIWIBFSA-N	-1	0	287.197	2.496	10	5		CEBERM
O=C([O-])c1cncc(Oc2ccc([N+](=O)[O-])cc2)c1	ZINC000111685876	186441753	/nfs/dbraw/zinc/44/17/53/186441753.db2.gz	FWNSJRGBTNJVAP-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
Cc1cc(CC(=O)[O-])c([N+](=O)[O-])cc1OC(F)(F)F	ZINC000575673693	366325141	/nfs/dbraw/zinc/32/51/41/366325141.db2.gz	LZSAWXXMNWWDMZ-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
O=C([O-])c1cc(F)cc([N+](=O)[O-])c1OC(F)F	ZINC000575661403	366321254	/nfs/dbraw/zinc/32/12/54/366321254.db2.gz	OSWSNLYZUMFFDL-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=[N+]([O-])c1c(F)ccc([O-])c1I	ZINC000575707340	366339479	/nfs/dbraw/zinc/33/94/79/366339479.db2.gz	WFYOTVSTEUJXLG-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
CCOC(=O)Cc1cc([N+](=O)[O-])c(Cl)cc1[O-]	ZINC000575701439	366333882	/nfs/dbraw/zinc/33/38/82/366333882.db2.gz	ZNTSGBMTVZCSDS-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
CCC[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)C(=O)[O-]	ZINC000081588729	363732962	/nfs/dbraw/zinc/73/29/62/363732962.db2.gz	QFIHUJUVGAGBOV-NSHDSACASA-N	-1	0	290.279	2.203	10	5		CEBERM
Cc1c(CC(=O)[O-])cc(Br)cc1[N+](=O)[O-]	ZINC000098092213	364529711	/nfs/dbraw/zinc/52/97/11/364529711.db2.gz	FFGXPODVZOVSFH-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
C[C@@H]1[C@@H](C(=O)[O-])CCN1c1cc(F)ccc1[N+](=O)[O-]	ZINC000092921966	184635151	/nfs/dbraw/zinc/63/51/51/184635151.db2.gz	ZSRYUYKZVQKCPZ-APPZFPTMSA-N	-1	0	268.244	2.033	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N[C@@](C)(C(=O)[O-])C(F)(F)F	ZINC000094222160	184765288	/nfs/dbraw/zinc/76/52/88/184765288.db2.gz	DRYBKCSBJUOYEM-VIFPVBQESA-N	-1	0	293.201	2.116	10	5		CEBERM
O=C([O-])[C@H]1CCCCC[C@H]1Nc1cc([N+](=O)[O-])ccn1	ZINC000094745397	184851784	/nfs/dbraw/zinc/85/17/84/184851784.db2.gz	ZCTDVIMYVKJEHF-WDEREUQCSA-N	-1	0	279.296	2.435	10	5		CEBERM
C[C@@]1(CNc2cc(C(=O)[O-])c([N+](=O)[O-])cc2F)CCCO1	ZINC000094803953	184868827	/nfs/dbraw/zinc/86/88/27/184868827.db2.gz	ZHTPXVPBJUNVSV-ZDUSSCGKSA-N	-1	0	298.270	2.413	10	5		CEBERM
CC[C@@H]1CN(c2cc(C(=O)[O-])cc([N+](=O)[O-])c2C)CCO1	ZINC000043386974	134900276	/nfs/dbraw/zinc/90/02/76/134900276.db2.gz	KZOPRLRCZNSVBC-LLVKDONJSA-N	-1	0	294.307	2.217	10	5		CEBERM
O=C([O-])c1cc(OCc2ccco2)ccc1[N+](=O)[O-]	ZINC000022177248	171371115	/nfs/dbraw/zinc/37/11/15/171371115.db2.gz	YHPZIUHDDKASMI-UHFFFAOYSA-N	-1	0	263.205	2.465	10	5		CEBERM
CCCC[C@@H](Nc1ccc([N+](=O)[O-])nc1)C(=O)[O-]	ZINC000035411093	172181998	/nfs/dbraw/zinc/18/19/98/172181998.db2.gz	CUWUDUGQLKMACY-SECBINFHSA-N	-1	0	253.258	2.045	10	5		CEBERM
CCN(CCC(=O)[O-])c1ccc([N+](=O)[O-])c(C)c1	ZINC000038023853	174005971	/nfs/dbraw/zinc/00/59/71/174005971.db2.gz	USLZHQJEGSUUBK-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
Cc1c(OCCOC(C)C)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386584	175032520	/nfs/dbraw/zinc/03/25/20/175032520.db2.gz	HVNYZDNALZHFTO-UHFFFAOYSA-N	-1	0	283.280	2.405	10	5		CEBERM
CCOC[C@@H](C)Nc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000044728047	175239224	/nfs/dbraw/zinc/23/92/24/175239224.db2.gz	CLVPRQVGAVTMLM-MRVPVSSYSA-N	-1	0	268.269	2.130	10	5		CEBERM
Cc1cc(C)c(Oc2cnc(C(=O)[O-])cn2)c([N+](=O)[O-])c1	ZINC000071182441	176057500	/nfs/dbraw/zinc/05/75/00/176057500.db2.gz	PJQNVGDDLQMFNB-UHFFFAOYSA-N	-1	0	289.247	2.492	10	5		CEBERM
COc1c([O-])c2nccc3c4ccccc4n(c32)c1=O	ZINC000100074489	294904228	/nfs/dbraw/zinc/90/42/28/294904228.db2.gz	HJFNTSGIQCFHGP-UHFFFAOYSA-N	-1	0	266.256	2.153	10	5	biogenic,in-vitro	CEBERM
CC(C)CN(CC(=O)[O-])c1cccc([N+](=O)[O-])c1	ZINC000062742642	519712261	/nfs/dbraw/zinc/71/22/61/519712261.db2.gz	IDDCXZUFBHFSHF-UHFFFAOYSA-N	-1	0	252.270	2.142	10	5		CEBERM
CC(C)c1c(C(=O)[O-])nnn1Cc1ccc([N+](=O)[O-])cc1	ZINC000050214608	519830874	/nfs/dbraw/zinc/83/08/74/519830874.db2.gz	AIFWAOJOUOJVTK-UHFFFAOYSA-N	-1	0	290.279	2.056	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H](C)CC(=O)[O-]	ZINC000061180992	520092675	/nfs/dbraw/zinc/09/26/75/520092675.db2.gz	OQTHCLNNXHHUIM-QMMMGPOBSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])cc1F)C(C)(C)C(=O)[O-]	ZINC000061149760	520092703	/nfs/dbraw/zinc/09/27/03/520092703.db2.gz	QTPUTONPQUBCJT-UHFFFAOYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCN(c1ccc([N+](=O)[O-])cc1F)[C@H](C)CC(=O)[O-]	ZINC000061182108	521493323	/nfs/dbraw/zinc/49/33/23/521493323.db2.gz	ZHHKRBPDVXNYSV-MRVPVSSYSA-N	-1	0	270.260	2.423	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1NC(=O)C[C@H](C)CC(=O)[O-]	ZINC000061834897	522979941	/nfs/dbraw/zinc/97/99/41/522979941.db2.gz	PCPYJIDWWGXOFT-QMMMGPOBSA-N	-1	0	296.279	2.043	10	5		CEBERM
Cc1cc(C)c(OC[C@H]2CC[C@H](C(=O)[O-])O2)c([N+](=O)[O-])c1	ZINC000051393956	524311305	/nfs/dbraw/zinc/31/13/05/524311305.db2.gz	CEBNUZQHNALIME-ZYHUDNBSSA-N	-1	0	295.291	2.223	10	5		CEBERM
C[C@]1(C(=O)[O-])CCN(c2c(F)c(F)ccc2[N+](=O)[O-])C1	ZINC000062933039	525231821	/nfs/dbraw/zinc/23/18/21/525231821.db2.gz	ZYXGSGNRKBAZLK-LBPRGKRZSA-N	-1	0	286.234	2.174	10	5		CEBERM
O=C([O-])[C@@H]1CC[C@H](CSc2ccccc2[N+](=O)[O-])O1	ZINC000051394202	526283085	/nfs/dbraw/zinc/28/30/85/526283085.db2.gz	QUTMHPVRYOLELO-SCZZXKLOSA-N	-1	0	283.305	2.319	10	5		CEBERM
O=C([O-])[C@H](CNc1cc([N+](=O)[O-])ccn1)c1ccccc1	ZINC000061609730	526303466	/nfs/dbraw/zinc/30/34/66/526303466.db2.gz	PHOMBTULSRLVSW-GFCCVEGCSA-N	-1	0	287.275	2.270	10	5		CEBERM
O=C([O-])[C@H](Nc1cccc(F)c1[N+](=O)[O-])C1CC1	ZINC000054505824	526314992	/nfs/dbraw/zinc/31/49/92/526314992.db2.gz	GJJOXEKSLCRKBT-SECBINFHSA-N	-1	0	254.217	2.009	10	5		CEBERM
O=C([O-])c1cc(COc2cccc([N+](=O)[O-])c2)ccn1	ZINC000068764852	526345037	/nfs/dbraw/zinc/34/50/37/526345037.db2.gz	YOKPQOQJVZJZRE-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
Cc1nnc(Oc2ccccc2[N+](=O)[O-])c(C(=O)[O-])c1C	ZINC000054553547	526377122	/nfs/dbraw/zinc/37/71/22/526377122.db2.gz	YDBINJTVTAREKO-UHFFFAOYSA-N	-1	0	289.247	2.492	10	5		CEBERM
O=C([O-])c1ccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)c(F)c1	ZINC000063008907	526377287	/nfs/dbraw/zinc/37/72/87/526377287.db2.gz	YGTQZENGNMOZPY-UHFFFAOYSA-N	-1	0	293.210	2.013	10	5		CEBERM
O=C([O-])c1ccc(Sc2ncccc2[N+](=O)[O-])o1	ZINC000069362512	526383662	/nfs/dbraw/zinc/38/36/62/526383662.db2.gz	JDWBKQAKUJOAMU-UHFFFAOYSA-N	-1	0	266.234	2.432	10	5		CEBERM
Cn1c(C(=O)[O-])ccc1-c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000051041468	527044871	/nfs/dbraw/zinc/04/48/71/527044871.db2.gz	UFYDWQOKCBZCNV-UHFFFAOYSA-N	-1	0	291.219	2.207	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc([N+](=O)[O-])c2cccnc12)C1CC1	ZINC000054521918	527655611	/nfs/dbraw/zinc/65/56/11/527655611.db2.gz	KMJWWVAQEQRHPO-LBPRGKRZSA-N	-1	0	287.275	2.418	10	5		CEBERM
O=C([O-])c1ccc(-c2cccc(CO)c2)cc1[N+](=O)[O-]	ZINC000095495068	184998076	/nfs/dbraw/zinc/99/80/76/184998076.db2.gz	WJQJSDHDOICTNN-UHFFFAOYSA-N	-1	0	273.244	2.452	10	5		CEBERM
CCOC(=O)c1cc([N+](=O)[O-])cc(Br)c1[O-]	ZINC000034763540	343420855	/nfs/dbraw/zinc/42/08/55/343420855.db2.gz	IBGFAHUAVGQGDN-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
Cc1ccc(C(=O)[O-])c([N+](=O)[O-])c1Br	ZINC000215553006	344534193	/nfs/dbraw/zinc/53/41/93/344534193.db2.gz	JZFRBFOZDYWGCP-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000085328415	179018886	/nfs/dbraw/zinc/01/88/86/179018886.db2.gz	FBZOCEYDIPACNE-BDAKNGLRSA-N	-1	0	295.251	2.168	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1F	ZINC000085329547	179019676	/nfs/dbraw/zinc/01/96/76/179019676.db2.gz	NSVIQKJECBVHJZ-WPRPVWTQSA-N	-1	0	268.244	2.399	10	5		CEBERM
Cc1ccc(NC(=O)[C@@H]2[C@@H](C(=O)[O-])C2(C)C)c([N+](=O)[O-])c1	ZINC000085411050	179057187	/nfs/dbraw/zinc/05/71/87/179057187.db2.gz	FAZVRWOQBOMSQN-QWRGUYRKSA-N	-1	0	292.291	2.199	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1NC[C@@H]1CCCC[C@@H]1O	ZINC000086017039	179216618	/nfs/dbraw/zinc/21/66/18/179216618.db2.gz	WGKQRCKEAAUFSD-ZANVPECISA-N	-1	0	294.307	2.256	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCC[C@@H]1O	ZINC000086016918	179216807	/nfs/dbraw/zinc/21/68/07/179216807.db2.gz	STTXLGDYXIENMN-ZANVPECISA-N	-1	0	294.307	2.256	10	5		CEBERM
CC[C@H](CNC(=O)Nc1ccc(C)c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000087487189	179431936	/nfs/dbraw/zinc/43/19/36/179431936.db2.gz	HXYMKHWDEFLFDB-SECBINFHSA-N	-1	0	295.295	2.136	10	5		CEBERM
Cc1nn(C)c(N[C@H](C)CCC[C@H](C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000087673925	179468322	/nfs/dbraw/zinc/46/83/22/179468322.db2.gz	JQESKLXVKDIAMG-DTWKUNHWSA-N	-1	0	298.343	2.328	10	5		CEBERM
COc1cc(N2CC[C@H](CC(=O)[O-])C2)c([N+](=O)[O-])cc1F	ZINC000089712963	179852145	/nfs/dbraw/zinc/85/21/45/179852145.db2.gz	LYJPFGVTVRIBCQ-MRVPVSSYSA-N	-1	0	298.270	2.044	10	5		CEBERM
CCCc1nn(C)c(N[C@@H](CC(C)C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091562419	180192623	/nfs/dbraw/zinc/19/26/23/180192623.db2.gz	PIMLTCMCTVDRBK-JTQLQIEISA-N	-1	0	298.343	2.192	10	5		CEBERM
CCC[C@H](Nc1c([N+](=O)[O-])c(C(C)C)nn1C)C(=O)[O-]	ZINC000091576841	180197721	/nfs/dbraw/zinc/19/77/21/180197721.db2.gz	FJSSHHJUHAPOAJ-QMMMGPOBSA-N	-1	0	284.316	2.117	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@H](CC(C)C)C(=O)[O-]	ZINC000091554862	180189637	/nfs/dbraw/zinc/18/96/37/180189637.db2.gz	BIBBYZQHMJADHY-SNVBAGLBSA-N	-1	0	298.343	2.421	10	5		CEBERM
CCC[C@](C)(Nc1cc(C)c([N+](=O)[O-])cn1)C(=O)[O-]	ZINC000092026350	180308864	/nfs/dbraw/zinc/30/88/64/180308864.db2.gz	DYQRTIKNMARGGT-LBPRGKRZSA-N	-1	0	267.285	2.354	10	5		CEBERM
CCOc1cc(N[C@H]2C=C[C@@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092182941	180339456	/nfs/dbraw/zinc/33/94/56/180339456.db2.gz	RTQMLHXVXZYJRS-ZJUUUORDSA-N	-1	0	292.291	2.435	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N[C@@H]1C=C[C@@H](C(=O)[O-])C1	ZINC000092182706	180339637	/nfs/dbraw/zinc/33/96/37/180339637.db2.gz	YIUNPALMFNDIHH-NXEZZACHSA-N	-1	0	262.265	2.344	10	5		CEBERM
Cc1cccc([N+](=O)[O-])c1C(=O)N(CC(=O)[O-])C(C)(C)C	ZINC000092447655	180387081	/nfs/dbraw/zinc/38/70/81/180387081.db2.gz	NRUCQVNXEKNKCK-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
Cc1cc(CC(=O)[O-])cc([N+](=O)[O-])c1OC(F)(F)F	ZINC000575673349	366323494	/nfs/dbraw/zinc/32/34/94/366323494.db2.gz	HZFYXECFQCOSBN-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
Cc1c(OC(F)F)ccc([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575668304	366323799	/nfs/dbraw/zinc/32/37/99/366323799.db2.gz	URXGNPXYRAFMQC-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
CCOc1c(C(=O)[O-])ccc([N+](=O)[O-])c1OC(F)F	ZINC000575655913	366315316	/nfs/dbraw/zinc/31/53/16/366315316.db2.gz	BXSYTQALXAEEJU-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCc1ccc(OC(F)F)c([N+](=O)[O-])c1C(=O)[O-]	ZINC000575658054	366317567	/nfs/dbraw/zinc/31/75/67/366317567.db2.gz	FUOFUVZPHXSRFJ-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])c(C(F)(F)F)cc1F	ZINC000575708112	366338653	/nfs/dbraw/zinc/33/86/53/366338653.db2.gz	IRNJRBBKHOLLAT-UHFFFAOYSA-N	-1	0	253.107	2.451	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc([N+](=O)[O-])c(Cl)cc1C(F)(F)F	ZINC000575695593	366331571	/nfs/dbraw/zinc/33/15/71/366331571.db2.gz	QAXGQTNTCGARNK-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)Cc1cc([S-])c(F)cc1[N+](=O)[O-]	ZINC000575701912	366333583	/nfs/dbraw/zinc/33/35/83/366333583.db2.gz	XILWKTRJJKQGBS-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
O=C([O-])Cc1cccc2c(=O)c3cccc(O)c3oc12	ZINC000028769800	361676583	/nfs/dbraw/zinc/67/65/83/361676583.db2.gz	FMTHUOUQOSGHKB-UHFFFAOYSA-N	-1	0	270.240	2.279	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N[C@](C)(C(=O)[O-])C(F)(F)F	ZINC000094222161	184765524	/nfs/dbraw/zinc/76/55/24/184765524.db2.gz	DRYBKCSBJUOYEM-SECBINFHSA-N	-1	0	293.201	2.116	10	5		CEBERM
Cc1nn(C)c(N[C@@H]2CCCCC[C@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000094745175	184851476	/nfs/dbraw/zinc/85/14/76/184851476.db2.gz	DISPUWOQJLOVDH-NXEZZACHSA-N	-1	0	296.327	2.082	10	5		CEBERM
Cc1nn(-c2cc(C)ccc2[N+](=O)[O-])c(C)c1CC(=O)[O-]	ZINC000094663505	184836670	/nfs/dbraw/zinc/83/66/70/184836670.db2.gz	OWJIMPQXARLXAO-UHFFFAOYSA-N	-1	0	289.291	2.333	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N1CCSC[C@H]1CC(=O)[O-]	ZINC000091130505	135067230	/nfs/dbraw/zinc/06/72/30/135067230.db2.gz	UCMJAVWWPOUTDN-LLVKDONJSA-N	-1	0	296.348	2.300	10	5		CEBERM
O=C([O-])c1ccc(OCc2cccnc2)c([N+](=O)[O-])c1	ZINC000037295767	173100105	/nfs/dbraw/zinc/10/01/05/173100105.db2.gz	JWZDJOJEBGUVOJ-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
O=C([O-])CCN(c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000037592765	173541392	/nfs/dbraw/zinc/54/13/92/173541392.db2.gz	GWZASHYRKBWBLS-UHFFFAOYSA-N	-1	0	250.254	2.038	10	5		CEBERM
CCN(CCC(=O)[O-])c1ccc([N+](=O)[O-])c2cccnc21	ZINC000038023883	174006151	/nfs/dbraw/zinc/00/61/51/174006151.db2.gz	PXFQAURSNUCJEU-UHFFFAOYSA-N	-1	0	289.291	2.444	10	5		CEBERM
Cc1nn(C)c(N[C@H](C(=O)[O-])C2CCCCC2)c1[N+](=O)[O-]	ZINC000038037080	174036478	/nfs/dbraw/zinc/03/64/78/174036478.db2.gz	OUCUOQHELGLDIF-JTQLQIEISA-N	-1	0	296.327	2.082	10	5		CEBERM
CC(C)(Nc1ccc([N+](=O)[O-])c2cccnc12)C(=O)[O-]	ZINC000040911013	174432426	/nfs/dbraw/zinc/43/24/26/174432426.db2.gz	ZEANOYXHBAFMPF-UHFFFAOYSA-N	-1	0	275.264	2.418	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000070556619	175984803	/nfs/dbraw/zinc/98/48/03/175984803.db2.gz	XDLMVKSNXKNMCV-DTWKUNHWSA-N	-1	0	265.269	2.045	10	5		CEBERM
O=C([O-])CCC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000071163830	176046913	/nfs/dbraw/zinc/04/69/13/176046913.db2.gz	ZVCNDKCDOBAHHM-UHFFFAOYSA-N	-1	0	262.221	2.124	10	5		CEBERM
CC(C)OCCOc1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070232020	519768896	/nfs/dbraw/zinc/76/88/96/519768896.db2.gz	OGPQZHSTQXPXNR-UHFFFAOYSA-N	-1	0	269.253	2.097	10	5		CEBERM
CCO[C@@H](CCOc1cccc([N+](=O)[O-])c1C)C(=O)[O-]	ZINC000062763741	520305058	/nfs/dbraw/zinc/30/50/58/520305058.db2.gz	DTIXESVURUJSSX-LBPRGKRZSA-N	-1	0	283.280	2.162	10	5		CEBERM
CCCCNC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000062823869	520645316	/nfs/dbraw/zinc/64/53/16/520645316.db2.gz	MGLPOVWJJGVBDZ-UHFFFAOYSA-N	-1	0	281.268	2.215	10	5		CEBERM
C[C@](Nc1ccc([N+](=O)[O-])nc1)(C(=O)[O-])c1ccccc1	ZINC000052879977	525155784	/nfs/dbraw/zinc/15/57/84/525155784.db2.gz	KXODCNPYMSSBGC-CQSZACIVSA-N	-1	0	287.275	2.402	10	5		CEBERM
Cc1cc(Sc2ccc([N+](=O)[O-])cc2C(=O)[O-])n(C)n1	ZINC000052308244	525441616	/nfs/dbraw/zinc/44/16/16/525441616.db2.gz	QLKJKQYNEHSYJL-UHFFFAOYSA-N	-1	0	293.304	2.486	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1Oc1cccnc1C(=O)[O-]	ZINC000052813306	525577835	/nfs/dbraw/zinc/57/78/35/525577835.db2.gz	GOXFAYFPEPQPLI-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
O=C([O-])[C@@]1(Cc2ccc([N+](=O)[O-])cc2Cl)CCOC1	ZINC000054634394	526295391	/nfs/dbraw/zinc/29/53/91/526295391.db2.gz	QCACCKCMCWLCAK-GFCCVEGCSA-N	-1	0	285.683	2.282	10	5		CEBERM
O=C([O-])[C@H](Nc1cc([N+](=O)[O-])ccn1)c1ccccc1	ZINC000050506739	526314049	/nfs/dbraw/zinc/31/40/49/526314049.db2.gz	OSWGUBWQZTUIBR-GFCCVEGCSA-N	-1	0	273.248	2.228	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1Cc1ccc(F)cc1F	ZINC000050885099	526356521	/nfs/dbraw/zinc/35/65/21/526356521.db2.gz	IYJMAXNOQYSLAK-UHFFFAOYSA-N	-1	0	282.202	2.421	10	5		CEBERM
O=C([O-])c1ncccc1COc1ccc([N+](=O)[O-])c(F)c1	ZINC000062764175	526408269	/nfs/dbraw/zinc/40/82/69/526408269.db2.gz	XTTXJNVVIBJWRH-UHFFFAOYSA-N	-1	0	292.222	2.406	10	5		CEBERM
O=C([O-])c1nn(Cc2ccc([N+](=O)[O-])o2)c2ccccc21	ZINC000069288193	526410575	/nfs/dbraw/zinc/41/05/75/526410575.db2.gz	OKUOILGTURVKBK-UHFFFAOYSA-N	-1	0	287.231	2.284	10	5		CEBERM
CCCc1nc2ccc([N+](=O)[O-])cc2c(C(=O)[O-])n1	ZINC000757121267	622765891	/nfs/dbraw/zinc/76/58/91/622765891.db2.gz	IGZFKHLGPUDOGO-UHFFFAOYSA-N	-1	0	261.237	2.189	10	5		CEBERM
Cc1c(CC(=O)[O-])ccc(Br)c1[N+](=O)[O-]	ZINC000396137158	344846229	/nfs/dbraw/zinc/84/62/29/344846229.db2.gz	NRRPIGKCWUSDJD-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@H]1Nc1ccccc1[N+](=O)[O-]	ZINC000085328514	179019001	/nfs/dbraw/zinc/01/90/01/179019001.db2.gz	WFYHYCLMMUTYBE-RKDXNWHRSA-N	-1	0	250.254	2.260	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000085328409	179019101	/nfs/dbraw/zinc/01/91/01/179019101.db2.gz	FBZOCEYDIPACNE-DTWKUNHWSA-N	-1	0	295.251	2.168	10	5		CEBERM
COc1cc(N[C@H]2CCC[C@@H]2C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000085328943	179019722	/nfs/dbraw/zinc/01/97/22/179019722.db2.gz	YFHJOEAJMZVIPK-CBAPKCEASA-N	-1	0	298.270	2.408	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCCC[C@H]1C(=O)[O-]	ZINC000085330576	179020645	/nfs/dbraw/zinc/02/06/45/179020645.db2.gz	MOWYRPZCAIZAIN-MNOVXSKESA-N	-1	0	279.296	2.354	10	5		CEBERM
Cc1ccc(NC(=O)[C@@H]2[C@@H](C(=O)[O-])C2(C)C)cc1[N+](=O)[O-]	ZINC000085406965	179054892	/nfs/dbraw/zinc/05/48/92/179054892.db2.gz	IASPRRKWUAIQTF-QWRGUYRKSA-N	-1	0	292.291	2.199	10	5		CEBERM
COc1cc(SC[C@H](C)C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000086111182	179233192	/nfs/dbraw/zinc/23/31/92/179233192.db2.gz	IIGAVJMTIZXJOD-ZETCQYMHSA-N	-1	0	271.294	2.416	10	5		CEBERM
C/C(=C\COc1cc(F)c([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000088629876	179644760	/nfs/dbraw/zinc/64/47/60/179644760.db2.gz	KVPXDURKKVNTCT-QHHAFSJGSA-N	-1	0	273.191	2.283	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCC[C@H]1C(=O)[O-]	ZINC000091555898	180190193	/nfs/dbraw/zinc/19/01/93/180190193.db2.gz	OXGRQCNOHNIGBN-NXEZZACHSA-N	-1	0	296.327	2.175	10	5		CEBERM
Cc1cc(N[C@@H]2CCC[C@@H](C(=O)[O-])C2)ncc1[N+](=O)[O-]	ZINC000092026453	180308335	/nfs/dbraw/zinc/30/83/35/180308335.db2.gz	BNQODXONLZIYPE-NXEZZACHSA-N	-1	0	279.296	2.354	10	5		CEBERM
CCN(CCC(=O)[O-])c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000110920418	186332023	/nfs/dbraw/zinc/33/20/23/186332023.db2.gz	LDLJINMOMVXLSO-UHFFFAOYSA-N	-1	0	286.259	2.044	10	5		CEBERM
O=C([O-])[C@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1	ZINC000111289613	186390823	/nfs/dbraw/zinc/39/08/23/186390823.db2.gz	KQBKXWDIKWAEBX-ZETCQYMHSA-N	-1	0	286.234	2.443	10	5		CEBERM
O=C([O-])[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1	ZINC000111289615	186391083	/nfs/dbraw/zinc/39/10/83/186391083.db2.gz	KQBKXWDIKWAEBX-SSDOTTSWSA-N	-1	0	286.234	2.443	10	5		CEBERM
O=C([O-])c1cccc(CCNc2ccc([N+](=O)[O-])nc2)c1	ZINC000111404159	186413951	/nfs/dbraw/zinc/41/39/51/186413951.db2.gz	KKOIQTWTJGXDLP-UHFFFAOYSA-N	-1	0	287.275	2.343	10	5		CEBERM
CCc1c(OC(F)F)ccc([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575659417	366319042	/nfs/dbraw/zinc/31/90/42/366319042.db2.gz	GJPHPELTFREORM-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CCc1cc(OC(F)F)c([N+](=O)[O-])cc1C(=O)[O-]	ZINC000575660556	366320263	/nfs/dbraw/zinc/32/02/63/366320263.db2.gz	YKHQOHOFDOKJDG-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1ccc(F)c([N+](=O)[O-])c1OC(F)F	ZINC000575661068	366321406	/nfs/dbraw/zinc/32/14/06/366321406.db2.gz	HURBPFMWHUWDBY-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])c1c(F)c(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000575709459	366339382	/nfs/dbraw/zinc/33/93/82/366339382.db2.gz	XHWBPAHTWQEVQB-UHFFFAOYSA-N	-1	0	253.107	2.451	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(Cl)cc([N+](=O)[O-])c1C(F)(F)F	ZINC000575694850	366331511	/nfs/dbraw/zinc/33/15/11/366331511.db2.gz	OJSQOUURIDOUJS-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)Cc1cc(F)cc([S-])c1[N+](=O)[O-]	ZINC000575701457	366334422	/nfs/dbraw/zinc/33/44/22/366334422.db2.gz	PAUQBVIBKICOQW-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
Cc1ccc(N2CCSC[C@@H]2CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000091130492	135067158	/nfs/dbraw/zinc/06/71/58/135067158.db2.gz	SQBBUOGIHMPRBN-JTQLQIEISA-N	-1	0	296.348	2.300	10	5		CEBERM
O=C([O-])Cc1cccc([N+](=O)[O-])c1OC(F)(F)F	ZINC000575345662	395660559	/nfs/dbraw/zinc/66/05/59/395660559.db2.gz	LRJJCTFDNDRVOR-UHFFFAOYSA-N	-1	0	265.143	2.121	10	5		CEBERM
Cc1nn(Cc2csc(C(=O)[O-])c2)c(C)c1[N+](=O)[O-]	ZINC000020312572	171144954	/nfs/dbraw/zinc/14/49/54/171144954.db2.gz	CJJSRKIRJFCVHN-UHFFFAOYSA-N	-1	0	281.293	2.216	10	5		CEBERM
CC[C@H](C)n1nc([N+](=O)[O-])c(Br)c1C(=O)[O-]	ZINC000020313924	171145603	/nfs/dbraw/zinc/14/56/03/171145603.db2.gz	ULBTWHXJQUBMRY-BYPYZUCNSA-N	-1	0	292.089	2.223	10	5		CEBERM
CC[C@@H](C)[C@H](NC(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)[O-]	ZINC000020362125	171161004	/nfs/dbraw/zinc/16/10/04/171161004.db2.gz	YLNPMBIUFXJKCY-PELKAZGASA-N	-1	0	294.307	2.132	10	5		CEBERM
Cc1nc2cc(N[C@@H](C)C(=O)[O-])c([N+](=O)[O-])cc2s1	ZINC000035407095	172177828	/nfs/dbraw/zinc/17/78/28/172177828.db2.gz	IWMSNTZARTYADD-YFKPBYRVSA-N	-1	0	281.293	2.398	10	5		CEBERM
CC[C@H](Nc1ccc2scnc2c1[N+](=O)[O-])C(=O)[O-]	ZINC000035411040	172182341	/nfs/dbraw/zinc/18/23/41/172182341.db2.gz	XXWVTVSGZSDCFZ-LURJTMIESA-N	-1	0	281.293	2.480	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1CS[C@@H](C)C(=O)[O-]	ZINC000037011369	172869051	/nfs/dbraw/zinc/86/90/51/172869051.db2.gz	XPAYCASBKLDTLA-ZETCQYMHSA-N	-1	0	271.294	2.310	10	5		CEBERM
O=C([O-])c1cccc(OCc2ccc([N+](=O)[O-])o2)c1	ZINC000037324057	173124910	/nfs/dbraw/zinc/12/49/10/173124910.db2.gz	HQKFKVQGNAOKQU-UHFFFAOYSA-N	-1	0	263.205	2.465	10	5		CEBERM
O=C([O-])c1cc(Oc2ccccc2[N+](=O)[O-])ccn1	ZINC000038080512	174090181	/nfs/dbraw/zinc/09/01/81/174090181.db2.gz	MQEVUFCKGKGONZ-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1Cc1ccccc1[N+](=O)[O-]	ZINC000041040462	174462968	/nfs/dbraw/zinc/46/29/68/174462968.db2.gz	CRJXIHXQFWPLSQ-UHFFFAOYSA-N	-1	0	291.219	2.051	10	5		CEBERM
O=C([O-])c1ccnc(Sc2ncccc2[N+](=O)[O-])c1	ZINC000041070859	174469981	/nfs/dbraw/zinc/46/99/81/174469981.db2.gz	VTANHVJBUBPOAG-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
Cc1c([N+](=O)[O-])cc(C(=O)[O-])cc1N1CCCC1	ZINC000043386666	175032552	/nfs/dbraw/zinc/03/25/52/175032552.db2.gz	MCHBIMPQDRQWIH-UHFFFAOYSA-N	-1	0	250.254	2.202	10	5		CEBERM
Cc1c(N(C)C(C)C)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386767	175032720	/nfs/dbraw/zinc/03/27/20/175032720.db2.gz	UNLYUTLUPJOYPN-UHFFFAOYSA-N	-1	0	252.270	2.446	10	5		CEBERM
C/C(C(=O)[O-])=C(\C)C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000071164616	176047661	/nfs/dbraw/zinc/04/76/61/176047661.db2.gz	DLKOGDYFLVBNDC-SREVYHEPSA-N	-1	0	282.227	2.093	10	5		CEBERM
C[C@@H](CCNc1ccc([N+](=O)[O-])cn1)CCC(=O)[O-]	ZINC000079066829	177426129	/nfs/dbraw/zinc/42/61/29/177426129.db2.gz	UNPNQKZQKSIBPH-SECBINFHSA-N	-1	0	267.285	2.293	10	5		CEBERM
Cc1ccc(N2CCC[C@@]2(C)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000079485215	177501947	/nfs/dbraw/zinc/50/19/47/177501947.db2.gz	QBUBLASZEFYSLX-ZDUSSCGKSA-N	-1	0	264.281	2.347	10	5		CEBERM
CCOc1cc(N2CCC[C@]2(C)C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000079485356	177502086	/nfs/dbraw/zinc/50/20/86/177502086.db2.gz	FVKBDZRFYMBFBG-CQSZACIVSA-N	-1	0	294.307	2.437	10	5		CEBERM
CC(C)Cc1nc(C(=O)[O-])nn1-c1ccc([N+](=O)[O-])cc1	ZINC000536958685	330383822	/nfs/dbraw/zinc/38/38/22/330383822.db2.gz	JXKPPOUGKRAQQJ-UHFFFAOYSA-N	-1	0	290.279	2.072	10	5		CEBERM
CCO[C@@H](COc1cc(Cl)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000062763104	520314541	/nfs/dbraw/zinc/31/45/41/520314541.db2.gz	UPUUPEXWXTXFIB-JTQLQIEISA-N	-1	0	289.671	2.117	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)C(C)(C)C(=O)[O-]	ZINC000061149051	520090824	/nfs/dbraw/zinc/09/08/24/520090824.db2.gz	PWSHEQOGEJBSBQ-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCCCOCCOc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000050517624	520792089	/nfs/dbraw/zinc/79/20/89/520792089.db2.gz	JMMYMDSVXJGTAU-UHFFFAOYSA-N	-1	0	283.280	2.489	10	5		CEBERM
COCC[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000052786326	521864125	/nfs/dbraw/zinc/86/41/25/521864125.db2.gz	YUQJSZDIEJELQU-SECBINFHSA-N	-1	0	288.687	2.150	10	5		CEBERM
COc1cc(C=O)c([N+](=O)[O-])cc1O[C@H](C)CCC(=O)[O-]	ZINC000050955351	522311791	/nfs/dbraw/zinc/31/17/91/522311791.db2.gz	OQIIDXNXSDXTPJ-MRVPVSSYSA-N	-1	0	297.263	2.048	10	5		CEBERM
CN(CCC(=O)[O-])Cc1c(Cl)cccc1[N+](=O)[O-]	ZINC000069051932	522687030	/nfs/dbraw/zinc/68/70/30/522687030.db2.gz	XCGQGIORIABGKX-UHFFFAOYSA-N	-1	0	272.688	2.155	10	5		CEBERM
C[C@H](CCC(=O)[O-])Oc1ccc(F)cc1[N+](=O)[O-]	ZINC000052064572	524121919	/nfs/dbraw/zinc/12/19/19/524121919.db2.gz	HBLSWMXKBRJAMM-SSDOTTSWSA-N	-1	0	257.217	2.366	10	5		CEBERM
C[C@H]1CCN(c2cc(C(=O)[O-])c([N+](=O)[O-])cc2F)C1	ZINC000050030674	524305497	/nfs/dbraw/zinc/30/54/97/524305497.db2.gz	GDPYCDQHXWPUDT-ZETCQYMHSA-N	-1	0	268.244	2.278	10	5		CEBERM
Cc1cc(C)c(OC[C@@H]2CC[C@@H](C(=O)[O-])O2)c([N+](=O)[O-])c1	ZINC000051393957	524312334	/nfs/dbraw/zinc/31/23/34/524312334.db2.gz	CEBNUZQHNALIME-JQWIXIFHSA-N	-1	0	295.291	2.223	10	5		CEBERM
C[C@@H](CC(=O)[O-])CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000061835745	524392115	/nfs/dbraw/zinc/39/21/15/524392115.db2.gz	SCEOTHORGIQSBR-MRVPVSSYSA-N	-1	0	266.253	2.034	10	5		CEBERM
C[C@@H](CCC(=O)[O-])Oc1ccc([N+](=O)[O-])cc1F	ZINC000050955330	524443656	/nfs/dbraw/zinc/44/36/56/524443656.db2.gz	FEBRJBIZEKFJNU-ZETCQYMHSA-N	-1	0	257.217	2.366	10	5		CEBERM
Cc1ccc(N(C)CCCC(=O)[O-])cc1[N+](=O)[O-]	ZINC000061700541	524886225	/nfs/dbraw/zinc/88/62/25/524886225.db2.gz	PWBQFLPUNVBMIN-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1O[C@@H](C)CCC(=O)[O-]	ZINC000050954782	525473327	/nfs/dbraw/zinc/47/33/27/525473327.db2.gz	CGUNQDGANCMTPU-QMMMGPOBSA-N	-1	0	269.253	2.236	10	5		CEBERM
C[C@H](CC(=O)[O-])CC(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000061834891	526251192	/nfs/dbraw/zinc/25/11/92/526251192.db2.gz	NEOPNQYVRDYKIO-ZETCQYMHSA-N	-1	0	284.243	2.173	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1NCCc1ccncc1	ZINC000070232406	526384211	/nfs/dbraw/zinc/38/42/11/526384211.db2.gz	FKYYQFZOHOSIST-UHFFFAOYSA-N	-1	0	287.275	2.343	10	5		CEBERM
O=C([O-])C1(CCc2ccccc2[N+](=O)[O-])CCOCC1	ZINC000062727089	527554803	/nfs/dbraw/zinc/55/48/03/527554803.db2.gz	PDIBCYULFKXOMF-UHFFFAOYSA-N	-1	0	279.292	2.409	10	5		CEBERM
O=C([O-])CC[C@@H]1CCCCN1c1ccc([N+](=O)[O-])cn1	ZINC000050923598	527596443	/nfs/dbraw/zinc/59/64/43/527596443.db2.gz	VKMXAJBLWGHAAG-JTQLQIEISA-N	-1	0	279.296	2.214	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc([N+](=O)[O-])c2ncccc12)C1CC1	ZINC000054521908	527655522	/nfs/dbraw/zinc/65/55/22/527655522.db2.gz	YZCITDADCCZPBF-LBPRGKRZSA-N	-1	0	287.275	2.418	10	5		CEBERM
CCC[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000233297379	641312644	/nfs/dbraw/zinc/31/26/44/641312644.db2.gz	XFJZVOWHPRMSKU-MRVPVSSYSA-N	-1	0	273.676	2.308	10	5		CEBERM
O=C([O-])[C@H]1Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@@H]12	ZINC000005347438	136394441	/nfs/dbraw/zinc/39/44/41/136394441.db2.gz	RIKMSJBWDDECKT-AAEUAGOBSA-N	-1	0	276.292	2.211	10	5		CEBERM
COc1cc(N[C@](C)(C(=O)[O-])C2CC2)ccc1[N+](=O)[O-]	ZINC000084096415	178787926	/nfs/dbraw/zinc/78/79/26/178787926.db2.gz	BRDIQNNYAQXSSD-ZDUSSCGKSA-N	-1	0	280.280	2.269	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@@H]1Nc1ccncc1[N+](=O)[O-]	ZINC000085330313	179020225	/nfs/dbraw/zinc/02/02/25/179020225.db2.gz	BUEJAQBQQOEJDI-IUCAKERBSA-N	-1	0	265.269	2.045	10	5		CEBERM
Cc1ccnc(N[C@H]2CCCC[C@@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000085329842	179020328	/nfs/dbraw/zinc/02/03/28/179020328.db2.gz	LLWYYQQLKJJVPS-UWVGGRQHSA-N	-1	0	279.296	2.354	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@H]1CNc1ncccc1[N+](=O)[O-]	ZINC000089382058	179776008	/nfs/dbraw/zinc/77/60/08/179776008.db2.gz	BMSGFQQGOZPTOA-VHSXEESVSA-N	-1	0	279.296	2.293	10	5		CEBERM
COCCCSc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000104432948	186000060	/nfs/dbraw/zinc/00/00/60/186000060.db2.gz	SUIJGVKYKHBWCL-UHFFFAOYSA-N	-1	0	271.294	2.422	10	5		CEBERM
Cc1cnc(N[C@H]2CCCC[C@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691783	180024596	/nfs/dbraw/zinc/02/45/96/180024596.db2.gz	OFNZILNPZPCISF-ZJUUUORDSA-N	-1	0	279.296	2.354	10	5		CEBERM
O=C([O-])c1cncc(Sc2ccc([N+](=O)[O-])cc2)n1	ZINC000091433416	180154576	/nfs/dbraw/zinc/15/45/76/180154576.db2.gz	MBODWFDOCZTCCI-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
CCCc1nn(C)c(SC[C@H](C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091560157	180191422	/nfs/dbraw/zinc/19/14/22/180191422.db2.gz	FPZWCGCLCBVLDM-ZETCQYMHSA-N	-1	0	287.341	2.094	10	5		CEBERM
CCCc1nn(C)c(NC[C@@H](CCC)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091560774	180192014	/nfs/dbraw/zinc/19/20/14/180192014.db2.gz	MPFDFEGQCBHSJY-SECBINFHSA-N	-1	0	298.343	2.194	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCCC[C@H]1C(=O)[O-]	ZINC000091549544	180189054	/nfs/dbraw/zinc/18/90/54/180189054.db2.gz	XJJRRCMBPAKJPW-ZJUUUORDSA-N	-1	0	296.327	2.175	10	5		CEBERM
Cc1cc(NCc2nc(C(=O)[O-])cs2)ncc1[N+](=O)[O-]	ZINC000092026580	180308464	/nfs/dbraw/zinc/30/84/64/180308464.db2.gz	WFLDWLQKQGBRRI-UHFFFAOYSA-N	-1	0	294.292	2.065	10	5		CEBERM
COc1ccc(N[C@@H]2C=C[C@@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000092183565	180339644	/nfs/dbraw/zinc/33/96/44/180339644.db2.gz	KPCHXVJGASUVAI-RKDXNWHRSA-N	-1	0	278.264	2.045	10	5		CEBERM
O=C([O-])CN(CC(F)(F)F)c1ccc(F)cc1[N+](=O)[O-]	ZINC000092436560	180385010	/nfs/dbraw/zinc/38/50/10/180385010.db2.gz	HBCYVJIGNNPBOO-UHFFFAOYSA-N	-1	0	296.176	2.187	10	5		CEBERM
CCCc1c([O-])nc(-c2ccccc2[N+](=O)[O-])[nH]c1=O	ZINC000110620069	186304951	/nfs/dbraw/zinc/30/49/51/186304951.db2.gz	BWQAGIMLDJLURD-UHFFFAOYSA-N	-1	0	275.264	2.003	10	5		CEBERM
COc1cc(N(CC(=O)[O-])C(C)C)c([N+](=O)[O-])cc1F	ZINC000110624843	186306274	/nfs/dbraw/zinc/30/62/74/186306274.db2.gz	HFRBBIKGIVJDES-UHFFFAOYSA-N	-1	0	286.259	2.042	10	5		CEBERM
C/C(=C\C(=O)[O-])COc1cccc(C)c1[N+](=O)[O-]	ZINC000111457074	186419763	/nfs/dbraw/zinc/41/97/63/186419763.db2.gz	KCSVNFPLFSPCKZ-SOFGYWHQSA-N	-1	0	251.238	2.313	10	5		CEBERM
O=C([O-])/C=C/c1cc(Br)cc([N+](=O)[O-])c1	ZINC000253575934	304023670	/nfs/dbraw/zinc/02/36/70/304023670.db2.gz	VFHFOLQJHIBGKM-OWOJBTEDSA-N	-1	0	272.054	2.455	10	5		CEBERM
CCC[C@H]1C[C@H]1NC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000075559984	363474706	/nfs/dbraw/zinc/47/47/06/363474706.db2.gz	UADOBWAXYUIPGQ-WCBMZHEXSA-N	-1	0	264.281	2.219	10	5		CEBERM
Cc1c(CC(=O)[O-])cc(OC(F)F)cc1[N+](=O)[O-]	ZINC000575667448	366323608	/nfs/dbraw/zinc/32/36/08/366323608.db2.gz	NFVHHKDRJXVSQP-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
Cc1cc([N+](=O)[O-])cc(OC(F)(F)F)c1CC(=O)[O-]	ZINC000575673431	366323704	/nfs/dbraw/zinc/32/37/04/366323704.db2.gz	JYEXRULTXHBSHR-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
CCc1c(CC(=O)[O-])ccc(OC(F)F)c1[N+](=O)[O-]	ZINC000575658326	366317894	/nfs/dbraw/zinc/31/78/94/366317894.db2.gz	AVVQAKSZDBWUAA-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CCOc1c([N+](=O)[O-])ccc(C(=O)[O-])c1OC(F)F	ZINC000575658713	366318824	/nfs/dbraw/zinc/31/88/24/366318824.db2.gz	VEQPDZFVUZERET-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
COc1cc([N+](=O)[O-])cc(OC(F)F)c1[S-]	ZINC000575665034	366322313	/nfs/dbraw/zinc/32/23/13/366322313.db2.gz	NPRMAAABMFJCCQ-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
CC(=O)c1c(Br)ccc([O-])c1[N+](=O)[O-]	ZINC000575691110	366329779	/nfs/dbraw/zinc/32/97/79/366329779.db2.gz	HKYALXMYONDQBT-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CCOC(=O)Cc1ccc([N+](=O)[O-])c(F)c1[S-]	ZINC000575701489	366333811	/nfs/dbraw/zinc/33/38/11/366333811.db2.gz	QIXSXKRASUYBSB-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
CCC[C@@H]1C[C@@H]1NC(=O)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000300583213	379175353	/nfs/dbraw/zinc/17/53/53/379175353.db2.gz	LPVTZSQKAPNSPL-KCJUWKMLSA-N	-1	0	264.281	2.219	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N1CCSC[C@@H]1CC(=O)[O-]	ZINC000091130504	135067317	/nfs/dbraw/zinc/06/73/17/135067317.db2.gz	UCMJAVWWPOUTDN-NSHDSACASA-N	-1	0	296.348	2.300	10	5		CEBERM
CC(C)[C@@H](Oc1cc(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000019410055	170789083	/nfs/dbraw/zinc/78/90/83/170789083.db2.gz	IBWPDDUKRCKOLB-SNVBAGLBSA-N	-1	0	257.217	2.222	10	5		CEBERM
O=C([O-])[C@H](Nc1ncccc1[N+](=O)[O-])c1ccccc1	ZINC000019754067	170854265	/nfs/dbraw/zinc/85/42/65/170854265.db2.gz	XGBOWJAWSKAYEQ-LLVKDONJSA-N	-1	0	273.248	2.228	10	5		CEBERM
CC(C)Oc1ccc(/C=C/C(=O)[O-])cc1[N+](=O)[O-]	ZINC000020576475	171255868	/nfs/dbraw/zinc/25/58/68/171255868.db2.gz	TVFYRTKDJUUGHR-GQCTYLIASA-N	-1	0	251.238	2.480	10	5		CEBERM
Nc1cccc2c(=O)c3cccc(CC(=O)[O-])c3oc12	ZINC000028770123	171574618	/nfs/dbraw/zinc/57/46/18/171574618.db2.gz	SUYGVIKHDPFFMO-UHFFFAOYSA-N	-1	0	269.256	2.156	10	5		CEBERM
C[C@H](Nc1ccc2scnc2c1[N+](=O)[O-])C(=O)[O-]	ZINC000035407086	172177611	/nfs/dbraw/zinc/17/76/11/172177611.db2.gz	RUZZKHOENVWKIG-YFKPBYRVSA-N	-1	0	267.266	2.090	10	5		CEBERM
CCN(CCC(=O)[O-])c1cc(F)cc([N+](=O)[O-])c1	ZINC000038023840	174006130	/nfs/dbraw/zinc/00/61/30/174006130.db2.gz	OTYMXTRIBXOJRO-UHFFFAOYSA-N	-1	0	256.233	2.035	10	5		CEBERM
NN=c1[n-]cnc(Oc2cccc3cccnc32)c1[N+](=O)[O-]	ZINC000040618475	174354103	/nfs/dbraw/zinc/35/41/03/174354103.db2.gz	NZCRNVBHLWUWCM-UHFFFAOYSA-N	-1	0	298.262	2.011	10	5		CEBERM
Cc1nn(-c2ccc(C)cc2[N+](=O)[O-])c(C)c1C(=O)[O-]	ZINC000043299317	174999982	/nfs/dbraw/zinc/99/99/82/174999982.db2.gz	KXEJPJOVNRLLTI-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
Cc1c(NC[C@@H]2CCCO2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386807	175032673	/nfs/dbraw/zinc/03/26/73/175032673.db2.gz	GKQQUNWQZOGYOI-JTQLQIEISA-N	-1	0	280.280	2.192	10	5		CEBERM
C/C(C(=O)[O-])=C(\C)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000071164617	176047514	/nfs/dbraw/zinc/04/75/14/176047514.db2.gz	JRSYROFATVETEV-SREVYHEPSA-N	-1	0	282.227	2.093	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(Oc2cnc(C(=O)[O-])cn2)c1	ZINC000071182458	176057578	/nfs/dbraw/zinc/05/75/78/176057578.db2.gz	HTTBJFVZICCQDL-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
Cc1c(C(=O)[O-])cnn1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000080045416	177601473	/nfs/dbraw/zinc/60/14/73/177601473.db2.gz	QJUHQZAEOBHMDA-UHFFFAOYSA-N	-1	0	295.682	2.500	10	5		CEBERM
Cc1ccc(N[C@@H](C(=O)[O-])C(C)C)c([N+](=O)[O-])c1	ZINC000037453247	301649536	/nfs/dbraw/zinc/64/95/36/301649536.db2.gz	MTOUUACUQSKWSS-LLVKDONJSA-N	-1	0	252.270	2.424	10	5		CEBERM
CC(C)CN(CC(=O)[O-])c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000062742577	519712193	/nfs/dbraw/zinc/71/21/93/519712193.db2.gz	POFHGLMVJOCVTL-UHFFFAOYSA-N	-1	0	297.267	2.050	10	5		CEBERM
CC(C)Oc1cc(/C=C/C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000050518173	519777633	/nfs/dbraw/zinc/77/76/33/519777633.db2.gz	ITMASZJEOQDUSH-GQCTYLIASA-N	-1	0	251.238	2.480	10	5		CEBERM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000068688771	520649029	/nfs/dbraw/zinc/64/90/29/520649029.db2.gz	JHWCLEVLBDGFQP-ZJUUUORDSA-N	-1	0	296.254	2.029	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000061216795	521195685	/nfs/dbraw/zinc/19/56/85/521195685.db2.gz	XEKVDFOOKAOZCP-SECBINFHSA-N	-1	0	295.295	2.169	10	5		CEBERM
CCN(c1ccc(F)cc1[N+](=O)[O-])[C@H](C)CC(=O)[O-]	ZINC000061182094	521488708	/nfs/dbraw/zinc/48/87/08/521488708.db2.gz	AEQYTMRROOAGOB-MRVPVSSYSA-N	-1	0	270.260	2.423	10	5		CEBERM
CCOc1oc(-c2cccc([N+](=O)[O-])c2)nc1C(=O)[O-]	ZINC000061641453	521630072	/nfs/dbraw/zinc/63/00/72/521630072.db2.gz	SLMINFQKIIYJEY-UHFFFAOYSA-N	-1	0	278.220	2.347	10	5		CEBERM
Cc1cccc(OCc2cc(C(=O)[O-])no2)c1[N+](=O)[O-]	ZINC000048804990	524765910	/nfs/dbraw/zinc/76/59/10/524765910.db2.gz	SPLPKMMOBLFFCZ-UHFFFAOYSA-N	-1	0	278.220	2.168	10	5		CEBERM
COc1ccc(Oc2cccc(C(=O)[O-])n2)c([N+](=O)[O-])c1	ZINC000051041660	524994317	/nfs/dbraw/zinc/99/43/17/524994317.db2.gz	ZJYYTYRMEYZAFM-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N(CC(=O)[O-])CC(C)C	ZINC000062742691	525567089	/nfs/dbraw/zinc/56/70/89/525567089.db2.gz	UFDDZXODUTUAJA-UHFFFAOYSA-N	-1	0	266.297	2.450	10	5		CEBERM
C[C@H](C(=O)[O-])N(C)c1ccc([N+](=O)[O-])cc1Cl	ZINC000054054640	526180307	/nfs/dbraw/zinc/18/03/07/526180307.db2.gz	NUCHRJSSJHPKTM-ZCFIWIBFSA-N	-1	0	258.661	2.158	10	5		CEBERM
O=C([O-])[C@@]1(Cc2ccc(Cl)cc2[N+](=O)[O-])CCOC1	ZINC000054634409	526295042	/nfs/dbraw/zinc/29/50/42/526295042.db2.gz	SCGHFZHCAIYRJX-GFCCVEGCSA-N	-1	0	285.683	2.282	10	5		CEBERM
O=C([O-])c1ccc(-n2ncc3ccc([N+](=O)[O-])cc32)o1	ZINC000050907371	526359376	/nfs/dbraw/zinc/35/93/76/526359376.db2.gz	NIFALCQIQYMAQG-UHFFFAOYSA-N	-1	0	273.204	2.225	10	5		CEBERM
O=C([O-])c1ccc(Oc2ncccc2[N+](=O)[O-])cc1	ZINC000048802082	526381668	/nfs/dbraw/zinc/38/16/68/526381668.db2.gz	IFXKPICWQFUMIU-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
O=C([O-])CC(=O)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000050918837	527567582	/nfs/dbraw/zinc/56/75/82/527567582.db2.gz	CWIKLNNCPZFUGR-UHFFFAOYSA-N	-1	0	292.169	2.027	10	5		CEBERM
Cc1cccc(N2C[C@@H](C)[C@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000235369988	344590256	/nfs/dbraw/zinc/59/02/56/344590256.db2.gz	KXHVKSBJXLSGNL-NXEZZACHSA-N	-1	0	264.281	2.060	10	5		CEBERM
O=Cc1c2cc([N+](=O)[O-])ccc2n(C2CC2)c1C(=O)[O-]	ZINC000584880188	344995693	/nfs/dbraw/zinc/99/56/93/344995693.db2.gz	GJGCMKUSPBENKJ-UHFFFAOYSA-N	-1	0	274.232	2.395	10	5		CEBERM
Cc1nn(C(C)C)c(N[C@H]2CC[C@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000097128067	185542377	/nfs/dbraw/zinc/54/23/77/185542377.db2.gz	GFEBRKAFAQKJCU-UWVGGRQHSA-N	-1	0	296.327	2.346	10	5		CEBERM
CC[C@H](NC(=O)c1ccc([N+](=O)[O-])c([O-])c1)C(C)C	ZINC000062226152	362714666	/nfs/dbraw/zinc/71/46/66/362714666.db2.gz	VLOQMJOJYFGDBB-JTQLQIEISA-N	-1	0	266.297	2.465	10	5		CEBERM
O=C([O-])c1ccc(NC[C@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000086016873	179216671	/nfs/dbraw/zinc/21/66/71/179216671.db2.gz	LOLNHPKHBXIJBD-ZWNOBZJWSA-N	-1	0	294.307	2.256	10	5		CEBERM
COC[C@@H](Nc1ccc([N+](=O)[O-])cc1C(=O)[O-])C(C)C	ZINC000086702750	179321372	/nfs/dbraw/zinc/32/13/72/179321372.db2.gz	NPUDBPKUYDDHQN-GFCCVEGCSA-N	-1	0	282.296	2.376	10	5		CEBERM
CC/C(=C\COc1cc([N+](=O)[O-])ccc1OC)C(=O)[O-]	ZINC000089074762	179697004	/nfs/dbraw/zinc/69/70/04/179697004.db2.gz	YDGBQVJKXDUTSA-RMKNXTFCSA-N	-1	0	281.264	2.403	10	5		CEBERM
O=C([O-])c1cc(NC[C@@H]2CCC[C@@H]2CO)ccc1[N+](=O)[O-]	ZINC000089502176	179805365	/nfs/dbraw/zinc/80/53/65/179805365.db2.gz	GXWMSVIMELOJID-VHSXEESVSA-N	-1	0	294.307	2.114	10	5		CEBERM
O=c1[n-]c(-c2ccccc2[N+](=O)[O-])ncc1Br	ZINC000090747542	180035717	/nfs/dbraw/zinc/03/57/17/180035717.db2.gz	DYAGQCYDJGWAMJ-UHFFFAOYSA-N	-1	0	296.080	2.108	10	5		CEBERM
C[C@@H](Nc1ccc([N+](=O)[O-])nc1)c1nc(C(=O)[O-])cs1	ZINC000090943011	180069029	/nfs/dbraw/zinc/06/90/29/180069029.db2.gz	DYXXYNMXNDHPLW-ZCFIWIBFSA-N	-1	0	294.292	2.318	10	5		CEBERM
O=C([O-])c1csc(CCNc2cccc([N+](=O)[O-])c2)n1	ZINC000090943934	180069580	/nfs/dbraw/zinc/06/95/80/180069580.db2.gz	ICOLZVBSHBBCII-UHFFFAOYSA-N	-1	0	293.304	2.404	10	5		CEBERM
Cc1c(S[C@@H](C)CCO)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000091261735	180115900	/nfs/dbraw/zinc/11/59/00/180115900.db2.gz	HGFQHIVFPFZJPE-ZETCQYMHSA-N	-1	0	285.321	2.464	10	5		CEBERM
C[C@H](CCO)Sc1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000091261768	180115923	/nfs/dbraw/zinc/11/59/23/180115923.db2.gz	GZERIMVWIXSUQA-SSDOTTSWSA-N	-1	0	271.294	2.156	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1NC(C)(C)CC(=O)[O-]	ZINC000091555892	180190481	/nfs/dbraw/zinc/19/04/81/180190481.db2.gz	SYDASERDPBWZDA-UHFFFAOYSA-N	-1	0	284.316	2.175	10	5		CEBERM
CC(C)c1nn(C)c(N[C@@H]2CCC[C@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000091584423	180199390	/nfs/dbraw/zinc/19/93/90/180199390.db2.gz	ATCWXTZRSZQMDU-RKDXNWHRSA-N	-1	0	296.327	2.117	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1NC1(C(=O)[O-])CCCCC1	ZINC000091550014	180188976	/nfs/dbraw/zinc/18/89/76/180188976.db2.gz	PVQCRXJYXNXMIG-UHFFFAOYSA-N	-1	0	296.327	2.319	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1NC1(C(=O)[O-])CCCC1	ZINC000091554837	180189579	/nfs/dbraw/zinc/18/95/79/180189579.db2.gz	IKCYVVKGAHGOEZ-UHFFFAOYSA-N	-1	0	296.327	2.319	10	5		CEBERM
Cc1cc(N(CC(=O)[O-])C2CCCC2)ncc1[N+](=O)[O-]	ZINC000092026360	180308809	/nfs/dbraw/zinc/30/88/09/180308809.db2.gz	QDPBVARYBJZQTC-UHFFFAOYSA-N	-1	0	279.296	2.132	10	5		CEBERM
C[C@H]1CN(c2ccc(C(=O)[O-])cc2[N+](=O)[O-])C[C@@H]1C	ZINC000092085931	180320864	/nfs/dbraw/zinc/32/08/64/180320864.db2.gz	QQRDITCBZLKJQF-IUCAKERBSA-N	-1	0	264.281	2.385	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@H](Nc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000092182803	180339255	/nfs/dbraw/zinc/33/92/55/180339255.db2.gz	GYBAYRKGGVXWLH-CBAPKCEASA-N	-1	0	266.228	2.175	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@@H](Nc2cccc(F)c2[N+](=O)[O-])C1	ZINC000092183845	180339857	/nfs/dbraw/zinc/33/98/57/180339857.db2.gz	ZXBUIDVOGCHCHD-HTQZYQBOSA-N	-1	0	266.228	2.175	10	5		CEBERM
O=C([O-])c1cn(-c2ccc3scnc3c2[N+](=O)[O-])cn1	ZINC000109476429	186254731	/nfs/dbraw/zinc/25/47/31/186254731.db2.gz	MWOLUUAQSSKTMS-UHFFFAOYSA-N	-1	0	290.260	2.088	10	5		CEBERM
O=C([O-])CCCOc1cc(F)c([N+](=O)[O-])cc1F	ZINC000110622877	186306429	/nfs/dbraw/zinc/30/64/29/186306429.db2.gz	MRASVVAYUDXOFP-UHFFFAOYSA-N	-1	0	261.180	2.117	10	5		CEBERM
Cc1cc(C(F)(F)F)cc([N+](=O)[O-])c1[C@@H](O)C(=O)[O-]	ZINC000575673799	366324776	/nfs/dbraw/zinc/32/47/76/366324776.db2.gz	NTOFXYXILUZNGF-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCc1cc(OC(F)F)cc(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575659401	366319010	/nfs/dbraw/zinc/31/90/10/366319010.db2.gz	GHXHAXZZCYQXSG-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])c(OC(F)F)cc1F	ZINC000575661713	366321063	/nfs/dbraw/zinc/32/10/63/366321063.db2.gz	VFCAQOKQMXCAEL-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])c1cc(OC(F)F)cc([N+](=O)[O-])c1F	ZINC000575661031	366321494	/nfs/dbraw/zinc/32/14/94/366321494.db2.gz	GGHOPHXLRWGJGI-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(C(F)(F)F)c1F	ZINC000575708384	366338710	/nfs/dbraw/zinc/33/87/10/366338710.db2.gz	JSZSKGRIKTUDOO-UHFFFAOYSA-N	-1	0	253.107	2.451	10	5		CEBERM
O=C([O-])c1cc(OC(F)(F)F)c(F)c([N+](=O)[O-])c1	ZINC000575711336	366339697	/nfs/dbraw/zinc/33/96/97/366339697.db2.gz	RJOXZZZXVFKLJK-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
O=C([O-])c1cc(OC(F)(F)F)c(F)cc1[N+](=O)[O-]	ZINC000575711695	366340100	/nfs/dbraw/zinc/34/01/00/366340100.db2.gz	VPGSFBMOGGRWCX-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575694757	366331680	/nfs/dbraw/zinc/33/16/80/366331680.db2.gz	MWANTOZDAYNIJL-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOc1cc(CC(=O)[O-])cc(CC)c1[N+](=O)[O-]	ZINC000575697435	366332253	/nfs/dbraw/zinc/33/22/53/366332253.db2.gz	WIQXNQRATUHIOR-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
CCOC(=O)c1c([O-])ccc([N+](=O)[O-])c1Br	ZINC000575699295	366332667	/nfs/dbraw/zinc/33/26/67/366332667.db2.gz	GZDXRRQBOYLGCF-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
O=C([O-])Cc1c(OC(F)(F)F)cccc1[N+](=O)[O-]	ZINC000575345686	395660584	/nfs/dbraw/zinc/66/05/84/395660584.db2.gz	OAORJXRQJPCUMQ-UHFFFAOYSA-N	-1	0	265.143	2.121	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000005584089	170116154	/nfs/dbraw/zinc/11/61/54/170116154.db2.gz	LKPLYMRJMSBEIO-VHSXEESVSA-N	-1	0	292.291	2.424	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1OC[C@@H]1CCCCO1	ZINC000019276564	170769611	/nfs/dbraw/zinc/76/96/11/170769611.db2.gz	KPSUMMHCMZLEFG-JTQLQIEISA-N	-1	0	281.264	2.241	10	5		CEBERM
O=C([O-])c1cnn(-c2cccc([N+](=O)[O-])c2)c1C1CC1	ZINC000020440171	171204109	/nfs/dbraw/zinc/20/41/09/171204109.db2.gz	RELLYXBDYQFXNX-UHFFFAOYSA-N	-1	0	273.248	2.356	10	5		CEBERM
O=C([O-])CCCCn1ncc2ccc([N+](=O)[O-])cc21	ZINC000020474402	171218781	/nfs/dbraw/zinc/21/87/81/171218781.db2.gz	HFADZUBGVOXBOY-UHFFFAOYSA-N	-1	0	263.253	2.199	10	5		CEBERM
O=C([O-])/C=C/c1ccc(OCC2CC2)c([N+](=O)[O-])c1	ZINC000020576092	171255895	/nfs/dbraw/zinc/25/58/95/171255895.db2.gz	GOBVRMPGCPFENB-GQCTYLIASA-N	-1	0	263.249	2.481	10	5		CEBERM
C[C@@H](Nc1ccc([N+](=O)[O-])c2ncccc12)C(=O)[O-]	ZINC000035407111	172178031	/nfs/dbraw/zinc/17/80/31/172178031.db2.gz	JSEZDKORLMYGJB-SSDOTTSWSA-N	-1	0	261.237	2.028	10	5		CEBERM
CCC[C@@](C)(Nc1ccc([N+](=O)[O-])nc1)C(=O)[O-]	ZINC000036807721	172722310	/nfs/dbraw/zinc/72/23/10/172722310.db2.gz	UQHJOXSZLQCWGM-LLVKDONJSA-N	-1	0	253.258	2.045	10	5		CEBERM
CC(C)N(CCC(=O)[O-])c1cccc([N+](=O)[O-])c1	ZINC000037592926	173541376	/nfs/dbraw/zinc/54/13/76/173541376.db2.gz	SSUWUNZYZXZWIO-UHFFFAOYSA-N	-1	0	252.270	2.284	10	5		CEBERM
CCN(CCC(=O)[O-])c1ccc(C)cc1[N+](=O)[O-]	ZINC000038024084	174006339	/nfs/dbraw/zinc/00/63/39/174006339.db2.gz	OXKOXEXBXDYUTN-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
COC(=O)Sc1nc2c(cccc2[N+](=O)[O-])[n-]1	ZINC000038869870	174158017	/nfs/dbraw/zinc/15/80/17/174158017.db2.gz	GHMJYQUNXOSEAO-UHFFFAOYSA-N	-1	0	253.239	2.330	10	5		CEBERM
Cc1cccc([N-]c2ncnc(Cl)c2[N+](=O)[O-])n1	ZINC000040571125	174338291	/nfs/dbraw/zinc/33/82/91/174338291.db2.gz	VKPVICJXKCZLAP-UHFFFAOYSA-N	-1	0	265.660	2.485	10	5		CEBERM
Nc1ncnc([N-]c2nc3ccccc3s2)c1[N+](=O)[O-]	ZINC000040608698	174353484	/nfs/dbraw/zinc/35/34/84/174353484.db2.gz	JXUZAIIQKDJFKK-UHFFFAOYSA-N	-1	0	288.292	2.320	10	5		CEBERM
CC(C)Oc1ncnc([N-]c2ccccn2)c1[N+](=O)[O-]	ZINC000040646858	174364862	/nfs/dbraw/zinc/36/48/62/174364862.db2.gz	QACYUURUQCRYAU-UHFFFAOYSA-N	-1	0	275.268	2.311	10	5		CEBERM
C[C@H]1CCC[C@](Nc2ccc([N+](=O)[O-])nc2)(C(=O)[O-])C1	ZINC000041035183	174458425	/nfs/dbraw/zinc/45/84/25/174458425.db2.gz	JSUMDFVUTOJHSM-TVQRCGJNSA-N	-1	0	279.296	2.435	10	5		CEBERM
CCOCCOc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043386565	175032709	/nfs/dbraw/zinc/03/27/09/175032709.db2.gz	KJYOTIOTAUSHPI-UHFFFAOYSA-N	-1	0	269.253	2.017	10	5		CEBERM
CCCc1nccn1-c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000070989581	176019234	/nfs/dbraw/zinc/01/92/34/176019234.db2.gz	MIMNKKWQSULIGN-UHFFFAOYSA-N	-1	0	275.264	2.431	10	5		CEBERM
O=C([O-])CCCCC[S@@](=O)c1ccc([N+](=O)[O-])cc1	ZINC000071291876	176110716	/nfs/dbraw/zinc/11/07/16/176110716.db2.gz	NVZGOOMDQKSAPU-IBGZPJMESA-N	-1	0	285.321	2.347	10	5		CEBERM
O=[N+]([O-])c1cc(-c2n[nH]c(-c3ccccn3)n2)ccc1[O-]	ZINC000072237686	176346393	/nfs/dbraw/zinc/34/63/93/176346393.db2.gz	YVZSTJFIEYAFLJ-UHFFFAOYSA-N	-1	0	283.247	2.148	10	5		CEBERM
CC(C)CN(CC(=O)[O-])c1c(F)c(F)ccc1[N+](=O)[O-]	ZINC000062742592	519712228	/nfs/dbraw/zinc/71/22/28/519712228.db2.gz	OCAOHCCEIVLQKQ-UHFFFAOYSA-N	-1	0	288.250	2.420	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1ccc([N+](=O)[O-])cc1	ZINC000061217540	521200272	/nfs/dbraw/zinc/20/02/72/521200272.db2.gz	BUBMBGONUPZAOD-SECBINFHSA-N	-1	0	252.270	2.142	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N(CC(=O)[O-])C1CCCC1	ZINC000052812061	525574250	/nfs/dbraw/zinc/57/42/50/525574250.db2.gz	HAMVWUHEYBRXEN-UHFFFAOYSA-N	-1	0	279.296	2.132	10	5		CEBERM
COc1cccc(C(=O)[O-])c1OCc1ccc([N+](=O)[O-])o1	ZINC000048762968	525838079	/nfs/dbraw/zinc/83/80/79/525838079.db2.gz	LOTLRVJVMIAUHZ-UHFFFAOYSA-N	-1	0	293.231	2.474	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N(C)C(C)(C)C(=O)[O-]	ZINC000061171123	526076909	/nfs/dbraw/zinc/07/69/09/526076909.db2.gz	BZHBINORJRMKAU-UHFFFAOYSA-N	-1	0	252.270	2.203	10	5		CEBERM
O=C([O-])c1ncccc1COc1cc(F)ccc1[N+](=O)[O-]	ZINC000062763485	526408404	/nfs/dbraw/zinc/40/84/04/526408404.db2.gz	VRCJLQUTXRPUDK-UHFFFAOYSA-N	-1	0	292.222	2.406	10	5		CEBERM
O=C([O-])/C=C/COc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000051858855	527544140	/nfs/dbraw/zinc/54/41/40/527544140.db2.gz	YFBHECZDEOZEKC-OWOJBTEDSA-N	-1	0	257.629	2.268	10	5		CEBERM
CC(C)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000179406472	528969622	/nfs/dbraw/zinc/96/96/22/528969622.db2.gz	KMLRKKQLDPOBQA-QMMMGPOBSA-N	-1	0	252.270	2.075	10	5		CEBERM
O=C([O-])[C@H]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000097065581	185520126	/nfs/dbraw/zinc/52/01/26/185520126.db2.gz	RUHWVKWQOSRCJS-WPRPVWTQSA-N	-1	0	250.254	2.260	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@H]1Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000085329260	179019917	/nfs/dbraw/zinc/01/99/17/179019917.db2.gz	LRWIBHJBACDVPK-GHMZBOCLSA-N	-1	0	268.244	2.399	10	5		CEBERM
CCN(C(=O)c1cc(C)ccc1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000088147289	179556916	/nfs/dbraw/zinc/55/69/16/179556916.db2.gz	XMPHLBRDNRBMJH-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
Cc1cnc(SC[C@@H](C)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691871	180024828	/nfs/dbraw/zinc/02/48/28/180024828.db2.gz	DGSCXONBNPAPKS-SSDOTTSWSA-N	-1	0	256.283	2.111	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1NCC[C@@H](C)CCC(=O)[O-]	ZINC000091558488	180190695	/nfs/dbraw/zinc/19/06/95/180190695.db2.gz	CBHYZSBVWVXHRE-VIFPVBQESA-N	-1	0	298.343	2.423	10	5		CEBERM
CC(C)c1nn(C)c(S[C@H](C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091578327	180198270	/nfs/dbraw/zinc/19/82/70/180198270.db2.gz	GSWUODRDIQNOCC-ZCFIWIBFSA-N	-1	0	273.314	2.017	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1NC[C@H]1CCC[C@@H]1C(=O)[O-]	ZINC000091550255	180188940	/nfs/dbraw/zinc/18/89/40/180188940.db2.gz	GMACKTZCMWFGFC-ZJUUUORDSA-N	-1	0	296.327	2.032	10	5		CEBERM
Cc1cc(N[C@H]2CCCC[C@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000092026518	180308383	/nfs/dbraw/zinc/30/83/83/180308383.db2.gz	GFBSIVQJJIIYRP-ZJUUUORDSA-N	-1	0	279.296	2.354	10	5		CEBERM
Cc1cc(N[C@@H]2C=C[C@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092182564	180339011	/nfs/dbraw/zinc/33/90/11/180339011.db2.gz	YXESLKMGINPUIY-GXSJLCMTSA-N	-1	0	262.265	2.344	10	5		CEBERM
CCOc1cc(N[C@H]2C=C[C@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092182943	180339267	/nfs/dbraw/zinc/33/92/67/180339267.db2.gz	RTQMLHXVXZYJRS-UWVGGRQHSA-N	-1	0	292.291	2.435	10	5		CEBERM
Cc1ccc(N[C@H]2C=C[C@@H](C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000092183836	180340181	/nfs/dbraw/zinc/34/01/81/180340181.db2.gz	MYKPGAJPQGFQKC-ZJUUUORDSA-N	-1	0	262.265	2.344	10	5		CEBERM
Cc1cc(C(=O)N(CC(=O)[O-])C(C)(C)C)ccc1[N+](=O)[O-]	ZINC000092447468	180387044	/nfs/dbraw/zinc/38/70/44/180387044.db2.gz	OLQKITKGQKKMGK-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
Cc1cc(C(F)(F)F)c([N+](=O)[O-])cc1[C@H](O)C(=O)[O-]	ZINC000575674158	366325033	/nfs/dbraw/zinc/32/50/33/366325033.db2.gz	POVWRJWQCUNQMH-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCOc1cc(OC(F)F)c([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000575658410	366317816	/nfs/dbraw/zinc/31/78/16/366317816.db2.gz	OMSDWHYWFPXJRH-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCc1ccc([N+](=O)[O-])c(CC(=O)[O-])c1OC(F)F	ZINC000575658692	366318732	/nfs/dbraw/zinc/31/87/32/366318732.db2.gz	DFPJMWJMJIZPFB-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CC(=O)c1c(Br)c([O-])ccc1[N+](=O)[O-]	ZINC000575692251	366330351	/nfs/dbraw/zinc/33/03/51/366330351.db2.gz	WESDZLKMWRFHAP-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
O=[N+]([O-])c1cc(F)c(I)cc1[O-]	ZINC000575706929	366338080	/nfs/dbraw/zinc/33/80/80/366338080.db2.gz	BOYSKVGATQWYEU-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
O=[N+]([O-])c1cc2[n-]nc(Br)c2c([N+](=O)[O-])c1	ZINC000014983669	361463062	/nfs/dbraw/zinc/46/30/62/361463062.db2.gz	PILNASVTIBPOLG-UHFFFAOYSA-N	-1	0	287.029	2.142	10	5		CEBERM
O=C([O-])CCc1ncc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000019271268	170767394	/nfs/dbraw/zinc/76/73/94/170767394.db2.gz	LZQSBRKHYYOCOR-UHFFFAOYSA-N	-1	0	262.221	2.267	10	5		CEBERM
O=C([O-])CCSCCc1ccc([N+](=O)[O-])cc1	ZINC000035677519	172348330	/nfs/dbraw/zinc/34/83/30/172348330.db2.gz	YLPJGALNZBVPKM-UHFFFAOYSA-N	-1	0	255.295	2.345	10	5		CEBERM
CCC[C@@](C)(Nc1ncccc1[N+](=O)[O-])C(=O)[O-]	ZINC000036807797	172723132	/nfs/dbraw/zinc/72/31/32/172723132.db2.gz	PCYXZRFMAWMKLP-LLVKDONJSA-N	-1	0	253.258	2.045	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1-n1nnc(C(=O)[O-])c1C(C)C	ZINC000037291094	173096437	/nfs/dbraw/zinc/09/64/37/173096437.db2.gz	SUVVOUWVLALKEU-UHFFFAOYSA-N	-1	0	290.279	2.306	10	5		CEBERM
Cc1nc(-c2ccc([N+](=O)[O-])cc2)nc(C)c1CC(=O)[O-]	ZINC000040887587	174427925	/nfs/dbraw/zinc/42/79/25/174427925.db2.gz	MSZSJYLJVAFZFP-UHFFFAOYSA-N	-1	0	287.275	2.296	10	5		CEBERM
Cc1nn(-c2ccc(C)cc2[N+](=O)[O-])c(C)c1CC(=O)[O-]	ZINC000043299238	175000173	/nfs/dbraw/zinc/00/01/73/175000173.db2.gz	RBXYFYKQENCVDF-UHFFFAOYSA-N	-1	0	289.291	2.333	10	5		CEBERM
Cc1c(N(C)CC2CC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043387043	175032449	/nfs/dbraw/zinc/03/24/49/175032449.db2.gz	XEWZPOAQARHMBJ-UHFFFAOYSA-N	-1	0	264.281	2.448	10	5		CEBERM
Cc1c(N(CCCO)C(C)C)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043387214	175032608	/nfs/dbraw/zinc/03/26/08/175032608.db2.gz	NRVSCDBZLZRNSO-UHFFFAOYSA-N	-1	0	296.323	2.199	10	5		CEBERM
CCc1nccn1-c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043386532	175032675	/nfs/dbraw/zinc/03/26/75/175032675.db2.gz	KFMSDOGRMHLSMK-UHFFFAOYSA-N	-1	0	275.264	2.350	10	5		CEBERM
O=C([O-])[C@H]1CC[C@@H](Cn2ccc3c2cccc3[N+](=O)[O-])O1	ZINC000071163703	176047051	/nfs/dbraw/zinc/04/70/51/176047051.db2.gz	WIQBDWBLDXJTMJ-TVQRCGJNSA-N	-1	0	290.275	2.182	10	5		CEBERM
O=C([O-])c1cc2ccccc2nc1-n1cc([N+](=O)[O-])cn1	ZINC000071386973	176147925	/nfs/dbraw/zinc/14/79/25/176147925.db2.gz	ATTILSAOMUKIRQ-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
CCc1ccc(O[C@@H](CC)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000078788892	177388324	/nfs/dbraw/zinc/38/83/24/177388324.db2.gz	YATDBUHOIAAOFD-JTQLQIEISA-N	-1	0	253.254	2.399	10	5		CEBERM
Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000071257389	300909253	/nfs/dbraw/zinc/90/92/53/300909253.db2.gz	QQHDTQSCWLYJHU-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
CCO[C@H](CCOc1ccc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000062763942	520514693	/nfs/dbraw/zinc/51/46/93/520514693.db2.gz	YATOWEULDPTCJV-GFCCVEGCSA-N	-1	0	283.280	2.162	10	5		CEBERM
CCN(c1ccccc1[N+](=O)[O-])[C@@H](C)CC(=O)[O-]	ZINC000061181877	521501752	/nfs/dbraw/zinc/50/17/52/521501752.db2.gz	LCZLKJYTLUGGDY-VIFPVBQESA-N	-1	0	252.270	2.284	10	5		CEBERM
CN(c1ccc([N+](=O)[O-])c2cnccc21)C(C)(C)C(=O)[O-]	ZINC000061171204	523642318	/nfs/dbraw/zinc/64/23/18/523642318.db2.gz	QQXLBKGNSIQJRL-UHFFFAOYSA-N	-1	0	289.291	2.442	10	5		CEBERM
Cc1cc(C(=O)[O-])nc(-c2ccccc2[N+](=O)[O-])n1	ZINC000054832747	524194506	/nfs/dbraw/zinc/19/45/06/524194506.db2.gz	XSRALMZDERGOAN-UHFFFAOYSA-N	-1	0	259.221	2.058	10	5		CEBERM
Cc1c(N(C)CCCC(=O)[O-])cccc1[N+](=O)[O-]	ZINC000062723417	525814993	/nfs/dbraw/zinc/81/49/93/525814993.db2.gz	DXAIZEVZUUKNJF-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
Cc1cnc(CNc2ccc(C(=O)[O-])cc2[N+](=O)[O-])cn1	ZINC000061322969	526049727	/nfs/dbraw/zinc/04/97/27/526049727.db2.gz	ROBPUNKSNIFUQM-UHFFFAOYSA-N	-1	0	288.263	2.004	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N(CC(=O)[O-])CC(C)C	ZINC000062742593	526075548	/nfs/dbraw/zinc/07/55/48/526075548.db2.gz	CDTUIYKXLKPQFC-UHFFFAOYSA-N	-1	0	266.297	2.450	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1NCCc1cscn1	ZINC000070233159	526383705	/nfs/dbraw/zinc/38/37/05/526383705.db2.gz	HKRLDQAAYIJLGB-UHFFFAOYSA-N	-1	0	293.304	2.404	10	5		CEBERM
O=C([O-])c1cccc(NCc2ccccc2[N+](=O)[O-])n1	ZINC000051067466	526392297	/nfs/dbraw/zinc/39/22/97/526392297.db2.gz	CPBYBSKNGPELCW-UHFFFAOYSA-N	-1	0	273.248	2.300	10	5		CEBERM
O=C([O-])c1ncccc1OCCc1ccccc1[N+](=O)[O-]	ZINC000062726088	526408411	/nfs/dbraw/zinc/40/84/11/526408411.db2.gz	DWBWAPYEGCMTPE-UHFFFAOYSA-N	-1	0	288.259	2.310	10	5		CEBERM
CCC[C@@H](Nc1ccc([N+](=O)[O-])c(OC)c1)C(=O)[O-]	ZINC000111044729	529022793	/nfs/dbraw/zinc/02/27/93/529022793.db2.gz	VQDFLQVUOQYPBM-SECBINFHSA-N	-1	0	268.269	2.269	10	5		CEBERM
CCc1c(C(=O)[O-])cnn1-c1cccc([N+](=O)[O-])c1	ZINC000034956949	361799824	/nfs/dbraw/zinc/79/98/24/361799824.db2.gz	BJIYVSSHIKNDGH-UHFFFAOYSA-N	-1	0	261.237	2.041	10	5		CEBERM
O=C([O-])[C@@H](O)c1c(Cl)ccc([N+](=O)[O-])c1Cl	ZINC000396119562	344845521	/nfs/dbraw/zinc/84/55/21/344845521.db2.gz	PLWDLTIQNMJZBG-ZETCQYMHSA-N	-1	0	266.036	2.020	10	5		CEBERM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000085407996	179055388	/nfs/dbraw/zinc/05/53/88/179055388.db2.gz	UFADSKTZLYPSQN-ZJUUUORDSA-N	-1	0	296.254	2.029	10	5		CEBERM
CC1(C)[C@H](C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)[C@@H]1C(=O)[O-]	ZINC000085407992	179055650	/nfs/dbraw/zinc/05/56/50/179055650.db2.gz	UFADSKTZLYPSQN-VHSXEESVSA-N	-1	0	296.254	2.029	10	5		CEBERM
Cc1cnc(S[C@@H](C(=O)[O-])C(C)C)cc1[N+](=O)[O-]	ZINC000097824664	185671579	/nfs/dbraw/zinc/67/15/79/185671579.db2.gz	DPJIMNBJXBYVGZ-SNVBAGLBSA-N	-1	0	270.310	2.500	10	5		CEBERM
CCC[C@@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)[O-]	ZINC000087512270	179437548	/nfs/dbraw/zinc/43/75/48/179437548.db2.gz	HOAYZGJAQTVUIK-QMMMGPOBSA-N	-1	0	297.267	2.416	10	5		CEBERM
Cc1nn(C)c(C)c1Oc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000088453214	179607182	/nfs/dbraw/zinc/60/71/82/179607182.db2.gz	MZDAACMBMGTUOT-UHFFFAOYSA-N	-1	0	291.263	2.436	10	5		CEBERM
Cc1cnc(NC2(C(=O)[O-])CCCC2)c([N+](=O)[O-])c1	ZINC000090691671	180024884	/nfs/dbraw/zinc/02/48/84/180024884.db2.gz	IPHKUIZZSKAQKP-UHFFFAOYSA-N	-1	0	265.269	2.108	10	5		CEBERM
C[C@H](CCO)Sc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000091261754	180115745	/nfs/dbraw/zinc/11/57/45/180115745.db2.gz	UWOOIOZOMAGNCU-SSDOTTSWSA-N	-1	0	271.294	2.156	10	5		CEBERM
CC(C)c1nn(C)c(N[C@@](C)(C(=O)[O-])C2CC2)c1[N+](=O)[O-]	ZINC000091583893	180199553	/nfs/dbraw/zinc/19/95/53/180199553.db2.gz	ZMQIICQUIKRSDQ-CYBMUJFWSA-N	-1	0	296.327	2.117	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N(CC(=O)[O-])[C@H](C)CC	ZINC000091554825	180189827	/nfs/dbraw/zinc/18/98/27/180189827.db2.gz	PJNUDCPHRODXRS-SECBINFHSA-N	-1	0	298.343	2.199	10	5		CEBERM
O=C([O-])c1ccn(Cc2cc(F)ccc2[N+](=O)[O-])c1	ZINC000091840021	180268286	/nfs/dbraw/zinc/26/82/86/180268286.db2.gz	MPEGJHUAQOCTMZ-UHFFFAOYSA-N	-1	0	264.212	2.282	10	5		CEBERM
Cc1c(Cn2cccc2C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000091840366	180268683	/nfs/dbraw/zinc/26/86/83/180268683.db2.gz	PUSYLJCNWUSFBQ-UHFFFAOYSA-N	-1	0	260.249	2.451	10	5		CEBERM
O=C([O-])c1cc(N[C@@H]2CCCOC2)c(F)cc1[N+](=O)[O-]	ZINC000109550369	186261903	/nfs/dbraw/zinc/26/19/03/186261903.db2.gz	GNRUBNJBVIDMKJ-SSDOTTSWSA-N	-1	0	284.243	2.023	10	5		CEBERM
COc1cc(N[C@@H](C(=O)[O-])C2CC2)c([N+](=O)[O-])cc1F	ZINC000110624943	186306695	/nfs/dbraw/zinc/30/66/95/186306695.db2.gz	HJXCMEBCRMYAHZ-LLVKDONJSA-N	-1	0	284.243	2.018	10	5		CEBERM
Cc1nn(-c2ccc(F)cc2C(=O)[O-])c(C)c1[N+](=O)[O-]	ZINC000111029301	186346043	/nfs/dbraw/zinc/34/60/43/186346043.db2.gz	LTYUMHOPHXYVNQ-UHFFFAOYSA-N	-1	0	279.227	2.235	10	5		CEBERM
O=C([O-])c1cccc(CCNc2ccc([N+](=O)[O-])cn2)c1	ZINC000111404153	186413886	/nfs/dbraw/zinc/41/38/86/186413886.db2.gz	LBYIDSLHKKYYDZ-UHFFFAOYSA-N	-1	0	287.275	2.343	10	5		CEBERM
Cc1c([C@@H](O)C(=O)[O-])cc([N+](=O)[O-])cc1C(F)(F)F	ZINC000575673138	366323518	/nfs/dbraw/zinc/32/35/18/366323518.db2.gz	CITPSPYJKSJLGJ-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCc1cc(OC(F)F)cc([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575658843	366318829	/nfs/dbraw/zinc/31/88/29/366318829.db2.gz	FEEGVMMUMSCGDV-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CCOc1cc([N+](=O)[O-])c(OC(F)F)cc1CC(=O)[O-]	ZINC000575658648	366319089	/nfs/dbraw/zinc/31/90/89/366319089.db2.gz	QZMWFCHPWCYNQD-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1cc([N+](=O)[O-])cc(C(=O)[O-])c1OC(F)F	ZINC000575660047	366319820	/nfs/dbraw/zinc/31/98/20/366319820.db2.gz	RVVQWPFCRYNMQU-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1c(F)c(OC(F)F)ccc1[N+](=O)[O-]	ZINC000575660931	366321634	/nfs/dbraw/zinc/32/16/34/366321634.db2.gz	DHRLMYBSYRPKPE-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
CC(=O)c1cc([N+](=O)[O-])cc([O-])c1Br	ZINC000575691081	366329744	/nfs/dbraw/zinc/32/97/44/366329744.db2.gz	HEWQVRYZIHCGSG-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CC(=O)c1cc(Br)c([O-])cc1[N+](=O)[O-]	ZINC000575691065	366329814	/nfs/dbraw/zinc/32/98/14/366329814.db2.gz	GZESGNAFHAUVPJ-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
O=C([O-])[C@@]12CCC[C@H]1CN(c1c(F)cccc1[N+](=O)[O-])C2	ZINC000263567857	304168456	/nfs/dbraw/zinc/16/84/56/304168456.db2.gz	XYLBHQUAEFVISC-LKFCYVNXSA-N	-1	0	294.282	2.425	10	5		CEBERM
CCC(CC)(Nc1cc([N+](=O)[O-])ccn1)C(=O)[O-]	ZINC000094240849	184768479	/nfs/dbraw/zinc/76/84/79/184768479.db2.gz	COENKOBTXPUSJC-UHFFFAOYSA-N	-1	0	253.258	2.045	10	5		CEBERM
Nc1nc(N[C@H]2CCCCC[C@@H]2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000094745658	184851779	/nfs/dbraw/zinc/85/17/79/184851779.db2.gz	RLSNMGKHNDEANX-IUCAKERBSA-N	-1	0	294.311	2.017	10	5		CEBERM
O=C([O-])[C@H]1CCCCN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000034740975	134780085	/nfs/dbraw/zinc/78/00/85/134780085.db2.gz	SJTATXVLFCYLLC-MRVPVSSYSA-N	-1	0	285.687	2.087	10	5		CEBERM
Cc1c([N+](=O)[O-])cc(C(=O)[O-])cc1N1CCOCC1(C)C	ZINC000043387113	134900284	/nfs/dbraw/zinc/90/02/84/134900284.db2.gz	MJDGNVPCBHQWNL-UHFFFAOYSA-N	-1	0	294.307	2.217	10	5		CEBERM
O=C([O-])CC1CCN(c2cc(F)ccc2[N+](=O)[O-])CC1	ZINC000093679841	135082116	/nfs/dbraw/zinc/08/21/16/135082116.db2.gz	SULYRWPDNBBRMJ-UHFFFAOYSA-N	-1	0	282.271	2.425	10	5		CEBERM
O=C([O-])c1cc(Oc2cccnc2)ccc1[N+](=O)[O-]	ZINC000037301207	173107248	/nfs/dbraw/zinc/10/72/48/173107248.db2.gz	LKBFJBFYECINCV-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
O=C([O-])c1ccc(Oc2ccc([N+](=O)[O-])cc2)nc1	ZINC000038080142	174089851	/nfs/dbraw/zinc/08/98/51/174089851.db2.gz	GOJVELFXSZXBCP-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
CCNc1ncnc([N-]c2nccs2)c1[N+](=O)[O-]	ZINC000040596309	174348765	/nfs/dbraw/zinc/34/87/65/174348765.db2.gz	CPHCMSVQDNMGKJ-UHFFFAOYSA-N	-1	0	266.286	2.017	10	5		CEBERM
CCNc1ncnc([N-]c2ncccc2C)c1[N+](=O)[O-]	ZINC000040596234	174348877	/nfs/dbraw/zinc/34/88/77/174348877.db2.gz	KGQFYIXNDUGXFX-UHFFFAOYSA-N	-1	0	274.284	2.264	10	5		CEBERM
CCn1cc(C(=O)[O-])c(-c2ccccc2[N+](=O)[O-])n1	ZINC000041067244	174468744	/nfs/dbraw/zinc/46/87/44/174468744.db2.gz	CHUYTBKAAFQFTF-UHFFFAOYSA-N	-1	0	261.237	2.176	10	5		CEBERM
Cc1nn(-c2cccc(F)c2[N+](=O)[O-])c(C)c1C(=O)[O-]	ZINC000043299351	175000001	/nfs/dbraw/zinc/00/00/01/175000001.db2.gz	KUMIYXQMUSLZBA-UHFFFAOYSA-N	-1	0	279.227	2.235	10	5		CEBERM
CCCN(C)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043386874	175032454	/nfs/dbraw/zinc/03/24/54/175032454.db2.gz	RKMFIXQQPJHQBL-UHFFFAOYSA-N	-1	0	252.270	2.448	10	5		CEBERM
COC[C@@H](C)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043386747	175032496	/nfs/dbraw/zinc/03/24/96/175032496.db2.gz	GZVYVSYUIMLOLF-SSDOTTSWSA-N	-1	0	268.269	2.048	10	5		CEBERM
Cc1cccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)c1C(=O)[O-]	ZINC000071170918	176051501	/nfs/dbraw/zinc/05/15/01/176051501.db2.gz	NSFCNIANGVLGQR-UHFFFAOYSA-N	-1	0	289.247	2.182	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])cc1C)[C@@H](C)CC(=O)[O-]	ZINC000061180965	520090121	/nfs/dbraw/zinc/09/01/21/520090121.db2.gz	ICHFIWDHOBPQOX-JTQLQIEISA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(CCC(=O)[O-])c1cc([N+](=O)[O-])ccc1C	ZINC000053734299	520987493	/nfs/dbraw/zinc/98/74/93/520987493.db2.gz	YZEDWWAATKJBQJ-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
CCC[C@]1(C(=O)[O-])CCN(c2ccc([N+](=O)[O-])cn2)C1	ZINC000062934349	521304684	/nfs/dbraw/zinc/30/46/84/521304684.db2.gz	JNUHANJDJUYLQF-ZDUSSCGKSA-N	-1	0	279.296	2.071	10	5		CEBERM
CCC1(C(=O)[O-])CCN(c2ncc([N+](=O)[O-])cc2C)CC1	ZINC000062845693	521675251	/nfs/dbraw/zinc/67/52/51/521675251.db2.gz	NGFPWJVEKFDXJA-UHFFFAOYSA-N	-1	0	293.323	2.379	10	5		CEBERM
COc1ccc(C(=O)[O-])c2[nH]c3ccccc3c(=O)c12	ZINC000058506397	523766818	/nfs/dbraw/zinc/76/68/18/523766818.db2.gz	ASQBSWGFQMAAAV-UHFFFAOYSA-N	-1	0	269.256	2.388	10	5		CEBERM
C[C@@H](CCC(=O)[O-])Oc1cc(F)ccc1[N+](=O)[O-]	ZINC000050954799	524442616	/nfs/dbraw/zinc/44/26/16/524442616.db2.gz	VJAQDHQPLKSQNZ-ZETCQYMHSA-N	-1	0	257.217	2.366	10	5		CEBERM
Cc1cc(SCC(=O)[O-])n(-c2cccc([N+](=O)[O-])c2)n1	ZINC000052307398	525435444	/nfs/dbraw/zinc/43/54/44/525435444.db2.gz	VVTMEQKRWCMYPR-UHFFFAOYSA-N	-1	0	293.304	2.266	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(C)cc1Oc1ccc(C(=O)[O-])nn1	ZINC000062997924	525556110	/nfs/dbraw/zinc/55/61/10/525556110.db2.gz	MSCYWBVTDJMOPT-UHFFFAOYSA-N	-1	0	289.247	2.492	10	5		CEBERM
O=C([O-])c1cc(NC2CCOCC2)c(F)cc1[N+](=O)[O-]	ZINC000050030395	526352346	/nfs/dbraw/zinc/35/23/46/526352346.db2.gz	IZMGJIASNBLCEI-UHFFFAOYSA-N	-1	0	284.243	2.023	10	5		CEBERM
O=C([O-])c1ccc(NC(=O)C2CC=CC2)c([N+](=O)[O-])c1	ZINC000069412783	526374921	/nfs/dbraw/zinc/37/49/21/526374921.db2.gz	FPBZCOWDSIECPX-UHFFFAOYSA-N	-1	0	276.248	2.198	10	5		CEBERM
O=C([O-])c1nccnc1Sc1ccccc1[N+](=O)[O-]	ZINC000054554119	526410648	/nfs/dbraw/zinc/41/06/48/526410648.db2.gz	PSVDMJFMNYZFQM-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
Cc1c([N+](=O)[O-])ccc(Br)c1C(=O)[O-]	ZINC000138344819	344389884	/nfs/dbraw/zinc/38/98/84/344389884.db2.gz	XQABXCWLMRTEQI-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
O=C([O-])[C@H]1CCN(c2cc(F)c(Cl)cc2[N+](=O)[O-])C1	ZINC000097355526	185588139	/nfs/dbraw/zinc/58/81/39/185588139.db2.gz	NCHYSFSGTJLTOW-LURJTMIESA-N	-1	0	288.662	2.298	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])cn1	ZINC000085329848	179020436	/nfs/dbraw/zinc/02/04/36/179020436.db2.gz	VOHSCYISRKJUCT-UWVGGRQHSA-N	-1	0	265.269	2.045	10	5		CEBERM
O=C([O-])CCNc1ccc([N+](=O)[O-])cc1C(F)F	ZINC000104208453	185931532	/nfs/dbraw/zinc/93/15/32/185931532.db2.gz	DKUBWSVEVWSMBV-UHFFFAOYSA-N	-1	0	260.196	2.419	10	5		CEBERM
Cc1cnc(NC2(CC(=O)[O-])CCCC2)c([N+](=O)[O-])c1	ZINC000090691773	180024902	/nfs/dbraw/zinc/02/49/02/180024902.db2.gz	ZGNVKUAXLJGJAB-UHFFFAOYSA-N	-1	0	279.296	2.498	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@@H](Nc2ccc([N+](=O)[O-])cc2F)C1	ZINC000092182876	180339314	/nfs/dbraw/zinc/33/93/14/180339314.db2.gz	SQEKGFOQJLYGOC-JGVFFNPUSA-N	-1	0	266.228	2.175	10	5		CEBERM
Cc1ccc(N[C@@H]2C=C[C@@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000092183789	180339885	/nfs/dbraw/zinc/33/98/85/180339885.db2.gz	ACHWASQBZHTXSU-NXEZZACHSA-N	-1	0	262.265	2.344	10	5		CEBERM
O=C([O-])CN(CC(F)(F)F)c1ccc([N+](=O)[O-])cc1F	ZINC000092436582	180385175	/nfs/dbraw/zinc/38/51/75/180385175.db2.gz	ZTQOMVAFZLRNAJ-UHFFFAOYSA-N	-1	0	296.176	2.187	10	5		CEBERM
CCCc1c([O-])nc(-c2cc([N+](=O)[O-])ccc2C)[nH]c1=O	ZINC000110619908	186306045	/nfs/dbraw/zinc/30/60/45/186306045.db2.gz	BMWLNYYGGIBGBC-UHFFFAOYSA-N	-1	0	289.291	2.312	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(OC(F)F)c1CC(=O)[O-]	ZINC000575667950	366323741	/nfs/dbraw/zinc/32/37/41/366323741.db2.gz	PJTFSSDQZOQPRJ-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
Cc1cc(OC(F)(F)F)c(CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000575673282	366323807	/nfs/dbraw/zinc/32/38/07/366323807.db2.gz	GJFJNIDHCLQIHR-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
Cc1cc([C@@H](O)C(=O)[O-])c(C(F)(F)F)c([N+](=O)[O-])c1	ZINC000575673402	366323841	/nfs/dbraw/zinc/32/38/41/366323841.db2.gz	IWMNTZJCUQTXKE-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCc1cc(OC(F)F)c(C(=O)[O-])c([N+](=O)[O-])c1	ZINC000575658850	366319015	/nfs/dbraw/zinc/31/90/15/366319015.db2.gz	IRQVUYYKHLRPBF-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(OC(F)F)c1F	ZINC000575661325	366321134	/nfs/dbraw/zinc/32/11/34/366321134.db2.gz	LOQLYQRSRYAVMO-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])Cc1c(F)cc([N+](=O)[O-])cc1OC(F)(F)F	ZINC000575709966	366338990	/nfs/dbraw/zinc/33/89/90/366338990.db2.gz	DESPVWFDTILNFJ-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
O=C([O-])Cn1c2ccccc2c(=O)c2ccc([N+](=O)[O-])cc21	ZINC000049452763	304090855	/nfs/dbraw/zinc/09/08/55/304090855.db2.gz	WJGTUOZYWUQYHB-UHFFFAOYSA-N	-1	0	298.254	2.148	10	5		CEBERM
O=C([O-])Cc1cccc2c(=O)c3ccc(O)cc3oc12	ZINC000027882814	361661693	/nfs/dbraw/zinc/66/16/93/361661693.db2.gz	NJEPKIHMLUUPIH-UHFFFAOYSA-N	-1	0	270.240	2.279	10	5		CEBERM
O=C([O-])c1ccc(COc2cccc([N+](=O)[O-])c2)nc1	ZINC000094756054	184853852	/nfs/dbraw/zinc/85/38/52/184853852.db2.gz	ZDCFWBVZLNDKDU-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
O=C([O-])c1cc(Cn2cc(Cl)c([N+](=O)[O-])n2)cs1	ZINC000020312581	171144913	/nfs/dbraw/zinc/14/49/13/171144913.db2.gz	SDGGMZUMUGWUJM-UHFFFAOYSA-N	-1	0	287.684	2.253	10	5		CEBERM
O=C([O-])/C=C/c1cc([N+](=O)[O-])ccc1OCC1CC1	ZINC000020576087	171255943	/nfs/dbraw/zinc/25/59/43/171255943.db2.gz	XZQMHCOJBKMGDB-ZZXKWVIFSA-N	-1	0	263.249	2.481	10	5		CEBERM
O=C([O-])c1ccc(OCc2ccco2)c([N+](=O)[O-])c1	ZINC000022221512	171378245	/nfs/dbraw/zinc/37/82/45/171378245.db2.gz	XDKJZIIPAAXLJD-UHFFFAOYSA-N	-1	0	263.205	2.465	10	5		CEBERM
O=C([O-])c1ccoc1COc1cccc([N+](=O)[O-])c1	ZINC000035205832	172049342	/nfs/dbraw/zinc/04/93/42/172049342.db2.gz	WQRACHHNZUYFIA-UHFFFAOYSA-N	-1	0	263.205	2.465	10	5		CEBERM
Cc1cccc(O[C@H](C(=O)[O-])C(C)C)c1[N+](=O)[O-]	ZINC000035283357	172101866	/nfs/dbraw/zinc/10/18/66/172101866.db2.gz	QZMCSTTWUSRIRS-NSHDSACASA-N	-1	0	253.254	2.391	10	5		CEBERM
CCN(c1ccc([N+](=O)[O-])c(C(=O)[O-])c1)C1CC1	ZINC000037080283	172936642	/nfs/dbraw/zinc/93/66/42/172936642.db2.gz	YUYTZMKWELSYBO-UHFFFAOYSA-N	-1	0	250.254	2.282	10	5		CEBERM
Cc1ccc(Oc2nc[n-]c(=NN(C)C)c2[N+](=O)[O-])cc1	ZINC000040628889	174357436	/nfs/dbraw/zinc/35/74/36/174357436.db2.gz	YAUBSFJFMUELQW-UHFFFAOYSA-N	-1	0	289.295	2.374	10	5		CEBERM
O=C([O-])C1(Nc2ccccc2[N+](=O)[O-])CCCC1	ZINC000041032880	174456327	/nfs/dbraw/zinc/45/63/27/174456327.db2.gz	DTLBJBZKROJGEV-UHFFFAOYSA-N	-1	0	250.254	2.404	10	5		CEBERM
O=C([O-])c1ccc(CNc2ccc([N+](=O)[O-])cc2)o1	ZINC000071381085	176144723	/nfs/dbraw/zinc/14/47/23/176144723.db2.gz	FMFIYJYJFAPGMS-UHFFFAOYSA-N	-1	0	262.221	2.498	10	5		CEBERM
CCCC[C@@H](Nc1ncc([N+](=O)[O-])cc1C)C(=O)[O-]	ZINC000052812041	521107074	/nfs/dbraw/zinc/10/70/74/521107074.db2.gz	AHYJTEYCMORINE-SNVBAGLBSA-N	-1	0	267.285	2.354	10	5		CEBERM
Cc1ccc(N2CCC[C@@H]2CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000061700594	524952585	/nfs/dbraw/zinc/95/25/85/524952585.db2.gz	SVWXGDBBXHORBG-SNVBAGLBSA-N	-1	0	264.281	2.347	10	5		CEBERM
COc1ccc(O[C@@H](C)CCC(=O)[O-])c([N+](=O)[O-])c1	ZINC000050954805	524980841	/nfs/dbraw/zinc/98/08/41/524980841.db2.gz	MOTUMIUWQCEXAQ-QMMMGPOBSA-N	-1	0	269.253	2.236	10	5		CEBERM
O=C([O-])c1ccc(NCc2cccc([N+](=O)[O-])c2)o1	ZINC000052926091	526379346	/nfs/dbraw/zinc/37/93/46/526379346.db2.gz	IKSFIFMSBQZJJX-UHFFFAOYSA-N	-1	0	262.221	2.498	10	5		CEBERM
O=C([O-])C1(Cc2cc(F)ccc2[N+](=O)[O-])CCOCC1	ZINC000061674673	527554905	/nfs/dbraw/zinc/55/49/05/527554905.db2.gz	GSJPKKJYOLWJLW-UHFFFAOYSA-N	-1	0	283.255	2.158	10	5		CEBERM
CCOc1cccc(N2C[C@H](C)[C@@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000229313689	639691471	/nfs/dbraw/zinc/69/14/71/639691471.db2.gz	QDDPLEXGIWGGRN-UWVGGRQHSA-N	-1	0	294.307	2.150	10	5		CEBERM
COc1cc(N[C@@H]2CCC[C@@H]2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000085328480	179019338	/nfs/dbraw/zinc/01/93/38/179019338.db2.gz	QBRKHCKBPOKTRO-VHSXEESVSA-N	-1	0	280.280	2.269	10	5		CEBERM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(F)cc1[N+](=O)[O-]	ZINC000085407822	179055491	/nfs/dbraw/zinc/05/54/91/179055491.db2.gz	JSERXHKNMFZOAQ-ZJUUUORDSA-N	-1	0	296.254	2.029	10	5		CEBERM
CC[C@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)[O-]	ZINC000087510153	179437357	/nfs/dbraw/zinc/43/73/57/179437357.db2.gz	VZWQTWCPVCENCK-SSDOTTSWSA-N	-1	0	283.240	2.026	10	5		CEBERM
O=C([O-])c1ccc(O[C@@H]2CCCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000088762756	179668700	/nfs/dbraw/zinc/66/87/00/179668700.db2.gz	JGQWCKZEIVEIGA-DGCLKSJQSA-N	-1	0	295.291	2.365	10	5		CEBERM
CCc1nn(C)c(Nc2ccc(C(=O)[O-])cc2)c1[N+](=O)[O-]	ZINC000091561421	180191957	/nfs/dbraw/zinc/19/19/57/180191957.db2.gz	SMTKMLCNNGXRRO-UHFFFAOYSA-N	-1	0	290.279	2.333	10	5		CEBERM
CCCc1nn(C)c(NCCCCCC(=O)[O-])c1[N+](=O)[O-]	ZINC000091561995	180192031	/nfs/dbraw/zinc/19/20/31/180192031.db2.gz	BJVASXGVPIUMIB-UHFFFAOYSA-N	-1	0	298.343	2.338	10	5		CEBERM
O=C([O-])c1ccn(CCc2ccccc2[N+](=O)[O-])c1	ZINC000091839883	180268214	/nfs/dbraw/zinc/26/82/14/180268214.db2.gz	BZNADCPONVLMAD-UHFFFAOYSA-N	-1	0	260.249	2.337	10	5		CEBERM
COc1cc(N[C@H]2C=C[C@@H](C(=O)[O-])C2)c([N+](=O)[O-])cc1F	ZINC000092182749	180339479	/nfs/dbraw/zinc/33/94/79/180339479.db2.gz	QCOVINRONGDQAD-SFYZADRCSA-N	-1	0	296.254	2.184	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@H](Nc2cc(F)ccc2[N+](=O)[O-])C1	ZINC000092183858	180339795	/nfs/dbraw/zinc/33/97/95/180339795.db2.gz	FZPNCEMPAFPQGW-CBAPKCEASA-N	-1	0	266.228	2.175	10	5		CEBERM
CCOC(OCC)C(=O)C=C([O-])c1cccc([N+](=O)[O-])c1	ZINC000106606432	186129298	/nfs/dbraw/zinc/12/92/98/186129298.db2.gz	JCJROBCMEHIXJH-UHFFFAOYSA-N	-1	0	295.291	2.136	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])C(=O)c1cc([N+](=O)[O-])ccc1F	ZINC000092447083	180386548	/nfs/dbraw/zinc/38/65/48/180386548.db2.gz	HBHABKZIQZGWNA-UHFFFAOYSA-N	-1	0	298.270	2.059	10	5		CEBERM
O=C([O-])c1ccc(Oc2cc(F)c([N+](=O)[O-])cc2F)nn1	ZINC000110623012	186306866	/nfs/dbraw/zinc/30/68/66/186306866.db2.gz	MJEQOEUGXBTFAZ-UHFFFAOYSA-N	-1	0	297.173	2.154	10	5		CEBERM
CCCOc1cc(N2CCC[C@H]2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000111821416	186460521	/nfs/dbraw/zinc/46/05/21/186460521.db2.gz	ZQIFTWWTGLITOT-LBPRGKRZSA-N	-1	0	294.307	2.437	10	5		CEBERM
O=[N+]([O-])c1cc(F)c(Br)cc1[S@](=O)[O-]	ZINC000675061743	540081088	/nfs/dbraw/zinc/08/10/88/540081088.db2.gz	ODKVIQWHWWTYQR-UHFFFAOYSA-N	-1	0	284.062	2.077	10	5		CEBERM
CC[C@H](CC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000675073270	540115022	/nfs/dbraw/zinc/11/50/22/540115022.db2.gz	IHLFDKOEVGXWIY-MRVPVSSYSA-N	-1	0	251.238	2.278	10	5		CEBERM
COc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C(F)(F)F	ZINC000575675901	366325081	/nfs/dbraw/zinc/32/50/81/366325081.db2.gz	ZKUKHGNUMVAYGA-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
Cc1cc(C(F)(F)F)c([N+](=O)[O-])cc1[C@@H](O)C(=O)[O-]	ZINC000575674154	366325148	/nfs/dbraw/zinc/32/51/48/366325148.db2.gz	POVWRJWQCUNQMH-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
Cc1c(CC(=O)[O-])cc([N+](=O)[O-])cc1OC(F)(F)F	ZINC000575675673	366325211	/nfs/dbraw/zinc/32/52/11/366325211.db2.gz	WYBFJAQBGAMMIU-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
Cc1cc([C@H](O)C(=O)[O-])c([N+](=O)[O-])cc1C(F)(F)F	ZINC000575676059	366325233	/nfs/dbraw/zinc/32/52/33/366325233.db2.gz	ZGOWLHYBAZPFSU-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCc1cc(OC(F)F)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575657893	366317639	/nfs/dbraw/zinc/31/76/39/366317639.db2.gz	BEHXBPSNUIVVKX-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCOc1cc([N+](=O)[O-])c(CC(=O)[O-])cc1OC(F)F	ZINC000575657982	366317795	/nfs/dbraw/zinc/31/77/95/366317795.db2.gz	NXLXPIROSXCXBI-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1c(OC(F)F)ccc(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575659550	366318796	/nfs/dbraw/zinc/31/87/96/366318796.db2.gz	IOKYKONEJWTVMP-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CCc1cc(OC(F)F)c(CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000575660049	366320377	/nfs/dbraw/zinc/32/03/77/366320377.db2.gz	LENYVXVDJKJMIE-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
COc1cc([N+](=O)[O-])c([S-])cc1OC(F)F	ZINC000575664099	366322330	/nfs/dbraw/zinc/32/23/30/366322330.db2.gz	BMYVMTZZVOMTNB-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
O=C([O-])Cc1c(OC(F)(F)F)ccc([N+](=O)[O-])c1F	ZINC000575711265	366340223	/nfs/dbraw/zinc/34/02/23/366340223.db2.gz	PNKGWDWIBGQRKI-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
CCOC(=O)Cc1cc([N+](=O)[O-])c([S-])cc1F	ZINC000575701395	366333622	/nfs/dbraw/zinc/33/36/22/366333622.db2.gz	NMOREWJQZDXCAE-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
C[C@@](Nc1cccc([N+](=O)[O-])c1)(C(=O)[O-])C(F)(F)F	ZINC000094222108	184765482	/nfs/dbraw/zinc/76/54/82/184765482.db2.gz	GQDDRSDYJXEKKP-SECBINFHSA-N	-1	0	278.186	2.412	10	5		CEBERM
O=C([O-])[C@@H]1CCCCC[C@H]1Nc1ccncc1[N+](=O)[O-]	ZINC000094745163	184851403	/nfs/dbraw/zinc/85/14/03/184851403.db2.gz	HDBCBMNEQCCGEB-NXEZZACHSA-N	-1	0	279.296	2.435	10	5		CEBERM
C[C@]1(CNc2ccc([N+](=O)[O-])cc2C(=O)[O-])CCCO1	ZINC000094803962	184869368	/nfs/dbraw/zinc/86/93/68/184869368.db2.gz	UCFCWHMNSVXIMQ-CYBMUJFWSA-N	-1	0	280.280	2.274	10	5		CEBERM
Cc1nn(-c2ccccc2[N+](=O)[O-])c(C)c1C(=O)[O-]	ZINC000019965452	170946983	/nfs/dbraw/zinc/94/69/83/170946983.db2.gz	XHQHWBDFZHXGOY-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
O=c1nc[n-]c2cc(-c3ccc([N+](=O)[O-])o3)sc21	ZINC000037116901	172967518	/nfs/dbraw/zinc/96/75/18/172967518.db2.gz	SGTSSDVNNZUEEB-UHFFFAOYSA-N	-1	0	263.234	2.153	10	5		CEBERM
Cc1c(OC2CCOCC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386647	175032581	/nfs/dbraw/zinc/03/25/81/175032581.db2.gz	OCCBAIRIYRJRNN-UHFFFAOYSA-N	-1	0	281.264	2.159	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])nc2)C1	ZINC000070556908	175985116	/nfs/dbraw/zinc/98/51/16/175985116.db2.gz	GEBJOCIAEQBIAB-IUCAKERBSA-N	-1	0	265.269	2.045	10	5		CEBERM
O=C([O-])[C@@H]1CC[C@@H](Cn2ccc3c2cccc3[N+](=O)[O-])O1	ZINC000071163705	176046995	/nfs/dbraw/zinc/04/69/95/176046995.db2.gz	WIQBDWBLDXJTMJ-ZANVPECISA-N	-1	0	290.275	2.182	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N1CCC[C@@]1(C)C(=O)[O-]	ZINC000079485666	177501646	/nfs/dbraw/zinc/50/16/46/177501646.db2.gz	MQAWEMUJIWXGTF-ZDUSSCGKSA-N	-1	0	264.281	2.347	10	5		CEBERM
Cc1nn(-c2cc([N+](=O)[O-])ccc2C(=O)[O-])cc1Cl	ZINC000080010099	177594571	/nfs/dbraw/zinc/59/45/71/177594571.db2.gz	DTFNOXOUBHXQQK-UHFFFAOYSA-N	-1	0	281.655	2.441	10	5		CEBERM
CC(=O)Nc1ccc(N[C@@H](C(=O)[O-])C(C)C)c([N+](=O)[O-])c1	ZINC000098037998	278200194	/nfs/dbraw/zinc/20/01/94/278200194.db2.gz	JQSOCJXMXMBGFD-GFCCVEGCSA-N	-1	0	295.295	2.074	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])cc1F)[C@H](C)CC(=O)[O-]	ZINC000061180993	520093316	/nfs/dbraw/zinc/09/33/16/520093316.db2.gz	OQTHCLNNXHHUIM-MRVPVSSYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCCN(CC(=O)[O-])c1cccc([N+](=O)[O-])c1C	ZINC000062723486	521563825	/nfs/dbraw/zinc/56/38/25/521563825.db2.gz	WZFITBQRMUZLKF-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
O=C([O-])c1cnn(Cc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000050444229	526404795	/nfs/dbraw/zinc/40/47/95/526404795.db2.gz	IDWKTULOYXXPIT-UHFFFAOYSA-N	-1	0	281.655	2.191	10	5		CEBERM
Cc1oc(-c2cc(F)ccc2[N+](=O)[O-])nc1C(=O)[O-]	ZINC000051086517	526728715	/nfs/dbraw/zinc/72/87/15/526728715.db2.gz	MJOYMKDIIUQPFP-UHFFFAOYSA-N	-1	0	266.184	2.396	10	5		CEBERM
Cc1nccc(CNc2cc([N+](=O)[O-])ccc2C(=O)[O-])n1	ZINC000070232844	527340712	/nfs/dbraw/zinc/34/07/12/527340712.db2.gz	HYOLXIJGCQQLLE-UHFFFAOYSA-N	-1	0	288.263	2.004	10	5		CEBERM
CC(C)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000179406461	528418816	/nfs/dbraw/zinc/41/88/16/528418816.db2.gz	KMLRKKQLDPOBQA-MRVPVSSYSA-N	-1	0	252.270	2.075	10	5		CEBERM
Cc1cccc([N+](=O)[O-])c1N1C[C@H](C)[C@@H](C(=O)[O-])C1	ZINC000227934914	639609245	/nfs/dbraw/zinc/60/92/45/639609245.db2.gz	MTYKMSQARRJZDJ-UWVGGRQHSA-N	-1	0	264.281	2.060	10	5		CEBERM
CCC[C@H](Nc1ccc([N+](=O)[O-])c(OC)c1)C(=O)[O-]	ZINC000111044726	643640697	/nfs/dbraw/zinc/64/06/97/643640697.db2.gz	VQDFLQVUOQYPBM-VIFPVBQESA-N	-1	0	268.269	2.269	10	5		CEBERM
O=[N+]([O-])c1ccc([O-])c(-c2n[nH]c(-c3ccccn3)n2)c1	ZINC000095619096	185016280	/nfs/dbraw/zinc/01/62/80/185016280.db2.gz	VLPDOVOSYUMIOE-UHFFFAOYSA-N	-1	0	283.247	2.148	10	5		CEBERM
O=C([O-])[C@H]1CC[C@@H](Nc2cc(F)cc([N+](=O)[O-])c2)C1	ZINC000097066360	185519928	/nfs/dbraw/zinc/51/99/28/185519928.db2.gz	HAQPALHDMUCZDL-IONNQARKSA-N	-1	0	268.244	2.399	10	5		CEBERM
COc1cc(N[C@@H]2CCC[C@H]2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000085328484	179019065	/nfs/dbraw/zinc/01/90/65/179019065.db2.gz	QBRKHCKBPOKTRO-NXEZZACHSA-N	-1	0	280.280	2.269	10	5		CEBERM
COc1ccc(N[C@@H]2CCC[C@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000085329204	179019536	/nfs/dbraw/zinc/01/95/36/179019536.db2.gz	XEHFJTXRXSHRND-NXEZZACHSA-N	-1	0	280.280	2.269	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1S[C@H](C(=O)[O-])C(C)C	ZINC000097824647	185671821	/nfs/dbraw/zinc/67/18/21/185671821.db2.gz	OTYKRQRXMXWVBO-VIFPVBQESA-N	-1	0	270.310	2.500	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N1CC[C@H](CC(=O)[O-])C1	ZINC000089713347	179852064	/nfs/dbraw/zinc/85/20/64/179852064.db2.gz	NUOPKDUURGEBLZ-SNVBAGLBSA-N	-1	0	264.281	2.204	10	5		CEBERM
Cc1nn(C)c(Oc2csc(C(=O)[O-])c2)c1[N+](=O)[O-]	ZINC000091352653	180138233	/nfs/dbraw/zinc/13/82/33/180138233.db2.gz	AFZJHFDUHVQGLQ-UHFFFAOYSA-N	-1	0	283.265	2.189	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N(CC)[C@@H](C)CC(=O)[O-]	ZINC000091555373	180190364	/nfs/dbraw/zinc/19/03/64/180190364.db2.gz	OCYHJPSFDGKRFP-VIFPVBQESA-N	-1	0	298.343	2.199	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCCC[C@@H]1C(=O)[O-]	ZINC000091549541	180188561	/nfs/dbraw/zinc/18/85/61/180188561.db2.gz	XJJRRCMBPAKJPW-VHSXEESVSA-N	-1	0	296.327	2.175	10	5		CEBERM
COc1ccc(Cn2cccc2C(=O)[O-])cc1[N+](=O)[O-]	ZINC000091840530	180269237	/nfs/dbraw/zinc/26/92/37/180269237.db2.gz	GFCUKASVNZVAIG-UHFFFAOYSA-N	-1	0	276.248	2.151	10	5		CEBERM
Cc1cc(N[C@H]2C=C[C@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092182563	180338840	/nfs/dbraw/zinc/33/88/40/180338840.db2.gz	YXESLKMGINPUIY-ONGXEEELSA-N	-1	0	262.265	2.344	10	5		CEBERM
Cc1c(N[C@@H]2C=C[C@@H](C(=O)[O-])C2)cccc1[N+](=O)[O-]	ZINC000092183078	180339230	/nfs/dbraw/zinc/33/92/30/180339230.db2.gz	DICIMPINTCCGSG-NXEZZACHSA-N	-1	0	262.265	2.344	10	5		CEBERM
COc1cc(N[C@H]2C=C[C@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092183406	180339428	/nfs/dbraw/zinc/33/94/28/180339428.db2.gz	LDKCZDKWPYVTKH-IUCAKERBSA-N	-1	0	278.264	2.045	10	5		CEBERM
Cc1ccc(N[C@@H]2C=C[C@@H](C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000092183837	180340083	/nfs/dbraw/zinc/34/00/83/180340083.db2.gz	MYKPGAJPQGFQKC-NXEZZACHSA-N	-1	0	262.265	2.344	10	5		CEBERM
CC(C)c1c([O-])nc(-c2cccc([N+](=O)[O-])c2)[nH]c1=O	ZINC000110620101	186305855	/nfs/dbraw/zinc/30/58/55/186305855.db2.gz	GHGVKWHADRWVJT-UHFFFAOYSA-N	-1	0	275.264	2.174	10	5		CEBERM
COc1cc(N(C)C(C)(C)C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000110624947	186306584	/nfs/dbraw/zinc/30/65/84/186306584.db2.gz	NIVZZEGDPDBWDC-UHFFFAOYSA-N	-1	0	286.259	2.042	10	5		CEBERM
CN(CC(=O)[O-])c1ccc([N+](=O)[O-])cc1C(F)F	ZINC000111821667	186460016	/nfs/dbraw/zinc/46/00/16/186460016.db2.gz	RVAUWKSKQMDXCQ-UHFFFAOYSA-N	-1	0	260.196	2.053	10	5		CEBERM
CC[C@H](CCNc1c([N+](=O)[O-])ncn1C)CCC(=O)[O-]	ZINC000112745137	186528145	/nfs/dbraw/zinc/52/81/45/186528145.db2.gz	WKOZBJKINSNURV-VIFPVBQESA-N	-1	0	284.316	2.021	10	5		CEBERM
O=[N+]([O-])c1cc(Br)c(F)c([S@](=O)[O-])c1	ZINC000675062182	540082151	/nfs/dbraw/zinc/08/21/51/540082151.db2.gz	JQKKCHWEAKJOFH-UHFFFAOYSA-N	-1	0	284.062	2.077	10	5		CEBERM
Cc1ccc(OC(F)F)c(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575666159	366323630	/nfs/dbraw/zinc/32/36/30/366323630.db2.gz	GYWOGEFWGQCHMH-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
COc1cc(CC(=O)[O-])cc([N+](=O)[O-])c1C(F)(F)F	ZINC000575679185	366325876	/nfs/dbraw/zinc/32/58/76/366325876.db2.gz	NWOBOZNADDZLOA-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
COc1cc([S-])c(OC(F)F)c([N+](=O)[O-])c1	ZINC000575664802	366322531	/nfs/dbraw/zinc/32/25/31/366322531.db2.gz	LEWWQXWRGBQBSV-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
CCOC(=O)Cc1c(F)ccc([S-])c1[N+](=O)[O-]	ZINC000575701704	366333574	/nfs/dbraw/zinc/33/35/74/366333574.db2.gz	WFHJPSLVZHOILO-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
O=[N+]([O-])c1cc(F)c([O-])cc1I	ZINC000575706941	366337361	/nfs/dbraw/zinc/33/73/61/366337361.db2.gz	CAPQBGLUMREYSB-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
O=C([O-])Cn1c2ccccc2c(=O)c2cc([N+](=O)[O-])ccc21	ZINC000003904608	304090970	/nfs/dbraw/zinc/09/09/70/304090970.db2.gz	DWDFWKXFFJEWLH-UHFFFAOYSA-N	-1	0	298.254	2.148	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N[C@@H](C(=O)[O-])C(C)C	ZINC000037453252	173219000	/nfs/dbraw/zinc/21/90/00/173219000.db2.gz	AVRPUBSRTTYGKO-LLVKDONJSA-N	-1	0	252.270	2.424	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)c(C)c1C	ZINC000040729278	174388207	/nfs/dbraw/zinc/38/82/07/174388207.db2.gz	FYYIBQJDDAFULW-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
COCCCOc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043386636	175032578	/nfs/dbraw/zinc/03/25/78/175032578.db2.gz	PPTGCVPXLYABMQ-UHFFFAOYSA-N	-1	0	269.253	2.017	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@@H]1NC(=O)c1csc([N+](=O)[O-])c1	ZINC000070524736	175969517	/nfs/dbraw/zinc/96/95/17/175969517.db2.gz	LJOPNFWQLTZHKZ-IUCAKERBSA-N	-1	0	298.320	2.030	10	5		CEBERM
C/C(C(=O)[O-])=C(\C)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000071164737	176047564	/nfs/dbraw/zinc/04/75/64/176047564.db2.gz	SQPSBMBWGAKMES-HSTULFTRSA-N	-1	0	292.291	2.193	10	5		CEBERM
O=C([O-])CCCCC[S@](=O)c1ccc([N+](=O)[O-])cc1	ZINC000071291875	176110207	/nfs/dbraw/zinc/11/02/07/176110207.db2.gz	NVZGOOMDQKSAPU-LJQANCHMSA-N	-1	0	285.321	2.347	10	5		CEBERM
CC[C@@H](C(=O)[O-])N(C)c1cc([N+](=O)[O-])ccc1C	ZINC000053734330	521881853	/nfs/dbraw/zinc/88/18/53/521881853.db2.gz	DSUDDQKYUPBFHE-JTQLQIEISA-N	-1	0	252.270	2.203	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1O[C@@H](C)CCC(=O)[O-]	ZINC000050955590	522983601	/nfs/dbraw/zinc/98/36/01/522983601.db2.gz	LJZZVGGVKCALBA-QMMMGPOBSA-N	-1	0	269.253	2.236	10	5		CEBERM
CC[C@H]1CO[C@H](C)CN1c1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070232461	523353180	/nfs/dbraw/zinc/35/31/80/523353180.db2.gz	ZXOLOICPCFBDID-ZJUUUORDSA-N	-1	0	294.307	2.297	10	5		CEBERM
Cc1cc(C)c(Oc2ccc(C(=O)[O-])nn2)c([N+](=O)[O-])c1	ZINC000050441756	524312216	/nfs/dbraw/zinc/31/22/16/524312216.db2.gz	RZWWLVCEAYSMEY-UHFFFAOYSA-N	-1	0	289.247	2.492	10	5		CEBERM
C[C@@H](CNc1c(F)c(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000054334425	524754452	/nfs/dbraw/zinc/75/44/52/524754452.db2.gz	QMFHRGWOABKRBK-YFKPBYRVSA-N	-1	0	260.196	2.006	10	5		CEBERM
Cc1ccc(N(C)C(C)(C)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000061171331	524886826	/nfs/dbraw/zinc/88/68/26/524886826.db2.gz	BXAXTVYGKHZQMF-UHFFFAOYSA-N	-1	0	252.270	2.203	10	5		CEBERM
Cc1c(N(C)C[C@@H](C)C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000062723524	525815296	/nfs/dbraw/zinc/81/52/96/525815296.db2.gz	CPRGUSWBGUYNBS-MRVPVSSYSA-N	-1	0	252.270	2.060	10	5		CEBERM
O=C([O-])c1ncccc1COc1ccc([N+](=O)[O-])cc1	ZINC000062763555	526408377	/nfs/dbraw/zinc/40/83/77/526408377.db2.gz	FQXNXWSCUJYMPW-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
O=C([O-])C[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(F)(F)F	ZINC000062763532	527625443	/nfs/dbraw/zinc/62/54/43/527625443.db2.gz	LKOPADSDRQBICD-MRVPVSSYSA-N	-1	0	279.170	2.379	10	5		CEBERM
Cc1cc(C(=O)[O-])c(Br)cc1[N+](=O)[O-]	ZINC000306581809	344715322	/nfs/dbraw/zinc/71/53/22/344715322.db2.gz	PYHGILPKAIWKGT-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
COc1cc(N2CCCCC[C@H]2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000083896146	178760056	/nfs/dbraw/zinc/76/00/56/178760056.db2.gz	BDLHXDRPHOMVSK-LBPRGKRZSA-N	-1	0	294.307	2.437	10	5		CEBERM
C[C@H](C(=O)[O-])N(C)c1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000054054692	362506934	/nfs/dbraw/zinc/50/69/34/362506934.db2.gz	UKMFXVFXSXNGPQ-MRVPVSSYSA-N	-1	0	275.264	2.052	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@@H]1Nc1cc([N+](=O)[O-])ccn1	ZINC000085329773	179020430	/nfs/dbraw/zinc/02/04/30/179020430.db2.gz	OWHRNNASXYRDRL-ZJUUUORDSA-N	-1	0	265.269	2.045	10	5		CEBERM
Cc1cnc(NC[C@@H]2CCC[C@@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691807	180024908	/nfs/dbraw/zinc/02/49/08/180024908.db2.gz	LTNVPTGHYNBFKP-UWVGGRQHSA-N	-1	0	279.296	2.211	10	5		CEBERM
C[C@H](Nc1ncccc1[N+](=O)[O-])c1nc(C(=O)[O-])cs1	ZINC000090943087	180068836	/nfs/dbraw/zinc/06/88/36/180068836.db2.gz	FWUZMQAQRBHFSO-LURJTMIESA-N	-1	0	294.292	2.318	10	5		CEBERM
C[C@H](CCO)Sc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000091261746	180115687	/nfs/dbraw/zinc/11/56/87/180115687.db2.gz	WATIDPTXPMGFJX-SSDOTTSWSA-N	-1	0	271.294	2.156	10	5		CEBERM
Cc1cccc(Oc2cncc(C(=O)[O-])n2)c1[N+](=O)[O-]	ZINC000091417400	180149679	/nfs/dbraw/zinc/14/96/79/180149679.db2.gz	NJXAFTJJZZBXHZ-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CC[C@H](C(=O)[O-])C1	ZINC000091555933	180190420	/nfs/dbraw/zinc/19/04/20/180190420.db2.gz	MNUQLUSXQXYTIO-VHSXEESVSA-N	-1	0	296.327	2.175	10	5		CEBERM
Cc1c(Cn2ccc(C(=O)[O-])c2)cccc1[N+](=O)[O-]	ZINC000091839918	180267663	/nfs/dbraw/zinc/26/76/63/180267663.db2.gz	HZRJZLAZNHWYNG-UHFFFAOYSA-N	-1	0	260.249	2.451	10	5		CEBERM
O=C([O-])c1cc(Sc2ncc([N+](=O)[O-])cn2)cs1	ZINC000091948091	180290679	/nfs/dbraw/zinc/29/06/79/180290679.db2.gz	VRXBNSUVQOHKMR-UHFFFAOYSA-N	-1	0	283.290	2.296	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@H](Nc2c(F)c(F)ccc2[N+](=O)[O-])C1	ZINC000092182861	180339359	/nfs/dbraw/zinc/33/93/59/180339359.db2.gz	BPGJHLLWORTMHY-RQJHMYQMSA-N	-1	0	284.218	2.314	10	5		CEBERM
COc1cc(N[C@H]2C=C[C@@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092183404	180339534	/nfs/dbraw/zinc/33/95/34/180339534.db2.gz	LDKCZDKWPYVTKH-BDAKNGLRSA-N	-1	0	278.264	2.045	10	5		CEBERM
O=C([O-])CN(CC(F)(F)F)c1ccccc1[N+](=O)[O-]	ZINC000092436693	180384949	/nfs/dbraw/zinc/38/49/49/180384949.db2.gz	TVRVDUWPARGNPQ-UHFFFAOYSA-N	-1	0	278.186	2.048	10	5		CEBERM
O=C([O-])c1cn(-c2ccc3ncccc3c2[N+](=O)[O-])cn1	ZINC000109476587	186254923	/nfs/dbraw/zinc/25/49/23/186254923.db2.gz	USEHXJMPJUGWQY-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
O=C([O-])CCc1nnc(-c2c(Cl)cccc2[N+](=O)[O-])o1	ZINC000111010870	186342895	/nfs/dbraw/zinc/34/28/95/186342895.db2.gz	LNJONXSXPYIZPZ-UHFFFAOYSA-N	-1	0	297.654	2.315	10	5		CEBERM
Cc1cc([N+](=O)[O-])cc([C@@H](O)C(=O)[O-])c1C(F)(F)F	ZINC000575673715	366325156	/nfs/dbraw/zinc/32/51/56/366325156.db2.gz	MNHITYABWYHJIY-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
COc1cc(CC(=O)[O-])c(C(F)(F)F)c([N+](=O)[O-])c1	ZINC000575679550	366326203	/nfs/dbraw/zinc/32/62/03/366326203.db2.gz	XFDDMHBKERSBGV-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
O=C([O-])c1c(OC(F)F)cc(F)cc1[N+](=O)[O-]	ZINC000575661612	366321312	/nfs/dbraw/zinc/32/13/12/366321312.db2.gz	QKPJUGJMAGHRFH-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])[C@H](O)c1c([N+](=O)[O-])cc(Cl)cc1C(F)(F)F	ZINC000575694052	366331252	/nfs/dbraw/zinc/33/12/52/366331252.db2.gz	IDFHKCZJMOOHRI-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)Cc1c(F)cc([N+](=O)[O-])cc1[S-]	ZINC000575701673	366333534	/nfs/dbraw/zinc/33/35/34/366333534.db2.gz	URZPCOGLZGDZMK-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
O=C([O-])Cc1cccc2c(=O)c3cc(O)ccc3oc12	ZINC000027894033	361661712	/nfs/dbraw/zinc/66/17/12/361661712.db2.gz	GHYVTYFHQYBSTH-UHFFFAOYSA-N	-1	0	270.240	2.279	10	5		CEBERM
COc1ccc(Nc2ccc([N+](=O)[O-])c(C(=O)[O-])c2)cn1	ZINC000019844959	184534942	/nfs/dbraw/zinc/53/49/42/184534942.db2.gz	FHGDMPIOQWVTJT-UHFFFAOYSA-N	-1	0	289.247	2.440	10	5		CEBERM
O=C([O-])CC1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000081744344	177850265	/nfs/dbraw/zinc/85/02/65/177850265.db2.gz	LWVWWSHXUHDTPF-UHFFFAOYSA-N	-1	0	284.699	2.155	10	5		CEBERM
O=C([O-])CC1CCN(c2cc(F)cc([N+](=O)[O-])c2)CC1	ZINC000093680050	135082198	/nfs/dbraw/zinc/08/21/98/135082198.db2.gz	VVXFHVMVOQUWIQ-UHFFFAOYSA-N	-1	0	282.271	2.425	10	5		CEBERM
Cc1cccc(C(=O)N[C@@H](CC(C)C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000019385108	170778868	/nfs/dbraw/zinc/77/88/68/170778868.db2.gz	XNTZHVBWYZGPAZ-NSHDSACASA-N	-1	0	294.307	2.132	10	5		CEBERM
CC(C)(CC(=O)[O-])CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000029010469	171583519	/nfs/dbraw/zinc/58/35/19/171583519.db2.gz	JCBFNKSNJIKOSS-UHFFFAOYSA-N	-1	0	280.280	2.424	10	5		CEBERM
O=C([O-])CCNc1ccc([N+](=O)[O-])c2ncccc12	ZINC000035340408	172132342	/nfs/dbraw/zinc/13/23/42/172132342.db2.gz	KPLPOMSBPBZIBC-UHFFFAOYSA-N	-1	0	261.237	2.030	10	5		CEBERM
Cc1ccc(Oc2nc[n-]c(=NN)c2[N+](=O)[O-])cc1C	ZINC000040656836	174365219	/nfs/dbraw/zinc/36/52/19/174365219.db2.gz	GWQAFYFYDLHELB-UHFFFAOYSA-N	-1	0	275.268	2.080	10	5		CEBERM
CCOc1ncnc([N-]c2ccc(C)cn2)c1[N+](=O)[O-]	ZINC000040659600	174366050	/nfs/dbraw/zinc/36/60/50/174366050.db2.gz	HEMNRRRTFQVJEL-UHFFFAOYSA-N	-1	0	275.268	2.231	10	5		CEBERM
O=C([O-])C1(Nc2ccc([N+](=O)[O-])nc2)CCCCC1	ZINC000041033037	174456287	/nfs/dbraw/zinc/45/62/87/174456287.db2.gz	KPOFROPBBKQRQD-UHFFFAOYSA-N	-1	0	265.269	2.189	10	5		CEBERM
CCn1cc(C(=O)[O-])c(-c2ccc(C)c([N+](=O)[O-])c2)n1	ZINC000041067187	174468440	/nfs/dbraw/zinc/46/84/40/174468440.db2.gz	IXFMFZBRWWSMBA-UHFFFAOYSA-N	-1	0	275.264	2.485	10	5		CEBERM
O=C([O-])c1ccc(NC[C@@H]2CCCCO2)c([N+](=O)[O-])c1	ZINC000042825094	174888695	/nfs/dbraw/zinc/88/86/95/174888695.db2.gz	WKQYGKXJSJPZLB-JTQLQIEISA-N	-1	0	280.280	2.274	10	5		CEBERM
O=C([O-])c1ccc(NC(=O)[C@H]2CCCS2)c([N+](=O)[O-])c1	ZINC000070435826	175930029	/nfs/dbraw/zinc/93/00/29/175930029.db2.gz	GORNBFYFOKNHFW-SNVBAGLBSA-N	-1	0	296.304	2.127	10	5		CEBERM
Cc1ccc(Oc2cnc(C(=O)[O-])cn2)c([N+](=O)[O-])c1	ZINC000071182474	176057664	/nfs/dbraw/zinc/05/76/64/176057664.db2.gz	SRIDSRBAGHBZQW-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
O=C([O-])Cc1csc(Sc2cc([N+](=O)[O-])ccn2)n1	ZINC000071300780	176113558	/nfs/dbraw/zinc/11/35/58/176113558.db2.gz	ITUQWQLRKUVAON-UHFFFAOYSA-N	-1	0	297.317	2.225	10	5		CEBERM
O=[N+]([O-])c1ccc([O-])c(-c2n[nH]c(-c3ccncc3)n2)c1	ZINC000072237744	176346448	/nfs/dbraw/zinc/34/64/48/176346448.db2.gz	LXFLLIJAAJGBKH-UHFFFAOYSA-N	-1	0	283.247	2.148	10	5		CEBERM
CC[C@H](Oc1cc([N+](=O)[O-])ccc1Cl)C(=O)[O-]	ZINC000078446040	177342412	/nfs/dbraw/zinc/34/24/12/177342412.db2.gz	DFUVNHILMGBILZ-QMMMGPOBSA-N	-1	0	259.645	2.490	10	5		CEBERM
CCN(C[C@@H]1CCCO1)c1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070232479	521229324	/nfs/dbraw/zinc/22/93/24/521229324.db2.gz	WTSJOPUWIKZVPG-NSHDSACASA-N	-1	0	294.307	2.298	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1OCc1occc1C(=O)[O-]	ZINC000050504948	522983781	/nfs/dbraw/zinc/98/37/81/522983781.db2.gz	UEQQAEBWBFCWLF-UHFFFAOYSA-N	-1	0	293.231	2.474	10	5		CEBERM
CN(c1ccc([N+](=O)[O-])c2ncccc12)C(C)(C)C(=O)[O-]	ZINC000061171190	523641321	/nfs/dbraw/zinc/64/13/21/523641321.db2.gz	KZRBQURDJMTCQU-UHFFFAOYSA-N	-1	0	289.291	2.442	10	5		CEBERM
Cc1cc(CNc2cc(C(=O)[O-])c([N+](=O)[O-])cc2F)no1	ZINC000050032442	524784728	/nfs/dbraw/zinc/78/47/28/524784728.db2.gz	YDIGZUUTBPMRHL-UHFFFAOYSA-N	-1	0	295.226	2.341	10	5		CEBERM
Cc1ccc(OCc2occc2C(=O)[O-])c([N+](=O)[O-])n1	ZINC000050279524	525453402	/nfs/dbraw/zinc/45/34/02/525453402.db2.gz	AIILSFCBAQQXRZ-UHFFFAOYSA-N	-1	0	278.220	2.168	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1Oc1cccc(C(=O)[O-])n1	ZINC000051041661	525472674	/nfs/dbraw/zinc/47/26/74/525472674.db2.gz	NMJUEZWJROQIPA-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N[C@@H](C(=O)[O-])C1CC1	ZINC000054522063	525571417	/nfs/dbraw/zinc/57/14/17/525571417.db2.gz	RSTKVXGLDMEHSH-LLVKDONJSA-N	-1	0	250.254	2.178	10	5		CEBERM
Cc1c([N+](=O)[O-])cccc1N1CCC[C@@H]1CC(=O)[O-]	ZINC000062723518	525930602	/nfs/dbraw/zinc/93/06/02/525930602.db2.gz	XRYLLOCWOHFPJN-SNVBAGLBSA-N	-1	0	264.281	2.347	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N[C@H](C(=O)[O-])C1CC1	ZINC000054505928	526084294	/nfs/dbraw/zinc/08/42/94/526084294.db2.gz	YICMTFOIHGLVHX-NSHDSACASA-N	-1	0	250.254	2.178	10	5		CEBERM
O=C([O-])[C@@]1(CCc2ccc([N+](=O)[O-])cc2)CCOC1	ZINC000054634240	526295407	/nfs/dbraw/zinc/29/54/07/526295407.db2.gz	SYXFTTQBMPZQKZ-ZDUSSCGKSA-N	-1	0	265.265	2.019	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc([N+](=O)[O-])c2ncccc12)C1CC1	ZINC000054521909	526314844	/nfs/dbraw/zinc/31/48/44/526314844.db2.gz	YZCITDADCCZPBF-GFCCVEGCSA-N	-1	0	287.275	2.418	10	5		CEBERM
O=C([O-])/C=C/c1ccc([N+](=O)[O-])c(OCC(F)F)c1	ZINC000050518181	527546907	/nfs/dbraw/zinc/54/69/07/527546907.db2.gz	VRBGQWWIDBVOFT-DUXPYHPUSA-N	-1	0	273.191	2.337	10	5		CEBERM
CC[C@@H]1OCC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000233945753	641347536	/nfs/dbraw/zinc/34/75/36/641347536.db2.gz	HQPPSDLCSSCDFB-CABZTGNLSA-N	-1	0	280.280	2.054	10	5		CEBERM
Cc1cc(CC(=O)[O-])c(Br)cc1[N+](=O)[O-]	ZINC000228887971	344564184	/nfs/dbraw/zinc/56/41/84/344564184.db2.gz	GRNPSRBPKLAILQ-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
CC(C)n1nc(C(F)(F)F)c([N+](=O)[O-])c1C(=O)[O-]	ZINC000584880203	344995743	/nfs/dbraw/zinc/99/57/43/344995743.db2.gz	HASGLYSADYHFOG-UHFFFAOYSA-N	-1	0	267.163	2.089	10	5		CEBERM
Cc1nn(C(C)C)c(N2CCC[C@H]2CC(=O)[O-])c1[N+](=O)[O-]	ZINC000097127943	185542840	/nfs/dbraw/zinc/54/28/40/185542840.db2.gz	YFMKFHJDXBGLDS-JTQLQIEISA-N	-1	0	296.327	2.124	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@@H]1Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000085329263	179019871	/nfs/dbraw/zinc/01/98/71/179019871.db2.gz	LRWIBHJBACDVPK-MNOVXSKESA-N	-1	0	268.244	2.399	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])cn1	ZINC000085329846	179020121	/nfs/dbraw/zinc/02/01/21/179020121.db2.gz	VOHSCYISRKJUCT-VHSXEESVSA-N	-1	0	265.269	2.045	10	5		CEBERM
CC(C)CCNc1ncc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000098129082	185691354	/nfs/dbraw/zinc/69/13/54/185691354.db2.gz	XOIFAVMFPHEGCD-UHFFFAOYSA-N	-1	0	253.258	2.146	10	5		CEBERM
O=C([O-])[C@H](Oc1cc(Cl)ccc1[N+](=O)[O-])C1CC1	ZINC000088793981	179673171	/nfs/dbraw/zinc/67/31/71/179673171.db2.gz	UQPJKNGXLPXPGV-SNVBAGLBSA-N	-1	0	271.656	2.490	10	5		CEBERM
O=C([O-])[C@@H](Oc1ccc([N+](=O)[O-])c2cccnc12)C1CC1	ZINC000088793873	179673251	/nfs/dbraw/zinc/67/32/51/179673251.db2.gz	PRKHVMLJNLPDQO-ZDUSSCGKSA-N	-1	0	288.259	2.385	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1SC[C@H](C)C(=O)[O-]	ZINC000091556428	180190319	/nfs/dbraw/zinc/19/03/19/180190319.db2.gz	ZTAVOBGWAKIWKO-ZETCQYMHSA-N	-1	0	287.341	2.323	10	5		CEBERM
Cc1cc(NC2(CC(=O)[O-])CCCC2)ncc1[N+](=O)[O-]	ZINC000092026506	180308800	/nfs/dbraw/zinc/30/88/00/180308800.db2.gz	SIVUKBBPBZHZKM-UHFFFAOYSA-N	-1	0	279.296	2.498	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N[C@H]1C=C[C@@H](C(=O)[O-])C1	ZINC000092182989	180339295	/nfs/dbraw/zinc/33/92/95/180339295.db2.gz	AEPWRXRUMAQISZ-ZJUUUORDSA-N	-1	0	262.265	2.344	10	5		CEBERM
COc1ccc(N[C@@H]2C=C[C@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000092183567	180339501	/nfs/dbraw/zinc/33/95/01/180339501.db2.gz	KPCHXVJGASUVAI-DTWKUNHWSA-N	-1	0	278.264	2.045	10	5		CEBERM
Cc1c(NCC2CCOCC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000111179103	186366312	/nfs/dbraw/zinc/36/63/12/186366312.db2.gz	CZZLIYDPRBJSGT-UHFFFAOYSA-N	-1	0	294.307	2.440	10	5		CEBERM
O=[N+]([O-])c1ccc([S@](=O)[O-])c(C(F)(F)F)c1	ZINC000675061924	540081889	/nfs/dbraw/zinc/08/18/89/540081889.db2.gz	SYBRABRZJICVRD-UHFFFAOYSA-N	-1	0	255.173	2.194	10	5		CEBERM
Cc1c(Br)cc([S@](=O)[O-])cc1[N+](=O)[O-]	ZINC000675062432	540082252	/nfs/dbraw/zinc/08/22/52/540082252.db2.gz	SUQDZQJKTSKLBA-UHFFFAOYSA-N	-1	0	280.099	2.246	10	5		CEBERM
CCOc1ccc(OC(F)F)c([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575655705	366313584	/nfs/dbraw/zinc/31/35/84/366313584.db2.gz	ARBBVYUHBCVURH-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(CC(=O)[O-])cc1OC(F)F	ZINC000575666221	366323317	/nfs/dbraw/zinc/32/33/17/366323317.db2.gz	HLMGFYAKXVFGKK-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
Cc1cc(OC(F)F)c([N+](=O)[O-])cc1CC(=O)[O-]	ZINC000575666302	366323395	/nfs/dbraw/zinc/32/33/95/366323395.db2.gz	IAIGAHAGCUUPBY-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
COc1cc(CC(=O)[O-])c([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000575677669	366326350	/nfs/dbraw/zinc/32/63/50/366326350.db2.gz	BZGYSRFKXCLGJL-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
CCOc1cc(CC(=O)[O-])c([N+](=O)[O-])cc1OC(F)F	ZINC000575656660	366315424	/nfs/dbraw/zinc/31/54/24/366315424.db2.gz	FOWIZJJQVTZQDJ-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1c(C(=O)[O-])ccc([N+](=O)[O-])c1OC(F)F	ZINC000575658605	366318764	/nfs/dbraw/zinc/31/87/64/366318764.db2.gz	HACSWZVYDQYXKS-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCc1c(C(=O)[O-])ccc(OC(F)F)c1[N+](=O)[O-]	ZINC000575660187	366320469	/nfs/dbraw/zinc/32/04/69/366320469.db2.gz	UJCVMWUXDVDBBZ-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])Cc1ccc(OC(F)(F)F)c([N+](=O)[O-])c1F	ZINC000575710329	366339501	/nfs/dbraw/zinc/33/95/01/366339501.db2.gz	GMNJDOZDIZQLOT-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1Cl	ZINC000575694960	366331357	/nfs/dbraw/zinc/33/13/57/366331357.db2.gz	OXFMBLQXNLXRQT-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
O=[N+]([O-])c1c([O-])ccc(F)c1I	ZINC000575707266	366337316	/nfs/dbraw/zinc/33/73/16/366337316.db2.gz	SFTUCYHTFIKERY-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
O=[N+]([O-])c1c([O-])ccc(I)c1F	ZINC000575706910	366337958	/nfs/dbraw/zinc/33/79/58/366337958.db2.gz	AMLCESUWLHVAMH-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
CC[C@H](C)[S@@](=O)C=C([O-])c1cccc([N+](=O)[O-])c1	ZINC000081915458	177892549	/nfs/dbraw/zinc/89/25/49/177892549.db2.gz	VOUVBYNBYIZHBW-NIVTXAMTSA-N	-1	0	269.322	2.325	10	5		CEBERM
Cc1cc(N2CCSC[C@H]2CC(=O)[O-])ccc1[N+](=O)[O-]	ZINC000091130429	135067085	/nfs/dbraw/zinc/06/70/85/135067085.db2.gz	OEFRIRSVEVQKCD-LLVKDONJSA-N	-1	0	296.348	2.300	10	5		CEBERM
CC[C@@H](Oc1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000002526143	169802529	/nfs/dbraw/zinc/80/25/29/169802529.db2.gz	XTDHZWYAGSYQAB-MRVPVSSYSA-N	-1	0	259.645	2.490	10	5		CEBERM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000006336823	170193543	/nfs/dbraw/zinc/19/35/43/170193543.db2.gz	GBKMCOBNNVQTKB-ZJUUUORDSA-N	-1	0	290.275	2.200	10	5		CEBERM
O=C([O-])/C=C/c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000020526910	171240148	/nfs/dbraw/zinc/24/01/48/171240148.db2.gz	KQYDXPMILMCKAG-ZZXKWVIFSA-N	-1	0	262.265	2.293	10	5		CEBERM
O=C([O-])CCCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000037497297	173236568	/nfs/dbraw/zinc/23/65/68/173236568.db2.gz	FLRYLCGEZHTBHU-UHFFFAOYSA-N	-1	0	286.671	2.442	10	5		CEBERM
O=C([O-])[C@H](Nc1ncccc1[N+](=O)[O-])C1CCCCC1	ZINC000038036931	174036458	/nfs/dbraw/zinc/03/64/58/174036458.db2.gz	FYGGLLOISIOLML-LLVKDONJSA-N	-1	0	279.296	2.435	10	5		CEBERM
COc1ccc(Oc2ccncc2[N+](=O)[O-])c(C(=O)[O-])c1	ZINC000043334271	175010530	/nfs/dbraw/zinc/01/05/30/175010530.db2.gz	QLKXXZWZXOHJGU-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
CCN(CCOC)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043387129	175032451	/nfs/dbraw/zinc/03/24/51/175032451.db2.gz	SGTAWNBUIPHZIP-UHFFFAOYSA-N	-1	0	282.296	2.074	10	5		CEBERM
C/C(C(=O)[O-])=C(\C)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1	ZINC000071165747	176048357	/nfs/dbraw/zinc/04/83/57/176048357.db2.gz	CTUDQACPSSBAFC-HJWRWDBZSA-N	-1	0	278.264	2.263	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(C)cc1Oc1cnc(C(=O)[O-])cn1	ZINC000071182483	176057637	/nfs/dbraw/zinc/05/76/37/176057637.db2.gz	SCDFABKMMRETAZ-UHFFFAOYSA-N	-1	0	289.247	2.492	10	5		CEBERM
CCC[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000043474541	270228321	/nfs/dbraw/zinc/22/83/21/270228321.db2.gz	BGZNMLMXQCAQQP-JTQLQIEISA-N	-1	0	299.258	2.109	10	5		CEBERM
CCO[C@H](CCOc1cccc([N+](=O)[O-])c1C)C(=O)[O-]	ZINC000062763742	520515030	/nfs/dbraw/zinc/51/50/30/520515030.db2.gz	DTIXESVURUJSSX-GFCCVEGCSA-N	-1	0	283.280	2.162	10	5		CEBERM
CC[C@@H](C(=O)[O-])N(C)c1cccc([N+](=O)[O-])c1C	ZINC000062723546	521882032	/nfs/dbraw/zinc/88/20/32/521882032.db2.gz	MKUKJMDDNUZHAV-VIFPVBQESA-N	-1	0	252.270	2.203	10	5		CEBERM
CCCC[C@H](Nc1ncc([N+](=O)[O-])cc1C)C(=O)[O-]	ZINC000052812040	521243609	/nfs/dbraw/zinc/24/36/09/521243609.db2.gz	AHYJTEYCMORINE-JTQLQIEISA-N	-1	0	267.285	2.354	10	5		CEBERM
CCC[C@](C)(Nc1ncc([N+](=O)[O-])cc1C)C(=O)[O-]	ZINC000052812051	521286041	/nfs/dbraw/zinc/28/60/41/521286041.db2.gz	AFMUNJDFLPNDEO-LBPRGKRZSA-N	-1	0	267.285	2.354	10	5		CEBERM
CCN(c1ccc(F)cc1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061171525	521489409	/nfs/dbraw/zinc/48/94/09/521489409.db2.gz	BODAFTOMYFBRKB-UHFFFAOYSA-N	-1	0	270.260	2.423	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1OCc1ccc(C(=O)[O-])o1	ZINC000050504921	522983251	/nfs/dbraw/zinc/98/32/51/522983251.db2.gz	OADQMIPWWLFWNO-UHFFFAOYSA-N	-1	0	293.231	2.474	10	5		CEBERM
CCn1cc(COc2ccc([N+](=O)[O-])cc2C(=O)[O-])cn1	ZINC000050539995	523392347	/nfs/dbraw/zinc/39/23/47/523392347.db2.gz	LVSYNSGCEGSENJ-UHFFFAOYSA-N	-1	0	291.263	2.088	10	5		CEBERM
CN(c1cccnc1)c1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070233218	523658183	/nfs/dbraw/zinc/65/81/83/523658183.db2.gz	AIGYDCPSYCSZGM-UHFFFAOYSA-N	-1	0	273.248	2.456	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N1CCC[C@H](C(=O)[O-])C1	ZINC000053734273	526076852	/nfs/dbraw/zinc/07/68/52/526076852.db2.gz	GAEULXDHZDVKGL-JTQLQIEISA-N	-1	0	264.281	2.204	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N[C@@H](C(=O)[O-])C1CC1	ZINC000054505932	526085778	/nfs/dbraw/zinc/08/57/78/526085778.db2.gz	YICMTFOIHGLVHX-LLVKDONJSA-N	-1	0	250.254	2.178	10	5		CEBERM
O=C([O-])[C@]1(CCc2ccc([N+](=O)[O-])cc2)CCOC1	ZINC000054634242	526337210	/nfs/dbraw/zinc/33/72/10/526337210.db2.gz	SYXFTTQBMPZQKZ-CYBMUJFWSA-N	-1	0	265.265	2.019	10	5		CEBERM
O=C([O-])c1cc(Sc2ncccn2)c(F)cc1[N+](=O)[O-]	ZINC000050033048	526355697	/nfs/dbraw/zinc/35/56/97/526355697.db2.gz	SECDDNIABXDXLP-UHFFFAOYSA-N	-1	0	295.251	2.373	10	5		CEBERM
CCCC[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000037563230	361904698	/nfs/dbraw/zinc/90/46/98/361904698.db2.gz	HXKLEGWXSGEMTP-MRVPVSSYSA-N	-1	0	286.309	2.030	10	5		CEBERM
O=C([O-])c1cc(Br)c([N+](=O)[O-])cc1F	ZINC000307535430	344723495	/nfs/dbraw/zinc/72/34/95/344723495.db2.gz	RKCFTYSSDFBMEC-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
O=C([O-])[C@H](O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-]	ZINC000396119471	344845592	/nfs/dbraw/zinc/84/55/92/344845592.db2.gz	PBIXDFVPAOKYOV-SSDOTTSWSA-N	-1	0	266.036	2.020	10	5		CEBERM
C[C@](Nc1cc(F)cc([N+](=O)[O-])c1)(C(=O)[O-])C1CC1	ZINC000084095646	178787618	/nfs/dbraw/zinc/78/76/18/178787618.db2.gz	OEGXQGLUMVIPCG-GFCCVEGCSA-N	-1	0	268.244	2.399	10	5		CEBERM
O=C([O-])[C@H]1CC[C@@H](Nc2cc(F)ccc2[N+](=O)[O-])C1	ZINC000097065931	185520489	/nfs/dbraw/zinc/52/04/89/185520489.db2.gz	LNVVLMMCZINHDR-IONNQARKSA-N	-1	0	268.244	2.399	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1[C@@H](C(=O)[O-])C1(C)C	ZINC000085411061	179056913	/nfs/dbraw/zinc/05/69/13/179056913.db2.gz	ZHSBZEZLVPHJHU-QWRGUYRKSA-N	-1	0	292.291	2.199	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1S[C@H](C)CC(=O)[O-]	ZINC000090098662	179914165	/nfs/dbraw/zinc/91/41/65/179914165.db2.gz	AESBKUFEBQNFIX-SSDOTTSWSA-N	-1	0	287.341	2.465	10	5		CEBERM
C[C@@H](Nc1cc([N+](=O)[O-])ccn1)c1nc(C(=O)[O-])cs1	ZINC000090942857	180068907	/nfs/dbraw/zinc/06/89/07/180068907.db2.gz	OQZXHTXDXWOUBL-ZCFIWIBFSA-N	-1	0	294.292	2.318	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1Oc1cncc(C(=O)[O-])n1	ZINC000091417391	180149356	/nfs/dbraw/zinc/14/93/56/180149356.db2.gz	KWCNLKPSKUIXIY-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
CCc1nn(C)c(Oc2cccc(C(=O)[O-])c2)c1[N+](=O)[O-]	ZINC000091560065	180191158	/nfs/dbraw/zinc/19/11/58/180191158.db2.gz	IEEFOFYJOKJVSC-UHFFFAOYSA-N	-1	0	291.263	2.381	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1SCC1(CC(=O)[O-])CC1	ZINC000091549298	180188797	/nfs/dbraw/zinc/18/87/97/180188797.db2.gz	ZPNMEYMJDAOARO-UHFFFAOYSA-N	-1	0	299.352	2.467	10	5		CEBERM
CCCOCCOc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000111106711	186352701	/nfs/dbraw/zinc/35/27/01/186352701.db2.gz	XSWGHVHNQOXFHM-UHFFFAOYSA-N	-1	0	287.243	2.238	10	5		CEBERM
O=C([O-])c1ccc(Sc2ccncn2)c([N+](=O)[O-])c1	ZINC000111113093	186353551	/nfs/dbraw/zinc/35/35/51/186353551.db2.gz	ZPJWYKYLOURWRC-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
Cc1cc([N+](=O)[O-])c([C@H](O)C(=O)[O-])cc1C(F)(F)F	ZINC000575673608	366323401	/nfs/dbraw/zinc/32/34/01/366323401.db2.gz	LKYYVNLFZOEBSA-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCOc1c(CC(=O)[O-])ccc([N+](=O)[O-])c1OC(F)F	ZINC000575656194	366315288	/nfs/dbraw/zinc/31/52/88/366315288.db2.gz	FBAUQSYWHBQFQG-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCOc1cc(CC(=O)[O-])cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575656156	366315476	/nfs/dbraw/zinc/31/54/76/366315476.db2.gz	CSOIXGIZZBHGPF-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1cc(C(=O)[O-])cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575657973	366317747	/nfs/dbraw/zinc/31/77/47/366317747.db2.gz	CVOHOYBFRGNLDD-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
COc1c(OC(F)F)ccc([S-])c1[N+](=O)[O-]	ZINC000575665550	366322267	/nfs/dbraw/zinc/32/22/67/366322267.db2.gz	PLMWFCOBBMKYGW-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
O=[N+]([O-])c1cc(I)cc([O-])c1F	ZINC000575707025	366337877	/nfs/dbraw/zinc/33/78/77/366337877.db2.gz	GQFXGWLRBMCONM-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
COc1ccc(Nc2ccc([N+](=O)[O-])cc2C(=O)[O-])cn1	ZINC000019844957	184534824	/nfs/dbraw/zinc/53/48/24/184534824.db2.gz	WDGOFXCIOAYQJD-UHFFFAOYSA-N	-1	0	289.247	2.440	10	5		CEBERM
Cc1nn(-c2cc(C)ccc2[N+](=O)[O-])c(C)c1C(=O)[O-]	ZINC000094663506	184837303	/nfs/dbraw/zinc/83/73/03/184837303.db2.gz	VWRMXVCXYXGQSD-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
O=C([O-])Cc1ccc([N+](=O)[O-])cc1OC(F)(F)F	ZINC000575345721	395660620	/nfs/dbraw/zinc/66/06/20/395660620.db2.gz	STNXSEAFRAIJDD-UHFFFAOYSA-N	-1	0	265.143	2.121	10	5		CEBERM
O=c1c2cc(Br)c(F)cc2[n-]cc1[N+](=O)[O-]	ZINC000584642572	400613166	/nfs/dbraw/zinc/61/31/66/400613166.db2.gz	DHMXHLHFCNCMMB-UHFFFAOYSA-N	-1	0	287.044	2.338	10	5		CEBERM
O=C([O-])c1ccsc1NC(=O)c1ccc([N+](=O)[O-])o1	ZINC000019272888	170768156	/nfs/dbraw/zinc/76/81/56/170768156.db2.gz	WXZGDNLBGRAUSH-UHFFFAOYSA-N	-1	0	282.233	2.200	10	5		CEBERM
O=C([O-])CCc1ncc(-c2ccccc2[N+](=O)[O-])o1	ZINC000020525978	171239166	/nfs/dbraw/zinc/23/91/66/171239166.db2.gz	SFODYPGPGYUFKB-UHFFFAOYSA-N	-1	0	262.221	2.267	10	5		CEBERM
CC(C)[C@@H](Nc1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000037453264	173218996	/nfs/dbraw/zinc/21/89/96/173218996.db2.gz	HJORABWXQMCKLM-SNVBAGLBSA-N	-1	0	256.233	2.255	10	5		CEBERM
CNc1ncnc([N-]c2cccnc2Cl)c1[N+](=O)[O-]	ZINC000040596033	174349034	/nfs/dbraw/zinc/34/90/34/174349034.db2.gz	ZLCCBXIWCBQPRC-UHFFFAOYSA-N	-1	0	280.675	2.219	10	5		CEBERM
CN(C)N=c1[n-]cnc(Oc2ccccc2)c1[N+](=O)[O-]	ZINC000040628886	174357404	/nfs/dbraw/zinc/35/74/04/174357404.db2.gz	QABIKTOUFDAXFL-UHFFFAOYSA-N	-1	0	275.268	2.066	10	5		CEBERM
O=C([O-])c1cc(NCCc2ccc([N+](=O)[O-])cc2)ccn1	ZINC000040676301	174373701	/nfs/dbraw/zinc/37/37/01/174373701.db2.gz	ANYIOGOKJDJENK-UHFFFAOYSA-N	-1	0	287.275	2.343	10	5		CEBERM
O=C([O-])c1cc2ccccc2nc1-n1ccc([N+](=O)[O-])n1	ZINC000071386987	176147991	/nfs/dbraw/zinc/14/79/91/176147991.db2.gz	GVLJBTCVGUILBX-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
CC(C)(C)c1nc(-c2ccc([O-])c([N+](=O)[O-])c2)n[nH]1	ZINC000072237693	176346526	/nfs/dbraw/zinc/34/65/26/176346526.db2.gz	NQMOLMQJFLARQT-UHFFFAOYSA-N	-1	0	262.269	2.383	10	5		CEBERM
C[C@H](CCNc1ccc([N+](=O)[O-])nc1)CCC(=O)[O-]	ZINC000079068525	177426521	/nfs/dbraw/zinc/42/65/21/177426521.db2.gz	NTRHNWMFNBXKJB-VIFPVBQESA-N	-1	0	267.285	2.293	10	5		CEBERM
O=C(c1cccc([N+](=O)[O-])c1[O-])N1CC[C@H]2CCC[C@H]21	ZINC000393452611	262365317	/nfs/dbraw/zinc/36/53/17/262365317.db2.gz	YAOMDULZYSBMLU-MWLCHTKSSA-N	-1	0	276.292	2.315	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1ccc([N+](=O)[O-])cc1F	ZINC000061217889	521199409	/nfs/dbraw/zinc/19/94/09/521199409.db2.gz	VCOUNNVNFWDEIN-MRVPVSSYSA-N	-1	0	270.260	2.281	10	5		CEBERM
CCC[C@H](Nc1cc(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000052099752	521179893	/nfs/dbraw/zinc/17/98/93/521179893.db2.gz	IDYAZHUWLPKBRY-QMMMGPOBSA-N	-1	0	256.233	2.399	10	5		CEBERM
COCC[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000052786325	521979368	/nfs/dbraw/zinc/97/93/68/521979368.db2.gz	YUQJSZDIEJELQU-VIFPVBQESA-N	-1	0	288.687	2.150	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1Oc1ncccc1C(=O)[O-]	ZINC000050505028	522985474	/nfs/dbraw/zinc/98/54/74/522985474.db2.gz	DYEYGQDCFVTDNO-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
CCn1cc(Nc2cc(C(=O)[O-])c([N+](=O)[O-])cc2F)cn1	ZINC000050030144	523439197	/nfs/dbraw/zinc/43/91/97/523439197.db2.gz	JHYRNQOIMBLRMJ-UHFFFAOYSA-N	-1	0	294.242	2.392	10	5		CEBERM
COc1ccc(C)cc1Cn1cc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000050705253	523816095	/nfs/dbraw/zinc/81/60/95/523816095.db2.gz	RFVXNWLFQFCKPD-UHFFFAOYSA-N	-1	0	290.275	2.460	10	5		CEBERM
C[C@@H]1CCN(c2cc(C(=O)[O-])c([N+](=O)[O-])cc2F)C1	ZINC000050030671	524523180	/nfs/dbraw/zinc/52/31/80/524523180.db2.gz	GDPYCDQHXWPUDT-SSDOTTSWSA-N	-1	0	268.244	2.278	10	5		CEBERM
COc1ccc(O[C@H](C)CCC(=O)[O-])c([N+](=O)[O-])c1	ZINC000050954807	524986047	/nfs/dbraw/zinc/98/60/47/524986047.db2.gz	MOTUMIUWQCEXAQ-MRVPVSSYSA-N	-1	0	269.253	2.236	10	5		CEBERM
Cc1c([N+](=O)[O-])cccc1N1CCCC[C@@H]1C(=O)[O-]	ZINC000062723442	525930864	/nfs/dbraw/zinc/93/08/64/525930864.db2.gz	SBMHRGUUMUKIJM-GFCCVEGCSA-N	-1	0	264.281	2.347	10	5		CEBERM
O=C([O-])c1ccc(NCc2ccc([N+](=O)[O-])cc2)o1	ZINC000050908635	526378705	/nfs/dbraw/zinc/37/87/05/526378705.db2.gz	BQDXVRSCXWEPHV-UHFFFAOYSA-N	-1	0	262.221	2.498	10	5		CEBERM
O=C([O-])c1ccc([S@@](=O)Cc2ccc([N+](=O)[O-])cc2)o1	ZINC000069363267	526385215	/nfs/dbraw/zinc/38/52/15/526385215.db2.gz	YVQINQVYEGBUOA-HXUWFJFHSA-N	-1	0	295.272	2.194	10	5		CEBERM
O=C([O-])c1nccn2cc(-c3ccccc3[N+](=O)[O-])nc12	ZINC000063216703	526409517	/nfs/dbraw/zinc/40/95/17/526409517.db2.gz	JIHMCCMZVKMLBY-UHFFFAOYSA-N	-1	0	284.231	2.003	10	5		CEBERM
Cc1nn(-c2cccc([N+](=O)[O-])c2C)c(C)c1C(=O)[O-]	ZINC000062724720	527536786	/nfs/dbraw/zinc/53/67/86/527536786.db2.gz	ONTHEQJQBXUXFH-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
O=C([O-])/C=C/c1ccc([N+](=O)[O-])c(OC(F)F)c1	ZINC000050518161	527546488	/nfs/dbraw/zinc/54/64/88/527546488.db2.gz	WDQPRLKZOHOEGY-DUXPYHPUSA-N	-1	0	259.164	2.294	10	5		CEBERM
O=C([O-])C1CCN(c2c(F)c(F)ccc2[N+](=O)[O-])CC1	ZINC000053162336	527565535	/nfs/dbraw/zinc/56/55/35/527565535.db2.gz	ILHOILRSHXJLCO-UHFFFAOYSA-N	-1	0	286.234	2.174	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1-c1ccccc1CO	ZINC000095495067	184998349	/nfs/dbraw/zinc/99/83/49/184998349.db2.gz	YHLVUUBFLJBUEG-UHFFFAOYSA-N	-1	0	273.244	2.452	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cnc1N1CCCCCC1	ZINC000082572534	178110470	/nfs/dbraw/zinc/11/04/70/178110470.db2.gz	KFHIVUMWVHRJSP-UHFFFAOYSA-N	-1	0	265.269	2.068	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(NCC[C@H]2CCCO2)c1	ZINC000211902993	344531891	/nfs/dbraw/zinc/53/18/91/344531891.db2.gz	VKHJWFCYPHZLEH-SNVBAGLBSA-N	-1	0	280.280	2.274	10	5		CEBERM
C[C@H](CO)CSc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000097458459	185609774	/nfs/dbraw/zinc/60/97/74/185609774.db2.gz	GHGNRCDIXSFMAC-SSDOTTSWSA-N	-1	0	271.294	2.014	10	5		CEBERM
C[C@H](CO)CSc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000097458452	185610142	/nfs/dbraw/zinc/61/01/42/185610142.db2.gz	JTJGJEQFPQKKNF-SSDOTTSWSA-N	-1	0	271.294	2.014	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@H]1Nc1ccc(F)cc1[N+](=O)[O-]	ZINC000085328779	179019572	/nfs/dbraw/zinc/01/95/72/179019572.db2.gz	IYLZSKMHRCJNLK-RKDXNWHRSA-N	-1	0	268.244	2.399	10	5		CEBERM
CC[C@H](Sc1cc2c(cc1[N+](=O)[O-])CC(=O)N2)C(=O)[O-]	ZINC000097824377	185671923	/nfs/dbraw/zinc/67/19/23/185671923.db2.gz	RTZZOUDAOIVMCT-VIFPVBQESA-N	-1	0	296.304	2.045	10	5		CEBERM
CC[C@H](CNc1cc(F)cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000087510419	179437389	/nfs/dbraw/zinc/43/73/89/179437389.db2.gz	CTYVXRMBKDPDCG-SSDOTTSWSA-N	-1	0	256.233	2.257	10	5		CEBERM
Cc1nn(C)c(C)c1Oc1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000088453230	179607112	/nfs/dbraw/zinc/60/71/12/179607112.db2.gz	IJERDKIVFAWEIF-UHFFFAOYSA-N	-1	0	291.263	2.436	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1C[C@H]1Cc2ccccc2O1	ZINC000090875546	180050941	/nfs/dbraw/zinc/05/09/41/180050941.db2.gz	BILRUNKBBOGXAR-LLVKDONJSA-N	-1	0	288.259	2.098	10	5		CEBERM
C[C@H](CCO)Sc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000091261741	180115702	/nfs/dbraw/zinc/11/57/02/180115702.db2.gz	FAZYBCJOHWSKBM-ZCFIWIBFSA-N	-1	0	289.284	2.295	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N(CC)C(C)(C)C(=O)[O-]	ZINC000091555370	180190307	/nfs/dbraw/zinc/19/03/07/180190307.db2.gz	RQAAWKJVHVROBT-UHFFFAOYSA-N	-1	0	298.343	2.199	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N(CC(=O)[O-])CC(C)C	ZINC000091555383	180190398	/nfs/dbraw/zinc/19/03/98/180190398.db2.gz	GASALNVJJOBTBK-UHFFFAOYSA-N	-1	0	298.343	2.057	10	5		CEBERM
CC[C@@H](C)N(CC(=O)[O-])c1c([N+](=O)[O-])c(C(C)C)nn1C	ZINC000091577850	180197673	/nfs/dbraw/zinc/19/76/73/180197673.db2.gz	DALJFNDOPUCIKG-SECBINFHSA-N	-1	0	298.343	2.141	10	5		CEBERM
COc1cc(N[C@H]2C=C[C@H](C(=O)[O-])C2)c([N+](=O)[O-])cc1F	ZINC000092182751	180339225	/nfs/dbraw/zinc/33/92/25/180339225.db2.gz	QCOVINRONGDQAD-YUMQZZPRSA-N	-1	0	296.254	2.184	10	5		CEBERM
Cc1cc([N+](=O)[O-])c([C@@H](O)C(=O)[O-])c(C(F)(F)F)c1	ZINC000575675473	366325000	/nfs/dbraw/zinc/32/50/00/366325000.db2.gz	UYYFEFKKXMWJOO-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
Cc1cc(C(F)(F)F)cc([C@H](O)C(=O)[O-])c1[N+](=O)[O-]	ZINC000575675588	366325174	/nfs/dbraw/zinc/32/51/74/366325174.db2.gz	WMCOWCCJXRWHJE-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
COc1cc([N+](=O)[O-])cc(CC(=O)[O-])c1C(F)(F)F	ZINC000575679248	366326173	/nfs/dbraw/zinc/32/61/73/366326173.db2.gz	QIKWXXWRNVBPMR-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
Cc1c(CC(=O)[O-])ccc([N+](=O)[O-])c1OC(F)F	ZINC000575665480	366322355	/nfs/dbraw/zinc/32/23/55/366322355.db2.gz	FDGCCOIEFGOEGD-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
O=C([O-])[C@@H](O)c1c(Cl)c(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000575693581	366331346	/nfs/dbraw/zinc/33/13/46/366331346.db2.gz	BJAGKURGFMMTDD-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
O=C([O-])[C@H](O)c1cc([N+](=O)[O-])cc(Cl)c1C(F)(F)F	ZINC000575696623	366332348	/nfs/dbraw/zinc/33/23/48/366332348.db2.gz	YCHZYYLJIZNSPS-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
O=[N+]([O-])c1ccc(F)c([O-])c1I	ZINC000575706976	366337377	/nfs/dbraw/zinc/33/73/77/366337377.db2.gz	DPFSKJFYIOEKRR-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
CCOC(=O)C=C([O-])c1c(Cl)cccc1[N+](=O)[O-]	ZINC000095348311	364342065	/nfs/dbraw/zinc/34/20/65/364342065.db2.gz	WCUXIOOYHJAULY-UHFFFAOYSA-N	-1	0	271.656	2.384	10	5		CEBERM
C[C@H]1[C@@H](C(=O)[O-])CCN1c1ccc(F)cc1[N+](=O)[O-]	ZINC000092922038	184634991	/nfs/dbraw/zinc/63/49/91/184634991.db2.gz	OMPHOEWJWFPTRW-CBAPKCEASA-N	-1	0	268.244	2.033	10	5		CEBERM
CC(C)C[C@H](CNc1ccc([N+](=O)[O-])c(N)n1)CC(=O)[O-]	ZINC000094261040	184771253	/nfs/dbraw/zinc/77/12/53/184771253.db2.gz	OULDSTOLGZEXEE-VIFPVBQESA-N	-1	0	296.327	2.121	10	5		CEBERM
CCCC[C@H](Nc1ncc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000263548985	154123433	/nfs/dbraw/zinc/12/34/33/154123433.db2.gz	JGNUCEJDUAHBQV-VIFPVBQESA-N	-1	0	271.248	2.184	10	5		CEBERM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1c1ccc([N+](=O)[O-])cn1	ZINC000022162245	171364234	/nfs/dbraw/zinc/36/42/34/171364234.db2.gz	KSQYMMLYEFTJBP-DLOVCJGASA-N	-1	0	291.307	2.212	10	5		CEBERM
O=C([O-])CCCCCN1Cc2ccc([N+](=O)[O-])cc2C1=O	ZINC000035141201	172009208	/nfs/dbraw/zinc/00/92/08/172009208.db2.gz	GBDSGRWCAODKOL-UHFFFAOYSA-N	-1	0	292.291	2.196	10	5		CEBERM
O=C([O-])CCC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000037222478	173043095	/nfs/dbraw/zinc/04/30/95/173043095.db2.gz	SMUIHSBSCVIUMK-UHFFFAOYSA-N	-1	0	262.221	2.124	10	5		CEBERM
CCN(CC)c1ncnc([N-]c2cc(C)on2)c1[N+](=O)[O-]	ZINC000040582045	174345080	/nfs/dbraw/zinc/34/50/80/174345080.db2.gz	FRZUUBSEDQMYBE-UHFFFAOYSA-N	-1	0	292.299	2.271	10	5		CEBERM
CCN(CC)c1ncnc([N-]c2ccccn2)c1[N+](=O)[O-]	ZINC000040608032	174353113	/nfs/dbraw/zinc/35/31/13/174353113.db2.gz	UBEQTWHZXBIGOD-UHFFFAOYSA-N	-1	0	288.311	2.370	10	5		CEBERM
O=C([O-])C[C@H]1CCCN1c1cccc([N+](=O)[O-])c1	ZINC000042162066	174645011	/nfs/dbraw/zinc/64/50/11/174645011.db2.gz	ZELGBUGNPIYFBE-SNVBAGLBSA-N	-1	0	250.254	2.038	10	5		CEBERM
Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1C(=O)[O-]	ZINC000071164144	176047033	/nfs/dbraw/zinc/04/70/33/176047033.db2.gz	RFGZUOUARWMPFU-UHFFFAOYSA-N	-1	0	290.231	2.447	10	5		CEBERM
C/C=C/COc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000051173656	518518636	/nfs/dbraw/zinc/51/86/36/518518636.db2.gz	OKWNCRFEVCCRCM-NSCUHMNNSA-N	-1	0	255.201	2.387	10	5		CEBERM
CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)(C)C(=O)[O-]	ZINC000061151581	520000378	/nfs/dbraw/zinc/00/03/78/520000378.db2.gz	XRBAIGMPUWVRKY-UHFFFAOYSA-N	-1	0	295.295	2.312	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000061216819	521242940	/nfs/dbraw/zinc/24/29/40/521242940.db2.gz	MODOKNSGYMXLGU-VIFPVBQESA-N	-1	0	295.295	2.169	10	5		CEBERM
CCOc1oc(-c2ccccc2[N+](=O)[O-])nc1C(=O)[O-]	ZINC000061641452	521629366	/nfs/dbraw/zinc/62/93/66/521629366.db2.gz	INGZJPLBFWKEDG-UHFFFAOYSA-N	-1	0	278.220	2.347	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc([N+](=O)[O-])c2cnccc12)C1CC1	ZINC000054521929	526315593	/nfs/dbraw/zinc/31/55/93/526315593.db2.gz	LJNPTGFNHWTTCL-CYBMUJFWSA-N	-1	0	287.275	2.418	10	5		CEBERM
O=C([O-])c1c2ccccc2oc1Cn1cnc([N+](=O)[O-])c1	ZINC000051360767	526339942	/nfs/dbraw/zinc/33/99/42/526339942.db2.gz	LYFMQTDZWKQXNA-UHFFFAOYSA-N	-1	0	287.231	2.284	10	5		CEBERM
Cc1nn(-c2ccc(C)cc2C(=O)[O-])c(C)c1[N+](=O)[O-]	ZINC000052981027	527525237	/nfs/dbraw/zinc/52/52/37/527525237.db2.gz	HHWJMVBYPJBGCX-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
O=C([O-])C[C@@H](Oc1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000062763497	527625753	/nfs/dbraw/zinc/62/57/53/527625753.db2.gz	MUYIFAKWXLSVCY-MRVPVSSYSA-N	-1	0	279.170	2.379	10	5		CEBERM
CCOC(=O)[C@H]1CCCCN1c1ccc([N+](=O)[O-])c([O-])c1	ZINC000584653834	344974165	/nfs/dbraw/zinc/97/41/65/344974165.db2.gz	HJXOELHDWOPTHT-GFCCVEGCSA-N	-1	0	294.307	2.222	10	5		CEBERM
Cc1ccnc(NC2(CC(=O)[O-])CCCC2)c1[N+](=O)[O-]	ZINC000084147643	178804026	/nfs/dbraw/zinc/80/40/26/178804026.db2.gz	ZHTLJPILNSLCCM-UHFFFAOYSA-N	-1	0	279.296	2.498	10	5		CEBERM
CC(C)[C@H](Sc1ccc([N+](=O)[O-])cn1)C(=O)[O-]	ZINC000097824615	185671326	/nfs/dbraw/zinc/67/13/26/185671326.db2.gz	LHZAUNAMESUIFK-VIFPVBQESA-N	-1	0	256.283	2.191	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(C(=O)N(CC(=O)[O-])CC(C)C)c1	ZINC000088147297	179556722	/nfs/dbraw/zinc/55/67/22/179556722.db2.gz	XCTSHNZIWZZFCK-UHFFFAOYSA-N	-1	0	294.307	2.086	10	5		CEBERM
Cc1cnc(N[C@@H]2CCCC[C@@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691780	180024559	/nfs/dbraw/zinc/02/45/59/180024559.db2.gz	OFNZILNPZPCISF-VHSXEESVSA-N	-1	0	279.296	2.354	10	5		CEBERM
Cc1cnc(N2CCCCC[C@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691768	180024769	/nfs/dbraw/zinc/02/47/69/180024769.db2.gz	CUOASCXCJQJOCK-JTQLQIEISA-N	-1	0	279.296	2.132	10	5		CEBERM
CCC[C@](C)(Nc1c([N+](=O)[O-])c(C)nn1CC)C(=O)[O-]	ZINC000091558005	180190886	/nfs/dbraw/zinc/19/08/86/180190886.db2.gz	GIQUFRULYSEABO-LBPRGKRZSA-N	-1	0	284.316	2.175	10	5		CEBERM
CC(C)c1nn(C)c(NC(C)(C)CC(=O)[O-])c1[N+](=O)[O-]	ZINC000091584419	180199853	/nfs/dbraw/zinc/19/98/53/180199853.db2.gz	BDSYVAJBAGMMFN-UHFFFAOYSA-N	-1	0	284.316	2.117	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCCC[C@H]1C(=O)[O-]	ZINC000091549543	180188818	/nfs/dbraw/zinc/18/88/18/180188818.db2.gz	XJJRRCMBPAKJPW-NXEZZACHSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCC[C@]1(C(=O)[O-])CCN(c2cc(C)c([N+](=O)[O-])cn2)C1	ZINC000092026466	180308314	/nfs/dbraw/zinc/30/83/14/180308314.db2.gz	NPLKZBQUZGYXGS-AWEZNQCLSA-N	-1	0	293.323	2.379	10	5		CEBERM
Cc1c(N(CC(=O)[O-])CC(F)(F)F)cccc1[N+](=O)[O-]	ZINC000092436635	180384795	/nfs/dbraw/zinc/38/47/95/180384795.db2.gz	ZWPQRFGMDAOYCO-UHFFFAOYSA-N	-1	0	292.213	2.357	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1C(=O)N(CC(=O)[O-])C(C)(C)C	ZINC000092446756	180386370	/nfs/dbraw/zinc/38/63/70/180386370.db2.gz	OSMKBTMFGJZLJO-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
O=C([O-])c1cccc(NC(=O)c2csc([N+](=O)[O-])c2)n1	ZINC000110935047	186334428	/nfs/dbraw/zinc/33/44/28/186334428.db2.gz	AWYVIURIVDEHGM-UHFFFAOYSA-N	-1	0	293.260	2.002	10	5		CEBERM
Cc1cc([N+](=O)[O-])cc(CC(=O)[O-])c1OC(F)(F)F	ZINC000575673103	366323810	/nfs/dbraw/zinc/32/38/10/366323810.db2.gz	BCWZIXYOTZANNZ-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
COc1cc([N+](=O)[O-])c(C(=O)[O-])cc1C(F)(F)F	ZINC000575674611	366324692	/nfs/dbraw/zinc/32/46/92/366324692.db2.gz	UCILIJMZNAMXGD-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
CCOc1c(CC(=O)[O-])cc([N+](=O)[O-])cc1OC(F)F	ZINC000575656091	366315650	/nfs/dbraw/zinc/31/56/50/366315650.db2.gz	CDWXJWIJYONIML-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCOc1c(CC(=O)[O-])cc(OC(F)F)cc1[N+](=O)[O-]	ZINC000575659777	366319984	/nfs/dbraw/zinc/31/99/84/366319984.db2.gz	YUYKNEJAEOJFRV-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
O=C([O-])c1c([N+](=O)[O-])ccc(F)c1OC(F)F	ZINC000575661694	366320817	/nfs/dbraw/zinc/32/08/17/366320817.db2.gz	UJHVFWJAGVCOEW-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])Cc1ccc([N+](=O)[O-])c(F)c1C(F)(F)F	ZINC000575710669	366338760	/nfs/dbraw/zinc/33/87/60/366338760.db2.gz	KMCXDVSZJFEGBJ-UHFFFAOYSA-N	-1	0	267.134	2.380	10	5		CEBERM
O=C([O-])Cc1cc(OC(F)(F)F)cc(F)c1[N+](=O)[O-]	ZINC000575710440	366339020	/nfs/dbraw/zinc/33/90/20/366339020.db2.gz	HQMYFHRBWMUUKE-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
CC(=O)c1cc([O-])c(Br)cc1[N+](=O)[O-]	ZINC000575691482	366330306	/nfs/dbraw/zinc/33/03/06/366330306.db2.gz	MWTHUCAYHYKQNL-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CCOC(=O)Cc1cc([N+](=O)[O-])cc([O-])c1Cl	ZINC000575701034	366334592	/nfs/dbraw/zinc/33/45/92/366334592.db2.gz	QOAGBRMJBZZVHV-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
O=C([O-])[C@@H]1CCCCCN1c1cccc([N+](=O)[O-])c1	ZINC000080991615	177748117	/nfs/dbraw/zinc/74/81/17/177748117.db2.gz	NDQUODYJQIJPQP-LBPRGKRZSA-N	-1	0	264.281	2.428	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1NC(CC)(CC)C(=O)[O-]	ZINC000094240857	184768874	/nfs/dbraw/zinc/76/88/74/184768874.db2.gz	QOIZQISTQKEIEG-UHFFFAOYSA-N	-1	0	284.316	2.175	10	5		CEBERM
O=C([O-])[C@H]1CCCCC[C@@H]1Nc1ccc([N+](=O)[O-])nc1	ZINC000094745378	184851292	/nfs/dbraw/zinc/85/12/92/184851292.db2.gz	GOEDKEZLUQPAGX-QWRGUYRKSA-N	-1	0	279.296	2.435	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@H]2CCCC[C@H]2O)c1	ZINC000211472880	394448336	/nfs/dbraw/zinc/44/83/36/394448336.db2.gz	GIGMGMPSUHAKBH-ZWNOBZJWSA-N	-1	0	294.307	2.256	10	5		CEBERM
COc1ccc(NCCCCC(=O)[O-])c([N+](=O)[O-])c1	ZINC000020474554	171218790	/nfs/dbraw/zinc/21/87/90/171218790.db2.gz	PXMPWJFVJGEDOP-UHFFFAOYSA-N	-1	0	268.269	2.270	10	5		CEBERM
C[C@H](Nc1ccc([N+](=O)[O-])c2cccnc12)C(=O)[O-]	ZINC000035407100	172177674	/nfs/dbraw/zinc/17/76/74/172177674.db2.gz	CKFZEAPPIZFJDG-ZETCQYMHSA-N	-1	0	261.237	2.028	10	5		CEBERM
O=C([O-])/C=C/c1ccc(OC(F)F)c([N+](=O)[O-])c1	ZINC000037300306	173106036	/nfs/dbraw/zinc/10/60/36/173106036.db2.gz	OUXLFBQDRYLCKP-DUXPYHPUSA-N	-1	0	259.164	2.294	10	5		CEBERM
O=C([O-])CCCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000037497296	173236621	/nfs/dbraw/zinc/23/66/21/173236621.db2.gz	SMUHWJALMLSPPD-UHFFFAOYSA-N	-1	0	286.671	2.442	10	5		CEBERM
CC[C@@H](C)C(=O)Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000037583171	173529026	/nfs/dbraw/zinc/52/90/26/173529026.db2.gz	LVBYKXRRIPVCGA-SSDOTTSWSA-N	-1	0	266.253	2.278	10	5		CEBERM
CCN(CCC(=O)[O-])c1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000038023862	174006397	/nfs/dbraw/zinc/00/63/97/174006397.db2.gz	GHFHEWIWMYTSBM-UHFFFAOYSA-N	-1	0	289.291	2.444	10	5		CEBERM
CCNc1nc[n-]c(=NNc2ccccc2)c1[N+](=O)[O-]	ZINC000040596225	174349061	/nfs/dbraw/zinc/34/90/61/174349061.db2.gz	HUVITUQRUPSMHF-UHFFFAOYSA-N	-1	0	274.284	2.256	10	5		CEBERM
CCCNc1ncnc([N-]c2nccs2)c1[N+](=O)[O-]	ZINC000040596913	174349464	/nfs/dbraw/zinc/34/94/64/174349464.db2.gz	VIPGZHQTCWGGEJ-UHFFFAOYSA-N	-1	0	280.313	2.407	10	5		CEBERM
Cc1cccnc1[N-]c1ncnc(-n2ccnc2)c1[N+](=O)[O-]	ZINC000040626126	174356357	/nfs/dbraw/zinc/35/63/57/174356357.db2.gz	SARUNIJMAJLXST-UHFFFAOYSA-N	-1	0	297.278	2.018	10	5		CEBERM
O=C([O-])c1ccnc(NCCc2ccc([N+](=O)[O-])cc2)c1	ZINC000040676298	174373784	/nfs/dbraw/zinc/37/37/84/174373784.db2.gz	STWYMVQMUINDOZ-UHFFFAOYSA-N	-1	0	287.275	2.343	10	5		CEBERM
C[C@@H]1CCC[C@@](Nc2ccc([N+](=O)[O-])nc2)(C(=O)[O-])C1	ZINC000041035184	174458266	/nfs/dbraw/zinc/45/82/66/174458266.db2.gz	JSUMDFVUTOJHSM-RNCFNFMXSA-N	-1	0	279.296	2.435	10	5		CEBERM
CCc1ccc(OC[C@H]2CC[C@@H](C(=O)[O-])O2)c([N+](=O)[O-])c1	ZINC000070497378	175957660	/nfs/dbraw/zinc/95/76/60/175957660.db2.gz	NHOAYOGZLAYAIT-MFKMUULPSA-N	-1	0	295.291	2.168	10	5		CEBERM
Cc1nc2cc(N3CC(C(=O)[O-])C3)c([N+](=O)[O-])cc2s1	ZINC000071173397	176052996	/nfs/dbraw/zinc/05/29/96/176052996.db2.gz	DTYMZTOSCJHEDT-UHFFFAOYSA-N	-1	0	293.304	2.034	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1Oc1cnc(C(=O)[O-])cn1	ZINC000071182463	176057620	/nfs/dbraw/zinc/05/76/20/176057620.db2.gz	BNIOMEIPNRAESZ-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
O=C([O-])c1cnc(Oc2ccc([N+](=O)[O-])c(F)c2)cn1	ZINC000071182479	176057788	/nfs/dbraw/zinc/05/77/88/176057788.db2.gz	HOKYLMICVSGPQV-UHFFFAOYSA-N	-1	0	279.183	2.014	10	5		CEBERM
O=C([O-])c1cc2ccccc2nc1-n1cnc([N+](=O)[O-])c1	ZINC000071386971	176147940	/nfs/dbraw/zinc/14/79/40/176147940.db2.gz	XJVYFYFHDINLSJ-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
C[C@@H](CCNC(=O)c1cccc([N+](=O)[O-])c1)CCC(=O)[O-]	ZINC000079057028	177423413	/nfs/dbraw/zinc/42/34/13/177423413.db2.gz	YGSQBACOXJGRMZ-SNVBAGLBSA-N	-1	0	294.307	2.216	10	5		CEBERM
Cc1ccnc(N[C@H]2[C@@H]3CC[C@@H](C3)[C@@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000079561927	177520399	/nfs/dbraw/zinc/52/03/99/177520399.db2.gz	XPGMHYUJAQRUID-VLEAKVRGSA-N	-1	0	291.307	2.209	10	5		CEBERM
CC(C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000062823761	519604018	/nfs/dbraw/zinc/60/40/18/519604018.db2.gz	YPQXRJVSBAKSRX-UHFFFAOYSA-N	-1	0	266.253	2.278	10	5		CEBERM
CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H](C)CC(=O)[O-]	ZINC000061181115	520000411	/nfs/dbraw/zinc/00/04/11/520000411.db2.gz	XREFLBKZRKNCBF-VIFPVBQESA-N	-1	0	295.295	2.312	10	5		CEBERM
CCN(C(=O)c1cccc([N+](=O)[O-])c1C)[C@H](C)CC(=O)[O-]	ZINC000061178230	520100839	/nfs/dbraw/zinc/10/08/39/520100839.db2.gz	JOSRQFZQTLGYII-SECBINFHSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCO[C@@H](CCOc1c(C)cc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000062763229	520304753	/nfs/dbraw/zinc/30/47/53/520304753.db2.gz	SAJVSNKHVUDNNG-LBPRGKRZSA-N	-1	0	297.307	2.470	10	5		CEBERM
CCO[C@H](COc1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000062763633	520522712	/nfs/dbraw/zinc/52/27/12/520522712.db2.gz	YUIVNQZSISOSBV-SNVBAGLBSA-N	-1	0	289.671	2.117	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1cc([N+](=O)[O-])ccc1C	ZINC000061217562	521200342	/nfs/dbraw/zinc/20/03/42/521200342.db2.gz	OUODXXSYXWUMBI-SNVBAGLBSA-N	-1	0	266.297	2.450	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])C(=O)c1cccc([N+](=O)[O-])c1C	ZINC000061215061	521245791	/nfs/dbraw/zinc/24/57/91/521245791.db2.gz	VHCHLNOYLNJXKL-VIFPVBQESA-N	-1	0	294.307	2.086	10	5		CEBERM
Cc1cc(COc2cc(C(=O)[O-])ccc2[N+](=O)[O-])on1	ZINC000049538221	524805268	/nfs/dbraw/zinc/80/52/68/524805268.db2.gz	PDEUZZOGPJTPOA-UHFFFAOYSA-N	-1	0	278.220	2.168	10	5		CEBERM
Cc1cc(NC(=O)[C@@H]2[C@H](C(=O)[O-])C2(C)C)ccc1[N+](=O)[O-]	ZINC000068688772	525223990	/nfs/dbraw/zinc/22/39/90/525223990.db2.gz	FBHYIMCYWVMQLJ-WDEREUQCSA-N	-1	0	292.291	2.199	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc(F)cc1[N+](=O)[O-])C1CC1	ZINC000054522029	526314490	/nfs/dbraw/zinc/31/44/90/526314490.db2.gz	PNAGJMWXCNMIQT-SNVBAGLBSA-N	-1	0	254.217	2.009	10	5		CEBERM
O=C([O-])[C@H](Nc1cc(F)ccc1[N+](=O)[O-])C1CC1	ZINC000054505970	526314579	/nfs/dbraw/zinc/31/45/79/526314579.db2.gz	IXKXTELQSPDJRY-SNVBAGLBSA-N	-1	0	254.217	2.009	10	5		CEBERM
O=C([O-])c1cc(COc2ccc([N+](=O)[O-])cc2F)ccn1	ZINC000068764891	526344552	/nfs/dbraw/zinc/34/45/52/526344552.db2.gz	GWWMSZIISOSLHY-UHFFFAOYSA-N	-1	0	292.222	2.406	10	5		CEBERM
O=C([O-])c1cc(OCC(F)(F)F)c(F)cc1[N+](=O)[O-]	ZINC000050018873	526353572	/nfs/dbraw/zinc/35/35/72/526353572.db2.gz	VMMWWOMMMCAVAY-UHFFFAOYSA-N	-1	0	283.133	2.373	10	5		CEBERM
Cc1oc(-c2ccc([N+](=O)[O-])cc2F)nc1C(=O)[O-]	ZINC000051086550	526732784	/nfs/dbraw/zinc/73/27/84/526732784.db2.gz	SRUZUYIMSHWAEF-UHFFFAOYSA-N	-1	0	266.184	2.396	10	5		CEBERM
Cc1nn(C)c(Sc2ccc(C(=O)[O-])o2)c1[N+](=O)[O-]	ZINC000069362766	527680764	/nfs/dbraw/zinc/68/07/64/527680764.db2.gz	KIDJBFRBNUUZFT-UHFFFAOYSA-N	-1	0	283.265	2.079	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cnc1NC1CCCCC1	ZINC000082572532	178110270	/nfs/dbraw/zinc/11/02/70/178110270.db2.gz	CITRFNQKXMOPAZ-UHFFFAOYSA-N	-1	0	265.269	2.433	10	5		CEBERM
O=C([O-])CCC1([N+](=O)[O-])C2CC3CC(C2)CC1C3	ZINC000138698374	344391085	/nfs/dbraw/zinc/39/10/85/344391085.db2.gz	LJIKAKUPUIDTTP-UHFFFAOYSA-N	-1	0	253.298	2.323	10	5		CEBERM
O=[N+]([O-])c1cc(F)c([O-])c(I)c1	ZINC000166997798	344477788	/nfs/dbraw/zinc/47/77/88/344477788.db2.gz	ARIBBOHQVSVNAY-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
C[C@@H](Nc1cc(Br)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000083730389	178732496	/nfs/dbraw/zinc/73/24/96/178732496.db2.gz	MKYOUQVPCDMCGB-RXMQYKEDSA-N	-1	0	289.085	2.242	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(Cl)c([N+](=O)[O-])cc1Cl	ZINC000396120462	344845740	/nfs/dbraw/zinc/84/57/40/344845740.db2.gz	RTVKALVBPBXYDE-SSDOTTSWSA-N	-1	0	266.036	2.020	10	5		CEBERM
Cc1cc([N+](=O)[O-])cc(Br)c1CC(=O)[O-]	ZINC000396134475	344845900	/nfs/dbraw/zinc/84/59/00/344845900.db2.gz	DOLSQVKTQSKWHQ-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@@H]1Nc1cc(F)ccc1[N+](=O)[O-]	ZINC000085329485	179019543	/nfs/dbraw/zinc/01/95/43/179019543.db2.gz	XFYCJXDIMWDFMQ-IUCAKERBSA-N	-1	0	268.244	2.399	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@@H]1Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000085329259	179019728	/nfs/dbraw/zinc/01/97/28/179019728.db2.gz	LRWIBHJBACDVPK-QWRGUYRKSA-N	-1	0	268.244	2.399	10	5		CEBERM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000085407994	179055633	/nfs/dbraw/zinc/05/56/33/179055633.db2.gz	UFADSKTZLYPSQN-NXEZZACHSA-N	-1	0	296.254	2.029	10	5		CEBERM
C[C@@H](Nc1ccc(Br)c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000086763702	179325539	/nfs/dbraw/zinc/32/55/39/179325539.db2.gz	FZZGIRTYKODPAA-RXMQYKEDSA-N	-1	0	289.085	2.242	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(C(=O)NC(C)(C)CCC(=O)[O-])c1	ZINC000088147280	179555873	/nfs/dbraw/zinc/55/58/73/179555873.db2.gz	NMVFKAQFKCTMRD-UHFFFAOYSA-N	-1	0	294.307	2.276	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1OCC1(CC(=O)[O-])CC1	ZINC000088256568	179571213	/nfs/dbraw/zinc/57/12/13/179571213.db2.gz	JDGVUABXMMPYSW-UHFFFAOYSA-N	-1	0	281.264	2.237	10	5		CEBERM
O=C([O-])c1cc(NC[C@@H]2CCC[C@H]2CO)ccc1[N+](=O)[O-]	ZINC000089502178	179805536	/nfs/dbraw/zinc/80/55/36/179805536.db2.gz	GXWMSVIMELOJID-UWVGGRQHSA-N	-1	0	294.307	2.114	10	5		CEBERM
Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccsc1	ZINC000090868455	180048946	/nfs/dbraw/zinc/04/89/46/180048946.db2.gz	OXEVSACVYDZKLA-UHFFFAOYSA-N	-1	0	299.333	2.039	10	5		CEBERM
CC(C)c1nn(C)c(N[C@@H]2CC[C@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000091577853	180197694	/nfs/dbraw/zinc/19/76/94/180197694.db2.gz	RMKNNFFLBMEFOW-DTWKUNHWSA-N	-1	0	296.327	2.117	10	5		CEBERM
CCC[C@H](CNc1c([N+](=O)[O-])c(C)nn1CC)C(=O)[O-]	ZINC000091549776	180188651	/nfs/dbraw/zinc/18/86/51/180188651.db2.gz	HNMDYWPCDWYLHT-SECBINFHSA-N	-1	0	284.316	2.032	10	5		CEBERM
Cc1cc(N[C@H]2CCCC[C@@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000092026516	180308338	/nfs/dbraw/zinc/30/83/38/180308338.db2.gz	GFBSIVQJJIIYRP-UWVGGRQHSA-N	-1	0	279.296	2.354	10	5		CEBERM
CCCC[C@H](Nc1cc(C)c([N+](=O)[O-])cn1)C(=O)[O-]	ZINC000092026344	180308646	/nfs/dbraw/zinc/30/86/46/180308646.db2.gz	ODEDCJLLRWBXQM-VIFPVBQESA-N	-1	0	267.285	2.354	10	5		CEBERM
Cc1c(N[C@@H](CO)C(C)C)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000092401339	180377634	/nfs/dbraw/zinc/37/76/34/180377634.db2.gz	XZMFVALKFJRUOM-NSHDSACASA-N	-1	0	282.296	2.030	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000092448238	180387079	/nfs/dbraw/zinc/38/70/79/180387079.db2.gz	ICAJVFNKAVUPRQ-UHFFFAOYSA-N	-1	0	295.295	2.312	10	5		CEBERM
O=C([O-])c1cc(-n2ccc([N+](=O)[O-])n2)c2ccccc2n1	ZINC000109586664	186264394	/nfs/dbraw/zinc/26/43/94/186264394.db2.gz	WJQZHEXLMUTXGY-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
COc1cc(C(F)(F)F)cc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575673740	366325171	/nfs/dbraw/zinc/32/51/71/366325171.db2.gz	NLCBTDSQDPOLGJ-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
CCOc1c([N+](=O)[O-])ccc(CC(=O)[O-])c1OC(F)F	ZINC000575656188	366315568	/nfs/dbraw/zinc/31/55/68/366315568.db2.gz	FARKYGHOQGJKNV-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1cc([N+](=O)[O-])c(CC(=O)[O-])cc1OC(F)F	ZINC000575660573	366320368	/nfs/dbraw/zinc/32/03/68/366320368.db2.gz	SILHIKCOWMGDBJ-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(C(F)(F)F)cc([N+](=O)[O-])c1Cl	ZINC000575696703	366332912	/nfs/dbraw/zinc/33/29/12/366332912.db2.gz	ZAOVAJCTYBDFDZ-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)c1cc(Br)c([O-])cc1[N+](=O)[O-]	ZINC000575699636	366333681	/nfs/dbraw/zinc/33/36/81/366333681.db2.gz	KUARQVWHPXLMFL-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
CCOC(=O)Cc1c(F)ccc([N+](=O)[O-])c1[S-]	ZINC000575701627	366334121	/nfs/dbraw/zinc/33/41/21/366334121.db2.gz	RWEAGGIRSPDWHP-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
CC[C@](C)(Nc1ccc(OC)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000094221840	184765161	/nfs/dbraw/zinc/76/51/61/184765161.db2.gz	LTHAVZVKQGSIRA-LBPRGKRZSA-N	-1	0	268.269	2.269	10	5		CEBERM
COCC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)[O-])CC1	ZINC000078439047	134489864	/nfs/dbraw/zinc/48/98/64/134489864.db2.gz	IFAYBKQMYNQSGO-UHFFFAOYSA-N	-1	0	294.307	2.156	10	5		CEBERM
CCO[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(=O)[O-])C1	ZINC000042423045	134890604	/nfs/dbraw/zinc/89/06/04/134890604.db2.gz	LPGDZDRBIJMLSU-LLVKDONJSA-N	-1	0	294.307	2.298	10	5		CEBERM
C/C=C/C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(C)c1)C(=O)[O-]	ZINC000263305853	154052658	/nfs/dbraw/zinc/05/26/58/154052658.db2.gz	VXAFNPUJOCXVRW-UFFNRZRYSA-N	-1	0	292.291	2.052	10	5		CEBERM
COc1ccc2c(c1)c(=O)c1ccccc1n2CC(=O)[O-]	ZINC000005586726	170116272	/nfs/dbraw/zinc/11/62/72/170116272.db2.gz	JUCYALRHLVLHEH-UHFFFAOYSA-N	-1	0	283.283	2.248	10	5		CEBERM
Cc1cccc(O[C@@H](C(=O)[O-])C(C)C)c1[N+](=O)[O-]	ZINC000035283359	172102183	/nfs/dbraw/zinc/10/21/83/172102183.db2.gz	QZMCSTTWUSRIRS-LLVKDONJSA-N	-1	0	253.254	2.391	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1O[C@H](C(=O)[O-])C(C)C	ZINC000035677985	172349245	/nfs/dbraw/zinc/34/92/45/172349245.db2.gz	IWJPGNSOFVUNTR-NSHDSACASA-N	-1	0	253.254	2.391	10	5		CEBERM
CCN(CCC(=O)[O-])c1cccc(F)c1[N+](=O)[O-]	ZINC000038023835	174006015	/nfs/dbraw/zinc/00/60/15/174006015.db2.gz	FNTRFNLCKPVYOI-UHFFFAOYSA-N	-1	0	256.233	2.035	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1Nc1ncccc1C(=O)[O-]	ZINC000040384912	174251540	/nfs/dbraw/zinc/25/15/40/174251540.db2.gz	OQSKFFSYNTZJSG-UHFFFAOYSA-N	-1	0	289.247	2.440	10	5		CEBERM
C[C@@H]1CCC[C@](Nc2ncccc2[N+](=O)[O-])(C(=O)[O-])C1	ZINC000041035030	174458186	/nfs/dbraw/zinc/45/81/86/174458186.db2.gz	WWTJJOUFYXRUCQ-NOZJJQNGSA-N	-1	0	279.296	2.435	10	5		CEBERM
O=C([O-])C[C@H]1CCCN1c1cc(F)cc([N+](=O)[O-])c1	ZINC000042161913	174644724	/nfs/dbraw/zinc/64/47/24/174644724.db2.gz	XIWGATLGOLGPJU-SECBINFHSA-N	-1	0	268.244	2.177	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])cc2C)c(C)c1CC(=O)[O-]	ZINC000043299237	175000163	/nfs/dbraw/zinc/00/01/63/175000163.db2.gz	HSWVWMNCHWXDEA-UHFFFAOYSA-N	-1	0	289.291	2.333	10	5		CEBERM
Cc1c(NC[C@@H]2CCCOC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000044933613	175280829	/nfs/dbraw/zinc/28/08/29/175280829.db2.gz	QTQPGEPRZDSXHZ-JTQLQIEISA-N	-1	0	294.307	2.440	10	5		CEBERM
Cc1cc(CNc2ccc(C(=O)[O-])cc2[N+](=O)[O-])on1	ZINC000045010873	175290085	/nfs/dbraw/zinc/29/00/85/175290085.db2.gz	XMGHPNWCFHJMJS-UHFFFAOYSA-N	-1	0	277.236	2.202	10	5		CEBERM
O=[N+]([O-])c1cc(-c2n[nH]c(-c3ccncc3)n2)ccc1[O-]	ZINC000072237675	176346550	/nfs/dbraw/zinc/34/65/50/176346550.db2.gz	UKQAGVHIAFMHCG-UHFFFAOYSA-N	-1	0	283.247	2.148	10	5		CEBERM
CCc1ccc(O[C@H](CC)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000078788894	177388560	/nfs/dbraw/zinc/38/85/60/177388560.db2.gz	YATDBUHOIAAOFD-SNVBAGLBSA-N	-1	0	253.254	2.399	10	5		CEBERM
Cc1ccc(N2CCC[C@]2(C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000079484777	177501139	/nfs/dbraw/zinc/50/11/39/177501139.db2.gz	CGVDWALJDPKHJH-CYBMUJFWSA-N	-1	0	264.281	2.347	10	5		CEBERM
Cc1nn(-c2nc(C)cc(C)c2C(=O)[O-])c(C)c1[N+](=O)[O-]	ZINC000037978294	302727607	/nfs/dbraw/zinc/72/76/07/302727607.db2.gz	CCOPTVPSFQJYOS-UHFFFAOYSA-N	-1	0	290.279	2.107	10	5		CEBERM
CCC[C@@]1(C(=O)[O-])CCCN(c2ccncc2[N+](=O)[O-])C1	ZINC000062875397	520945625	/nfs/dbraw/zinc/94/56/25/520945625.db2.gz	BKZHZYUMXLPIAV-CQSZACIVSA-N	-1	0	293.323	2.461	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1Oc1cccc(C(=O)[O-])n1	ZINC000051041723	522986315	/nfs/dbraw/zinc/98/63/15/522986315.db2.gz	LTWAMTAJIAXWJV-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
COCCN(CC(C)C)c1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070232678	523681910	/nfs/dbraw/zinc/68/19/10/523681910.db2.gz	VVMCAQWWRNEWHE-UHFFFAOYSA-N	-1	0	296.323	2.402	10	5		CEBERM
CC[C@H](C(=O)[O-])N(C)c1c(F)c(F)ccc1[N+](=O)[O-]	ZINC000053162489	523808028	/nfs/dbraw/zinc/80/80/28/523808028.db2.gz	AMMLDEAEBCXNGH-SSDOTTSWSA-N	-1	0	274.223	2.172	10	5		CEBERM
Cc1cc(C)c(OCc2cc(C(=O)[O-])no2)c([N+](=O)[O-])c1	ZINC000050441751	524311140	/nfs/dbraw/zinc/31/11/40/524311140.db2.gz	VKCWTHUGKVVJJT-UHFFFAOYSA-N	-1	0	292.247	2.477	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1CC1(C(=O)[O-])CCOCC1	ZINC000061674674	525458234	/nfs/dbraw/zinc/45/82/34/525458234.db2.gz	NJTPHDIXWRVBGY-UHFFFAOYSA-N	-1	0	295.291	2.027	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1-c1nccc(C(=O)[O-])n1	ZINC000054792673	526068016	/nfs/dbraw/zinc/06/80/16/526068016.db2.gz	DAGFAMHIIMTKBC-UHFFFAOYSA-N	-1	0	259.221	2.058	10	5		CEBERM
C[C@H](C(=O)[O-])N(C)c1ccc2scnc2c1[N+](=O)[O-]	ZINC000054054774	526180429	/nfs/dbraw/zinc/18/04/29/526180429.db2.gz	VSJLLFVEYSYYLV-ZCFIWIBFSA-N	-1	0	281.293	2.114	10	5		CEBERM
O=C([O-])c1cc(N2CCC[C@@H]2CCCO)ccc1[N+](=O)[O-]	ZINC000052763845	526348577	/nfs/dbraw/zinc/34/85/77/526348577.db2.gz	CWPBORDUDLTRNX-SNVBAGLBSA-N	-1	0	294.307	2.034	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(OCc2ccccn2)c1	ZINC000050517677	526383817	/nfs/dbraw/zinc/38/38/17/526383817.db2.gz	MNYGOQDCNXSSHI-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
O=C([O-])c1cccnc1NCc1cccc([N+](=O)[O-])c1	ZINC000052926084	526398628	/nfs/dbraw/zinc/39/86/28/526398628.db2.gz	ADWDLKKAMIOMRK-UHFFFAOYSA-N	-1	0	273.248	2.300	10	5		CEBERM
O=C([O-])/C=C/c1ccc(OC2CCOCC2)c([N+](=O)[O-])c1	ZINC000069290782	527547023	/nfs/dbraw/zinc/54/70/23/527547023.db2.gz	NRZFNOOLTVARJS-DUXPYHPUSA-N	-1	0	293.275	2.250	10	5		CEBERM
CCC[C@@H](Nc1ncnc2sc([N+](=O)[O-])cc21)C(=O)[O-]	ZINC000261798538	629242753	/nfs/dbraw/zinc/24/27/53/629242753.db2.gz	RBIRWIQHAYWZCP-SSDOTTSWSA-N	-1	0	296.308	2.265	10	5		CEBERM
O=C([O-])c1c(F)cc([N+](=O)[O-])cc1Br	ZINC000221102991	344538997	/nfs/dbraw/zinc/53/89/97/344538997.db2.gz	RLLZDZKCCNTZDW-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
Cc1cc(Br)c(C(=O)[O-])c([N+](=O)[O-])c1	ZINC000221106575	344539334	/nfs/dbraw/zinc/53/93/34/344539334.db2.gz	ZQRXQHPYCAVWRF-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1C/C(Cl)=C/Cl	ZINC000086000450	179214007	/nfs/dbraw/zinc/21/40/07/179214007.db2.gz	XKNOLCBRGYKTJB-DJWKRKHSSA-N	-1	0	265.052	2.414	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])C(=O)c1cc(C)ccc1[N+](=O)[O-]	ZINC000088147294	179556760	/nfs/dbraw/zinc/55/67/60/179556760.db2.gz	SUKIYIXSLKNKBT-JTQLQIEISA-N	-1	0	294.307	2.086	10	5		CEBERM
Cc1cnc(NC[C@H]2CCC[C@@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691808	180024927	/nfs/dbraw/zinc/02/49/27/180024927.db2.gz	LTNVPTGHYNBFKP-ZJUUUORDSA-N	-1	0	279.296	2.211	10	5		CEBERM
C[C@@H](Nc1ncccc1[N+](=O)[O-])c1nc(C(=O)[O-])cs1	ZINC000090943089	180068961	/nfs/dbraw/zinc/06/89/61/180068961.db2.gz	FWUZMQAQRBHFSO-ZCFIWIBFSA-N	-1	0	294.292	2.318	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](C(=O)[O-])C(C)C	ZINC000091555910	180190402	/nfs/dbraw/zinc/19/04/02/180190402.db2.gz	VIYQLJKPJRCAFR-SNVBAGLBSA-N	-1	0	298.343	2.278	10	5		CEBERM
CCCC[C@H](Nc1c([N+](=O)[O-])c(CCC)nn1C)C(=O)[O-]	ZINC000091562006	180191937	/nfs/dbraw/zinc/19/19/37/180191937.db2.gz	CWOABJMQRIIBLO-JTQLQIEISA-N	-1	0	298.343	2.336	10	5		CEBERM
C[C@H](c1ccc(C(=O)[O-])o1)n1cc(Cl)c([N+](=O)[O-])n1	ZINC000091779958	180252454	/nfs/dbraw/zinc/25/24/54/180252454.db2.gz	OLDOEQCEXUVHIC-RXMQYKEDSA-N	-1	0	285.643	2.345	10	5		CEBERM
COC(=O)c1cc(=O)c2ccc3ccccc3c2[n-]1	ZINC000109596912	186265667	/nfs/dbraw/zinc/26/56/67/186265667.db2.gz	XWQMPHXNXUFZGO-UHFFFAOYSA-N	-1	0	253.257	2.468	10	5		CEBERM
CC[C@@H](C(=O)[O-])N(C)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000110624917	186306298	/nfs/dbraw/zinc/30/62/98/186306298.db2.gz	TZVNDZPKSWWZOR-QMMMGPOBSA-N	-1	0	286.259	2.042	10	5		CEBERM
Cc1cc([C@H](O)C(=O)[O-])c([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000575673067	366323759	/nfs/dbraw/zinc/32/37/59/366323759.db2.gz	AFAFVSAWBAYGMI-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
Cc1cc([C@H](O)C(=O)[O-])cc([N+](=O)[O-])c1C(F)(F)F	ZINC000575675787	366324672	/nfs/dbraw/zinc/32/46/72/366324672.db2.gz	YILNYWXLEBWIPL-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCc1c(C(=O)[O-])cc(OC(F)F)cc1[N+](=O)[O-]	ZINC000575659448	366318778	/nfs/dbraw/zinc/31/87/78/366318778.db2.gz	MSXZJKOHLQSKHP-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCOC(=O)Cc1c([S-])c(F)ccc1[N+](=O)[O-]	ZINC000575701988	366334971	/nfs/dbraw/zinc/33/49/71/366334971.db2.gz	ZHKGBQKJLSCCFA-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
CC(C)(C)OC(=O)c1n[n-]c2cc([N+](=O)[O-])ccc21	ZINC000141109975	366563891	/nfs/dbraw/zinc/56/38/91/366563891.db2.gz	RSGTXHWRSLRNNL-UHFFFAOYSA-N	-1	0	263.253	2.426	10	5		CEBERM
O=c1c(-c2nnn[n-]2)coc2c3ccccc3ccc12	ZINC000095186859	364342015	/nfs/dbraw/zinc/34/20/15/364342015.db2.gz	LBIIFWPYHLLIRW-UHFFFAOYSA-N	-1	0	264.244	2.126	10	5		CEBERM
C[C@H]1[C@@H](C(=O)[O-])CCN1c1cc(F)cc([N+](=O)[O-])c1	ZINC000092923089	184635919	/nfs/dbraw/zinc/63/59/19/184635919.db2.gz	GYQMBBFCLYDRJX-CPCISQLKSA-N	-1	0	268.244	2.033	10	5		CEBERM
CC[C@@H](CCO)CNc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000094957050	184903814	/nfs/dbraw/zinc/90/38/14/184903814.db2.gz	UMANPIJNDSKSNM-VIFPVBQESA-N	-1	0	282.296	2.114	10	5		CEBERM
CC(C)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000130312356	394885881	/nfs/dbraw/zinc/88/58/81/394885881.db2.gz	KLUQSFHALSWJAT-MRVPVSSYSA-N	-1	0	252.270	2.075	10	5		CEBERM
O=C([O-])Cc1cc([N+](=O)[O-])ccc1OC(F)(F)F	ZINC000575338353	395659985	/nfs/dbraw/zinc/65/99/85/395659985.db2.gz	WJXTTZMHJUEFRL-UHFFFAOYSA-N	-1	0	265.143	2.121	10	5		CEBERM
O=C([O-])Cc1cccc(OC(F)(F)F)c1[N+](=O)[O-]	ZINC000575345691	395660547	/nfs/dbraw/zinc/66/05/47/395660547.db2.gz	OSFXCMMDIXYASY-UHFFFAOYSA-N	-1	0	265.143	2.121	10	5		CEBERM
Cc1cc2cc(O)cc(O)c2c2oc(=O)cc([O-])c12	ZINC000006070476	170174087	/nfs/dbraw/zinc/17/40/87/170174087.db2.gz	URYCWSZWYNTGEX-UHFFFAOYSA-N	-1	0	258.229	2.371	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1CS[C@H](C)C(=O)[O-]	ZINC000037011370	172869289	/nfs/dbraw/zinc/86/92/89/172869289.db2.gz	XPAYCASBKLDTLA-SSDOTTSWSA-N	-1	0	271.294	2.310	10	5		CEBERM
COc1cc(C(=O)[O-])c([N+](=O)[O-])cc1OCC(C)C	ZINC000037226475	173046350	/nfs/dbraw/zinc/04/63/50/173046350.db2.gz	HGFRTTYIAXVOSG-UHFFFAOYSA-N	-1	0	269.253	2.336	10	5		CEBERM
Cc1cccnc1[N-]c1ncnc(Cl)c1[N+](=O)[O-]	ZINC000040571265	174338640	/nfs/dbraw/zinc/33/86/40/174338640.db2.gz	UPKKWVQYZKRATB-UHFFFAOYSA-N	-1	0	265.660	2.485	10	5		CEBERM
Cc1nccn1-c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043386508	175031968	/nfs/dbraw/zinc/03/19/68/175031968.db2.gz	ZXYOLHUTVGMNJZ-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
Cc1c(N(C)C[C@H]2CCCO2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043387117	175032785	/nfs/dbraw/zinc/03/27/85/175032785.db2.gz	UXUPAUHQBQNTPV-LLVKDONJSA-N	-1	0	294.307	2.217	10	5		CEBERM
O=C([O-])Cc1csc(-c2ccccc2[N+](=O)[O-])n1	ZINC000044732050	175240731	/nfs/dbraw/zinc/24/07/31/175240731.db2.gz	QSQFUCZNPVLFPU-UHFFFAOYSA-N	-1	0	264.262	2.345	10	5		CEBERM
Cc1ccnc(N[C@H]2CCC[C@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000070495631	175957033	/nfs/dbraw/zinc/95/70/33/175957033.db2.gz	YSKQWWUVLPRDRJ-UWVGGRQHSA-N	-1	0	279.296	2.354	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H](NC(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000070555473	175984185	/nfs/dbraw/zinc/98/41/85/175984185.db2.gz	LYQCVISFTZBDIF-CBAPKCEASA-N	-1	0	298.320	2.030	10	5		CEBERM
O=C(c1cccc([N+](=O)[O-])c1[O-])N1CC[C@H]2CCC[C@@H]21	ZINC000393452609	262365277	/nfs/dbraw/zinc/36/52/77/262365277.db2.gz	YAOMDULZYSBMLU-KOLCDFICSA-N	-1	0	276.292	2.315	10	5		CEBERM
CCN(C(=O)c1cccc(C)c1[N+](=O)[O-])[C@H](C)CC(=O)[O-]	ZINC000061178278	520098207	/nfs/dbraw/zinc/09/82/07/520098207.db2.gz	AZWPYPUGJRKGEP-SNVBAGLBSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1ccc(C)cc1[N+](=O)[O-]	ZINC000061217918	521200107	/nfs/dbraw/zinc/20/01/07/521200107.db2.gz	FJAKWXYXOPOGKN-SNVBAGLBSA-N	-1	0	266.297	2.450	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1O[C@H](C)CCC(=O)[O-]	ZINC000050955593	522983413	/nfs/dbraw/zinc/98/34/13/522983413.db2.gz	LJZZVGGVKCALBA-MRVPVSSYSA-N	-1	0	269.253	2.236	10	5		CEBERM
CN(C[C@@H]1CCCCO1)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000048553567	523035945	/nfs/dbraw/zinc/03/59/45/523035945.db2.gz	FWCBJBYFFXQFPN-NSHDSACASA-N	-1	0	294.307	2.298	10	5		CEBERM
CCn1ccnc1COc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000054743628	523542082	/nfs/dbraw/zinc/54/20/82/523542082.db2.gz	HNOLWSYEHFTCOD-UHFFFAOYSA-N	-1	0	291.263	2.088	10	5		CEBERM
CN(c1cccnc1)c1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000070231268	523658157	/nfs/dbraw/zinc/65/81/57/523658157.db2.gz	YCYBNQUFKFTLSH-UHFFFAOYSA-N	-1	0	273.248	2.456	10	5		CEBERM
C[C@@H](CC(=O)[O-])Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000061832156	524392175	/nfs/dbraw/zinc/39/21/75/524392175.db2.gz	YTERQHCGTORNMX-MRVPVSSYSA-N	-1	0	291.263	2.298	10	5		CEBERM
Cc1cc(NC(=O)[C@H]2[C@@H](C(=O)[O-])C2(C)C)ccc1[N+](=O)[O-]	ZINC000068688775	525238110	/nfs/dbraw/zinc/23/81/10/525238110.db2.gz	FBHYIMCYWVMQLJ-MNOVXSKESA-N	-1	0	292.291	2.199	10	5		CEBERM
Cc1cc(Sc2ccc([N+](=O)[O-])c(C(=O)[O-])c2)n(C)n1	ZINC000052308241	525442329	/nfs/dbraw/zinc/44/23/29/525442329.db2.gz	FDOXXAZMXHGPGD-UHFFFAOYSA-N	-1	0	293.304	2.486	10	5		CEBERM
C[C@H](SCCc1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000062726093	525975938	/nfs/dbraw/zinc/97/59/38/525975938.db2.gz	DJBDSSBVUFKMSC-QMMMGPOBSA-N	-1	0	255.295	2.344	10	5		CEBERM
Cc1ncn(-c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)c1C	ZINC000051926214	527461803	/nfs/dbraw/zinc/46/18/03/527461803.db2.gz	LNYQOHRWPQSNPV-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
O=C([O-])C[C@H](Oc1ccc([N+](=O)[O-])cc1)C(F)(F)F	ZINC000062763531	527634255	/nfs/dbraw/zinc/63/42/55/527634255.db2.gz	LKOPADSDRQBICD-QMMMGPOBSA-N	-1	0	279.170	2.379	10	5		CEBERM
O=C([O-])[C@@H](Nc1cc(F)cc([N+](=O)[O-])c1)C1CC1	ZINC000054505837	527655854	/nfs/dbraw/zinc/65/58/54/527655854.db2.gz	MCUPEDBEACVPMO-JTQLQIEISA-N	-1	0	254.217	2.009	10	5		CEBERM
O=C([O-])c1ccc(Br)c([N+](=O)[O-])c1F	ZINC000306904837	344718468	/nfs/dbraw/zinc/71/84/68/344718468.db2.gz	VHVZJUGOZVJLBB-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
C[C@@](Nc1ccc([N+](=O)[O-])cc1F)(C(=O)[O-])C1CC1	ZINC000084095982	178787402	/nfs/dbraw/zinc/78/74/02/178787402.db2.gz	UFNNOXFBLXFXBA-LBPRGKRZSA-N	-1	0	268.244	2.399	10	5		CEBERM
O=C([O-])C(=O)CCCCCc1ccc([N+](=O)[O-])cc1	ZINC000584652684	344973439	/nfs/dbraw/zinc/97/34/39/344973439.db2.gz	RYTMFVSFZRZYDW-UHFFFAOYSA-N	-1	0	265.265	2.351	10	5		CEBERM
O=C([O-])c1ccn(-c2cc(F)c(Cl)cc2[N+](=O)[O-])n1	ZINC000097361383	185589587	/nfs/dbraw/zinc/58/95/87/185589587.db2.gz	YBBPQECLDBEOAB-UHFFFAOYSA-N	-1	0	285.618	2.271	10	5		CEBERM
Cc1c(NC(=O)[C@H]2[C@@H](C(=O)[O-])C2(C)C)cccc1[N+](=O)[O-]	ZINC000085408018	179055646	/nfs/dbraw/zinc/05/56/46/179055646.db2.gz	INKQJXSSGONOTI-MNOVXSKESA-N	-1	0	292.291	2.199	10	5		CEBERM
CC[C@@H](CNc1cc([N+](=O)[O-])ccc1C)C(=O)[O-]	ZINC000087510874	179437386	/nfs/dbraw/zinc/43/73/86/179437386.db2.gz	KUMAHLVZIGPGJT-VIFPVBQESA-N	-1	0	252.270	2.426	10	5		CEBERM
Cc1nn(C)c(C)c1Oc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000088453218	179607531	/nfs/dbraw/zinc/60/75/31/179607531.db2.gz	DJNBHSWRHMFDCT-UHFFFAOYSA-N	-1	0	291.263	2.436	10	5		CEBERM
O=C([O-])c1ccc(NC[C@@H]2CCC[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000089502208	179805334	/nfs/dbraw/zinc/80/53/34/179805334.db2.gz	QZURTGVZOFMQGQ-WDEREUQCSA-N	-1	0	294.307	2.114	10	5		CEBERM
Cc1cnc(N[C@@H]2CCC[C@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000090691728	180024781	/nfs/dbraw/zinc/02/47/81/180024781.db2.gz	CUCGKUYIICECPD-VHSXEESVSA-N	-1	0	279.296	2.354	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1S[C@@H](C)C(=O)[O-]	ZINC000091556418	180190050	/nfs/dbraw/zinc/19/00/50/180190050.db2.gz	SCILEONSHSDQMC-ZETCQYMHSA-N	-1	0	273.314	2.075	10	5		CEBERM
CC(C)c1nn(C)c(NC[C@@H](C(=O)[O-])C(C)C)c1[N+](=O)[O-]	ZINC000091576845	180198021	/nfs/dbraw/zinc/19/80/21/180198021.db2.gz	MLFBEFZDQGDKSG-SECBINFHSA-N	-1	0	298.343	2.220	10	5		CEBERM
CC(C)c1nn(C)c(N[C@](C)(C(=O)[O-])C2CC2)c1[N+](=O)[O-]	ZINC000091583890	180199821	/nfs/dbraw/zinc/19/98/21/180199821.db2.gz	ZMQIICQUIKRSDQ-ZDUSSCGKSA-N	-1	0	296.327	2.117	10	5		CEBERM
Cc1nn([C@@H](C)c2ccc(C(=O)[O-])o2)c(C)c1[N+](=O)[O-]	ZINC000091779702	180252487	/nfs/dbraw/zinc/25/24/87/180252487.db2.gz	VZRMUKLIQUSZKT-ZETCQYMHSA-N	-1	0	279.252	2.309	10	5		CEBERM
Cc1cc(N2CCCCC[C@@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000092026496	180308848	/nfs/dbraw/zinc/30/88/48/180308848.db2.gz	OXMDRDNDXYXTCL-SNVBAGLBSA-N	-1	0	279.296	2.132	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N[C@@H]1C=C[C@H](C(=O)[O-])C1	ZINC000092182992	180339357	/nfs/dbraw/zinc/33/93/57/180339357.db2.gz	AEPWRXRUMAQISZ-VHSXEESVSA-N	-1	0	262.265	2.344	10	5		CEBERM
CCOC(OCC)C(=O)C=C([O-])c1ccc([N+](=O)[O-])cc1	ZINC000106606406	186129300	/nfs/dbraw/zinc/12/93/00/186129300.db2.gz	WRLYSRLKMHWNGM-UHFFFAOYSA-N	-1	0	295.291	2.136	10	5		CEBERM
O=C([O-])CN(Cc1cccc([N+](=O)[O-])c1)CC(F)(F)F	ZINC000092442591	180385919	/nfs/dbraw/zinc/38/59/19/180385919.db2.gz	PUICXPHBVZWHRC-UHFFFAOYSA-N	-1	0	292.213	2.044	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NCC1CCOCC1	ZINC000111179066	186366174	/nfs/dbraw/zinc/36/61/74/186366174.db2.gz	YGWWGHBLYSJLKR-UHFFFAOYSA-N	-1	0	280.280	2.132	10	5		CEBERM
O=[N+]([O-])c1cc([S@](=O)[O-])c(Cl)cc1Cl	ZINC000675061984	540081901	/nfs/dbraw/zinc/08/19/01/540081901.db2.gz	XCGWUEMJQVGJRT-UHFFFAOYSA-N	-1	0	256.066	2.482	10	5		CEBERM
Cc1cc([N+](=O)[O-])cc(OC(F)F)c1CC(=O)[O-]	ZINC000575667491	366323818	/nfs/dbraw/zinc/32/38/18/366323818.db2.gz	NSWCTXTZDSPZRX-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
COc1c(C(=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575673233	366323850	/nfs/dbraw/zinc/32/38/50/366323850.db2.gz	GJWMOSXRAIIUDI-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
CCOc1ccc([N+](=O)[O-])c(CC(=O)[O-])c1OC(F)F	ZINC000575657654	366317391	/nfs/dbraw/zinc/31/73/91/366317391.db2.gz	KWSMUKJQDGTAHJ-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1cc([N+](=O)[O-])cc(CC(=O)[O-])c1OC(F)F	ZINC000575660104	366320283	/nfs/dbraw/zinc/32/02/83/366320283.db2.gz	MHMQOOBXYIKIOA-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CCc1cc(CC(=O)[O-])c([N+](=O)[O-])cc1OC(F)F	ZINC000575660405	366320444	/nfs/dbraw/zinc/32/04/44/366320444.db2.gz	PILPSIHECQATPA-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=C([O-])c1cc(F)cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575661976	366320735	/nfs/dbraw/zinc/32/07/35/366320735.db2.gz	XWUOJWMKWFLRQY-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
CCc1c(CC(=O)[O-])cc([N+](=O)[O-])cc1OC(F)F	ZINC000575660791	366321195	/nfs/dbraw/zinc/32/11/95/366321195.db2.gz	YHORSUVYNQLNKI-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(OC(F)F)cc1CC(=O)[O-]	ZINC000575665981	366322297	/nfs/dbraw/zinc/32/22/97/366322297.db2.gz	GESFRQYURNCYSO-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(C(F)(F)F)c([N+](=O)[O-])cc1Cl	ZINC000575695866	366331185	/nfs/dbraw/zinc/33/11/85/366331185.db2.gz	UIFIPSZUFGWLQC-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)c1cc(Br)cc([O-])c1[N+](=O)[O-]	ZINC000575700290	366333463	/nfs/dbraw/zinc/33/34/63/366333463.db2.gz	UEKNPUPRPKNLCT-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
Cc1cccc(OCC(C)(C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000093703526	184707732	/nfs/dbraw/zinc/70/77/32/184707732.db2.gz	YSTGOEZGISHOJU-UHFFFAOYSA-N	-1	0	253.254	2.393	10	5		CEBERM
CC[C@@H](C)CNC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000263164908	154028213	/nfs/dbraw/zinc/02/82/13/154028213.db2.gz	IRSHJTMKIIMKMY-MRVPVSSYSA-N	-1	0	280.280	2.069	10	5		CEBERM
CC(C)(Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)[O-]	ZINC000034248714	171835320	/nfs/dbraw/zinc/83/53/20/171835320.db2.gz	KOJOOQKYUUHEBG-UHFFFAOYSA-N	-1	0	268.225	2.156	10	5		CEBERM
C[C@@H](SCCc1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000035677518	172348309	/nfs/dbraw/zinc/34/83/09/172348309.db2.gz	HCEMFQPDAVQJDI-MRVPVSSYSA-N	-1	0	255.295	2.344	10	5		CEBERM
O=C([O-])c1occc1COc1cccc([N+](=O)[O-])c1	ZINC000037333262	173134596	/nfs/dbraw/zinc/13/45/96/173134596.db2.gz	NLFYJTXGBPUNMD-UHFFFAOYSA-N	-1	0	263.205	2.465	10	5		CEBERM
O=[N+]([O-])c1c(Cl)ncnc1[N-]c1ccccn1	ZINC000040571301	174338355	/nfs/dbraw/zinc/33/83/55/174338355.db2.gz	XYPAGUFFMZRIBD-UHFFFAOYSA-N	-1	0	251.633	2.177	10	5		CEBERM
Cc1cc(C)cc(Oc2nc[n-]c(=NN)c2[N+](=O)[O-])c1	ZINC000040582742	174345628	/nfs/dbraw/zinc/34/56/28/174345628.db2.gz	FQIHJEDFMDELCS-UHFFFAOYSA-N	-1	0	275.268	2.080	10	5		CEBERM
CC(C)Nc1ncnc([N-]c2ccccn2)c1[N+](=O)[O-]	ZINC000040597496	174349459	/nfs/dbraw/zinc/34/94/59/174349459.db2.gz	CKEANNZNTUXICL-UHFFFAOYSA-N	-1	0	274.284	2.344	10	5		CEBERM
O=C([O-])c1ccc(NCCc2ccc([N+](=O)[O-])cc2)nc1	ZINC000040676299	174374024	/nfs/dbraw/zinc/37/40/24/174374024.db2.gz	AKGQUCNPIORYAL-UHFFFAOYSA-N	-1	0	287.275	2.343	10	5		CEBERM
COc1ccc(Oc2ccc([N+](=O)[O-])cn2)c(C(=O)[O-])c1	ZINC000043334251	175010644	/nfs/dbraw/zinc/01/06/44/175010644.db2.gz	CRGHJCOAJBDKFS-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
Cc1c(NCC2CC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386733	175032390	/nfs/dbraw/zinc/03/23/90/175032390.db2.gz	BQYUHTZXKRBTFZ-UHFFFAOYSA-N	-1	0	250.254	2.423	10	5		CEBERM
COC[C@@H](C)N(C)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043387135	175032519	/nfs/dbraw/zinc/03/25/19/175032519.db2.gz	UGODSHYXAFGKCW-MRVPVSSYSA-N	-1	0	282.296	2.073	10	5		CEBERM
COCCSc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043387283	175032661	/nfs/dbraw/zinc/03/26/61/175032661.db2.gz	JPPVUZXTPSYWQP-UHFFFAOYSA-N	-1	0	271.294	2.340	10	5		CEBERM
O=C([O-])CC1(CNc2ncc([N+](=O)[O-])cn2)CCCCC1	ZINC000043413561	175037541	/nfs/dbraw/zinc/03/75/41/175037541.db2.gz	KKWXFJHGIKAPIF-UHFFFAOYSA-N	-1	0	294.311	2.222	10	5		CEBERM
O=C([O-])c1ccc(NC(=O)[C@@H]2CCCS2)c([N+](=O)[O-])c1	ZINC000070435825	175929973	/nfs/dbraw/zinc/92/99/73/175929973.db2.gz	GORNBFYFOKNHFW-JTQLQIEISA-N	-1	0	296.304	2.127	10	5		CEBERM
C/C(C(=O)[O-])=C(\C)C(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000071165020	176047908	/nfs/dbraw/zinc/04/79/08/176047908.db2.gz	KDUBLINCZFVMMY-HJWRWDBZSA-N	-1	0	278.264	2.263	10	5		CEBERM
CCOC[C@H](C)Nc1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070232831	520140658	/nfs/dbraw/zinc/14/06/58/520140658.db2.gz	OZGSYYMDISGUED-QMMMGPOBSA-N	-1	0	268.269	2.130	10	5		CEBERM
CCCOc1cc(/C=C/C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000050518172	520299252	/nfs/dbraw/zinc/29/92/52/520299252.db2.gz	QUPRHYNKBMLGLM-GQCTYLIASA-N	-1	0	251.238	2.481	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1ccccc1[N+](=O)[O-]	ZINC000061217611	521200339	/nfs/dbraw/zinc/20/03/39/521200339.db2.gz	QPPXMAVYMBECQX-SECBINFHSA-N	-1	0	252.270	2.142	10	5		CEBERM
C[C@@H]1CN(c2cc([N+](=O)[O-])ccc2C(=O)[O-])CC(C)(C)O1	ZINC000070232886	525064196	/nfs/dbraw/zinc/06/41/96/525064196.db2.gz	RNEZZFPXWZRUOH-SECBINFHSA-N	-1	0	294.307	2.297	10	5		CEBERM
Cc1cc(NC(=O)C2(C(=O)[O-])CCC2)ccc1[N+](=O)[O-]	ZINC000050292766	525114458	/nfs/dbraw/zinc/11/44/58/525114458.db2.gz	OAJOUNMMRSLCNL-UHFFFAOYSA-N	-1	0	278.264	2.097	10	5		CEBERM
Cc1cc(Oc2nccnc2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000054553556	525388401	/nfs/dbraw/zinc/38/84/01/525388401.db2.gz	AWYXIXZGPCLDCX-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(C)cc1OC[C@@H]1CC[C@@H](C(=O)[O-])O1	ZINC000062997627	525556064	/nfs/dbraw/zinc/55/60/64/525556064.db2.gz	LZGWCAMQLICCLN-JQWIXIFHSA-N	-1	0	295.291	2.223	10	5		CEBERM
C[C@@H](Nc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F)[C@H]1CCCO1	ZINC000050030092	525696973	/nfs/dbraw/zinc/69/69/73/525696973.db2.gz	UACQIWWJYLVRTF-JMCQJSRRSA-N	-1	0	298.270	2.412	10	5		CEBERM
Cc1c(N(CC(=O)[O-])CC2CC2)cccc1[N+](=O)[O-]	ZINC000062723459	525817240	/nfs/dbraw/zinc/81/72/40/525817240.db2.gz	IYPHIMFVOAJSQW-UHFFFAOYSA-N	-1	0	264.281	2.204	10	5		CEBERM
Cc1c([N+](=O)[O-])cccc1N1CCC[C@H]1CC(=O)[O-]	ZINC000062723519	525930855	/nfs/dbraw/zinc/93/08/55/525930855.db2.gz	XRYLLOCWOHFPJN-JTQLQIEISA-N	-1	0	264.281	2.347	10	5		CEBERM
O=C([O-])c1ccnc(NCc2cccc([N+](=O)[O-])c2)c1	ZINC000052926077	526400085	/nfs/dbraw/zinc/40/00/85/526400085.db2.gz	PPPBZUGKVPKVFS-UHFFFAOYSA-N	-1	0	273.248	2.300	10	5		CEBERM
CCC[C@H](Nc1ncnc2sc([N+](=O)[O-])cc21)C(=O)[O-]	ZINC000261798539	623382532	/nfs/dbraw/zinc/38/25/32/623382532.db2.gz	RBIRWIQHAYWZCP-ZETCQYMHSA-N	-1	0	296.308	2.265	10	5		CEBERM
Cc1cc(Br)c([N+](=O)[O-])cc1C(=O)[O-]	ZINC000137849531	344388673	/nfs/dbraw/zinc/38/86/73/344388673.db2.gz	ZAKVEORHPUAYTP-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(Br)cc1C(=O)[O-]	ZINC000306607518	344715670	/nfs/dbraw/zinc/71/56/70/344715670.db2.gz	UNFUIVARUDBLCA-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
O=C([O-])[C@@H](O)c1c(Cl)cc([N+](=O)[O-])cc1Cl	ZINC000396121432	344845379	/nfs/dbraw/zinc/84/53/79/344845379.db2.gz	UPNHPGLWFDUAQI-ZETCQYMHSA-N	-1	0	266.036	2.020	10	5		CEBERM
Cn1c2ccccc2c2ccc(F)cc2/c(=N\[O-])c1=O	ZINC000584638092	344970936	/nfs/dbraw/zinc/97/09/36/344970936.db2.gz	PGZVXGVQBVDRRN-SAPNQHFASA-N	-1	0	270.263	2.121	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])nc1	ZINC000085330473	179020391	/nfs/dbraw/zinc/02/03/91/179020391.db2.gz	RHXKPYYELAJBIM-VHSXEESVSA-N	-1	0	265.269	2.045	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCCC[C@@H]1C(=O)[O-]	ZINC000085330573	179020571	/nfs/dbraw/zinc/02/05/71/179020571.db2.gz	MOWYRPZCAIZAIN-QWRGUYRKSA-N	-1	0	279.296	2.354	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1NC[C@H]1CCCC[C@H]1O	ZINC000086017045	179216347	/nfs/dbraw/zinc/21/63/47/179216347.db2.gz	WGKQRCKEAAUFSD-NOZJJQNGSA-N	-1	0	294.307	2.256	10	5		CEBERM
CCC[C@H](CNc1c([N+](=O)[O-])c(C)nn1CCC)C(=O)[O-]	ZINC000091555920	180190076	/nfs/dbraw/zinc/19/00/76/180190076.db2.gz	QHLKLZPOJDMIGG-SNVBAGLBSA-N	-1	0	298.343	2.423	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCC[C@H]1C(=O)[O-]	ZINC000091555900	180190204	/nfs/dbraw/zinc/19/02/04/180190204.db2.gz	OXGRQCNOHNIGBN-ZJUUUORDSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCc1nn(C)c(NC2(CC(=O)[O-])CCCC2)c1[N+](=O)[O-]	ZINC000091575812	180197275	/nfs/dbraw/zinc/19/72/75/180197275.db2.gz	STABZABXPUGSLI-UHFFFAOYSA-N	-1	0	296.327	2.090	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1NC(=O)N1CCCCC1	ZINC000091968999	180294598	/nfs/dbraw/zinc/29/45/98/180294598.db2.gz	GGTSTDHFZIYHCZ-UHFFFAOYSA-N	-1	0	293.279	2.311	10	5		CEBERM
C[C@@H](Nc1ccc([N+](=O)[O-])cc1C(F)F)c1nnn[n-]1	ZINC000111290775	186390949	/nfs/dbraw/zinc/39/09/49/186390949.db2.gz	HCDWDCZYDQQJNF-RXMQYKEDSA-N	-1	0	284.226	2.219	10	5		CEBERM
O=C([O-])c1cncc(Oc2ccccc2[N+](=O)[O-])c1	ZINC000111686189	186441983	/nfs/dbraw/zinc/44/19/83/186441983.db2.gz	RLJJWGNDGBLXEX-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
CCc1cc(OC(F)F)cc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575658017	366317711	/nfs/dbraw/zinc/31/77/11/366317711.db2.gz	DRBVVBMKZWCNMR-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCOc1cc(OC(F)F)c(C(=O)[O-])c([N+](=O)[O-])c1	ZINC000575658723	366319060	/nfs/dbraw/zinc/31/90/60/366319060.db2.gz	VIUKBZDFDVHLLJ-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1c(OC(F)F)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575659786	366320072	/nfs/dbraw/zinc/32/00/72/366320072.db2.gz	ZCZAEXCQQGCSIL-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCc1cc(C(=O)[O-])c([N+](=O)[O-])cc1OC(F)F	ZINC000575660479	366320106	/nfs/dbraw/zinc/32/01/06/366320106.db2.gz	WLLZBWJMQSWMFH-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1c(F)cc(OC(F)F)cc1[N+](=O)[O-]	ZINC000575661991	366320841	/nfs/dbraw/zinc/32/08/41/366320841.db2.gz	YOWZOMFIIMOLNH-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])c1cc(OC(F)F)c(F)cc1[N+](=O)[O-]	ZINC000575661436	366321001	/nfs/dbraw/zinc/32/10/01/366321001.db2.gz	PQNNBCFLGQRRFF-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
COc1c(OC(F)F)cc([S-])cc1[N+](=O)[O-]	ZINC000575664951	366322275	/nfs/dbraw/zinc/32/22/75/366322275.db2.gz	MLMJIHXUAMUROJ-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
Cc1c(OC(F)F)cc(CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000575664957	366322434	/nfs/dbraw/zinc/32/24/34/366322434.db2.gz	AKEXGIRKNFRKSU-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cc(OC(F)(F)F)c1F	ZINC000575711263	366340150	/nfs/dbraw/zinc/34/01/50/366340150.db2.gz	PLTAQNWRYHSZHK-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
CCOC(=O)c1cc([N+](=O)[O-])c([O-])cc1Br	ZINC000575700631	366333403	/nfs/dbraw/zinc/33/34/03/366333403.db2.gz	WJFANEDVYIAFPL-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
CCOC(=O)c1cc([N+](=O)[O-])c(Br)cc1[O-]	ZINC000575700194	366334143	/nfs/dbraw/zinc/33/41/43/366334143.db2.gz	PMQBRAMBGCSEAT-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
O=C([O-])[C@H](O)c1cccc2c(=O)c3ccccc3oc21	ZINC000026717455	361644283	/nfs/dbraw/zinc/64/42/83/361644283.db2.gz	QIVFYOPEEIUGTM-CYBMUJFWSA-N	-1	0	270.240	2.064	10	5		CEBERM
O=C([O-])[C@@H](O)c1cccc2c(=O)c3ccccc3oc21	ZINC000026717460	361644459	/nfs/dbraw/zinc/64/44/59/361644459.db2.gz	QIVFYOPEEIUGTM-ZDUSSCGKSA-N	-1	0	270.240	2.064	10	5		CEBERM
O=C([O-])[C@H]1CCCN1Sc1ccccc1[N+](=O)[O-]	ZINC000002391001	304188311	/nfs/dbraw/zinc/18/83/11/304188311.db2.gz	ZVSQNFDSXRIAHI-SECBINFHSA-N	-1	0	268.294	2.151	10	5		CEBERM
O=C([O-])c1c(F)cc(Br)cc1[N+](=O)[O-]	ZINC000261507876	190040289	/nfs/dbraw/zinc/04/02/89/190040289.db2.gz	NDJPAWIBZAMBIT-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
C[C@@H](C(=O)[O-])[C@@H](C)n1ncc2ccc([N+](=O)[O-])cc21	ZINC000093017618	184642694	/nfs/dbraw/zinc/64/26/94/184642694.db2.gz	FHDFYPKBRHNYFM-HTQZYQBOSA-N	-1	0	263.253	2.226	10	5		CEBERM
O=C([O-])c1ccc(OCc2ccc([N+](=O)[O-])o2)cc1	ZINC000036896485	172787849	/nfs/dbraw/zinc/78/78/49/172787849.db2.gz	MCZWNQRIHNDOEG-UHFFFAOYSA-N	-1	0	263.205	2.465	10	5		CEBERM
COc1ccc(N[C@@H](C(=O)[O-])C(C)C)c([N+](=O)[O-])c1	ZINC000037453292	173219055	/nfs/dbraw/zinc/21/90/55/173219055.db2.gz	XXUJUBQKQOEHTG-LLVKDONJSA-N	-1	0	268.269	2.125	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1Cc1cccc([N+](=O)[O-])c1	ZINC000041040427	174462940	/nfs/dbraw/zinc/46/29/40/174462940.db2.gz	KJDVBDYUEYGIKF-UHFFFAOYSA-N	-1	0	291.219	2.051	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1-c1nnc(SCC(=O)[O-])o1	ZINC000044747829	175243623	/nfs/dbraw/zinc/24/36/23/175243623.db2.gz	ABZXXHMIMMXJPE-UHFFFAOYSA-N	-1	0	295.276	2.130	10	5		CEBERM
Cc1c(Oc2cnc(C(=O)[O-])cn2)cccc1[N+](=O)[O-]	ZINC000071182462	176057605	/nfs/dbraw/zinc/05/76/05/176057605.db2.gz	KZDWGOQMYFCLRX-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
C[C@@]1(C(=O)[O-])CCCN1c1cccc([N+](=O)[O-])c1	ZINC000079486246	177502201	/nfs/dbraw/zinc/50/22/01/177502201.db2.gz	JCCSXVNGNANVTR-LBPRGKRZSA-N	-1	0	250.254	2.038	10	5		CEBERM
CCC[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000043474543	270228340	/nfs/dbraw/zinc/22/83/40/270228340.db2.gz	BGZNMLMXQCAQQP-SNVBAGLBSA-N	-1	0	299.258	2.109	10	5		CEBERM
CCc1nccc(N(C(=O)[O-])C2CC2)c1[N+](=O)[O-]	ZINC000095934159	288640237	/nfs/dbraw/zinc/64/02/37/288640237.db2.gz	FASJJGHKQNXCOV-UHFFFAOYSA-N	-1	0	251.242	2.199	10	5		CEBERM
N#[N+]c1c([O-])cc(S(=O)(=O)[O-])c2cc([N+](=O)[O-])ccc21	ZINC000006094216	303219049	/nfs/dbraw/zinc/21/90/49/303219049.db2.gz	CCFWJWRQXDDAEJ-UHFFFAOYSA-O	-1	0	296.240	2.185	10	5		CEBERM
CN(C(=O)Nc1ccc([N+](=O)[O-])cc1F)C(C)(C)C(=O)[O-]	ZINC000061176667	523886105	/nfs/dbraw/zinc/88/61/05/523886105.db2.gz	VRGZUFJLPFMGNF-UHFFFAOYSA-N	-1	0	299.258	2.061	10	5		CEBERM
C[C@H]1C[C@@H]1Nc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000052293907	524855676	/nfs/dbraw/zinc/85/56/76/524855676.db2.gz	XQRUQTCRUFSIJX-XNCJUZBTSA-N	-1	0	254.217	2.252	10	5		CEBERM
C[C@](Nc1ncccc1[N+](=O)[O-])(C(=O)[O-])c1ccccc1	ZINC000052879828	525156589	/nfs/dbraw/zinc/15/65/89/525156589.db2.gz	VDLHSVHAZNRQMH-CQSZACIVSA-N	-1	0	287.275	2.402	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1NC1(C(=O)[O-])CCCC1	ZINC000052812076	525576763	/nfs/dbraw/zinc/57/67/63/525576763.db2.gz	RCBLSUAJBHDCKA-UHFFFAOYSA-N	-1	0	265.269	2.108	10	5		CEBERM
O=C([O-])c1ccc(N2CCC[C@H]2CCCO)c([N+](=O)[O-])c1	ZINC000052763840	526373659	/nfs/dbraw/zinc/37/36/59/526373659.db2.gz	YXNAZGFHOQLKQS-NSHDSACASA-N	-1	0	294.307	2.034	10	5		CEBERM
O=C([O-])c1ccc(Sc2cc([N+](=O)[O-])ccn2)o1	ZINC000069362547	526383366	/nfs/dbraw/zinc/38/33/66/526383366.db2.gz	WBBANVTYYPTHFZ-UHFFFAOYSA-N	-1	0	266.234	2.432	10	5		CEBERM
O=C([O-])/C=C/c1ccc([N+](=O)[O-])c(OC2CCOCC2)c1	ZINC000069308400	527547062	/nfs/dbraw/zinc/54/70/62/527547062.db2.gz	LHLJSIAABHREBN-DUXPYHPUSA-N	-1	0	293.275	2.250	10	5		CEBERM
CCC[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000148356412	631095084	/nfs/dbraw/zinc/09/50/84/631095084.db2.gz	XCMDCHMKCYBJPJ-SSDOTTSWSA-N	-1	0	273.676	2.308	10	5		CEBERM
O=C([O-])[C@H](O)c1ccc([N+](=O)[O-])c(Cl)c1Cl	ZINC000396123215	344845424	/nfs/dbraw/zinc/84/54/24/344845424.db2.gz	YJAPEVINTYVAEV-SSDOTTSWSA-N	-1	0	266.036	2.020	10	5		CEBERM
Cc1ccc(CC(=O)[O-])c(Br)c1[N+](=O)[O-]	ZINC000396134073	344845947	/nfs/dbraw/zinc/84/59/47/344845947.db2.gz	CFZWMKPRCSGGMS-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
COc1cc(N2CCCCC[C@@H]2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000083896144	178760293	/nfs/dbraw/zinc/76/02/93/178760293.db2.gz	BDLHXDRPHOMVSK-GFCCVEGCSA-N	-1	0	294.307	2.437	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])cn1	ZINC000085329849	179020363	/nfs/dbraw/zinc/02/03/63/179020363.db2.gz	VOHSCYISRKJUCT-NXEZZACHSA-N	-1	0	265.269	2.045	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@H]1Nc1cc([N+](=O)[O-])ccn1	ZINC000085329767	179020409	/nfs/dbraw/zinc/02/04/09/179020409.db2.gz	OWHRNNASXYRDRL-VHSXEESVSA-N	-1	0	265.269	2.045	10	5		CEBERM
CC[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(=O)[O-]	ZINC000087499156	179436044	/nfs/dbraw/zinc/43/60/44/179436044.db2.gz	RSWYWWALWNPULY-VIFPVBQESA-N	-1	0	295.295	2.136	10	5		CEBERM
CCc1ccc(Oc2cncc(C(=O)[O-])n2)c([N+](=O)[O-])c1	ZINC000091417617	180149925	/nfs/dbraw/zinc/14/99/25/180149925.db2.gz	CYKVTFJHIOWQHV-UHFFFAOYSA-N	-1	0	289.247	2.438	10	5		CEBERM
O=c1c2c([n-]n1-c1ccccc1[N+](=O)[O-])CCCC2	ZINC000104931028	186032639	/nfs/dbraw/zinc/03/26/39/186032639.db2.gz	JMQWDOPXCKSNRL-VIFPVBQESA-N	-1	0	259.265	2.488	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@@H](CC(C)C)C(=O)[O-]	ZINC000091554860	180189837	/nfs/dbraw/zinc/18/98/37/180189837.db2.gz	BIBBYZQHMJADHY-JTQLQIEISA-N	-1	0	298.343	2.421	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@H](Nc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000092182801	180339541	/nfs/dbraw/zinc/33/95/41/180339541.db2.gz	GYBAYRKGGVXWLH-APPZFPTMSA-N	-1	0	266.228	2.175	10	5		CEBERM
O=C([O-])CN(CC(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000092436748	180385275	/nfs/dbraw/zinc/38/52/75/180385275.db2.gz	JXGDKBUYXSRLFY-UHFFFAOYSA-N	-1	0	278.186	2.048	10	5		CEBERM
O=C([O-])CN(Cc1csc([N+](=O)[O-])c1)CC(F)(F)F	ZINC000092444961	180385707	/nfs/dbraw/zinc/38/57/07/180385707.db2.gz	MYBTUHOWCFLLMR-UHFFFAOYSA-N	-1	0	298.242	2.105	10	5		CEBERM
CCCOc1cc(N[C@@H](C)c2nnn[n-]2)ccc1[N+](=O)[O-]	ZINC000111049037	186348022	/nfs/dbraw/zinc/34/80/22/186348022.db2.gz	RPQLQUVYKUVDNR-QMMMGPOBSA-N	-1	0	292.299	2.070	10	5		CEBERM
C[C@@H](C(=O)[O-])N(C)c1ccc([N+](=O)[O-])cc1C(F)F	ZINC000111289591	186390984	/nfs/dbraw/zinc/39/09/84/186390984.db2.gz	QLKHWRNQQGJROU-LURJTMIESA-N	-1	0	274.223	2.442	10	5		CEBERM
O=C([O-])/C=C(/Br)c1ccc([N+](=O)[O-])cc1	ZINC000033374021	304023369	/nfs/dbraw/zinc/02/33/69/304023369.db2.gz	XKZDUCREGROOCM-VMPITWQZSA-N	-1	0	272.054	2.415	10	5		CEBERM
Cc1cc(OC(F)F)cc([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575669029	366323714	/nfs/dbraw/zinc/32/37/14/366323714.db2.gz	XLNHJOPRKAXXAP-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
COc1cc([N+](=O)[O-])cc([S-])c1OC(F)F	ZINC000575666555	366323808	/nfs/dbraw/zinc/32/38/08/366323808.db2.gz	WAFIVJDVMXGJBR-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
CCOc1c(C(=O)[O-])cc(OC(F)F)cc1[N+](=O)[O-]	ZINC000575659759	366320518	/nfs/dbraw/zinc/32/05/18/366320518.db2.gz	YHOQJIDWKFKTEX-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
Cc1cc(OC(F)F)cc(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575665505	366322391	/nfs/dbraw/zinc/32/23/91/366322391.db2.gz	FMZAXQKHVKFCJL-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(Cl)c(C(F)(F)F)c([N+](=O)[O-])c1	ZINC000575696574	366332894	/nfs/dbraw/zinc/33/28/94/366332894.db2.gz	XJNHOQMCGIDUTD-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
O=C([O-])COc1cccc2c(=O)c3ccccc3oc12	ZINC000026722466	361644764	/nfs/dbraw/zinc/64/47/64/361644764.db2.gz	XYCATILRTUMTTP-UHFFFAOYSA-N	-1	0	270.240	2.410	10	5		CEBERM
COc1ccc(OCC(C)(C)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000093703369	184708020	/nfs/dbraw/zinc/70/80/20/184708020.db2.gz	YRFPMMLGIBRBLZ-UHFFFAOYSA-N	-1	0	269.253	2.093	10	5		CEBERM
CC[C@@](C)(Nc1c([N+](=O)[O-])c(C(C)C)nn1C)C(=O)[O-]	ZINC000094221643	184764994	/nfs/dbraw/zinc/76/49/94/184764994.db2.gz	RDRLYLQXOSAZPV-GFCCVEGCSA-N	-1	0	284.316	2.117	10	5		CEBERM
O=C([O-])[C@@H]1CCCCC[C@H]1Nc1ccc([N+](=O)[O-])nc1	ZINC000094745379	184851336	/nfs/dbraw/zinc/85/13/36/184851336.db2.gz	GOEDKEZLUQPAGX-GHMZBOCLSA-N	-1	0	279.296	2.435	10	5		CEBERM
CC[C@@H](NC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)C(C)C	ZINC000262651483	131247296	/nfs/dbraw/zinc/24/72/96/131247296.db2.gz	KPDKWPUNTDBAGH-GFCCVEGCSA-N	-1	0	294.307	2.457	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1OC(F)(F)F	ZINC000575345747	395660556	/nfs/dbraw/zinc/66/05/56/395660556.db2.gz	VZMNKVMIKSPEFA-UHFFFAOYSA-N	-1	0	251.116	2.192	10	5		CEBERM
C[C@@H]1OCCC[C@@H]1C(=O)Nc1ccc([O-])c([N+](=O)[O-])c1	ZINC000191275149	153164882	/nfs/dbraw/zinc/16/48/82/153164882.db2.gz	CRULMSXPKHHXSJ-WPRPVWTQSA-N	-1	0	280.280	2.054	10	5		CEBERM
CC[C@H](C)[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1C)C(=O)[O-]	ZINC000019269959	170766493	/nfs/dbraw/zinc/76/64/93/170766493.db2.gz	DAYJHUVCGLQKMT-QPUJVOFHSA-N	-1	0	294.307	2.132	10	5		CEBERM
Cc1nn(-c2ccc(Cl)c(C(=O)[O-])n2)c(C)c1[N+](=O)[O-]	ZINC000019965709	170947042	/nfs/dbraw/zinc/94/70/42/170947042.db2.gz	RQOCZEFALBWEBK-UHFFFAOYSA-N	-1	0	296.670	2.144	10	5		CEBERM
CC[C@@H](C)[C@@H](NC(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)[O-]	ZINC000020362123	171160961	/nfs/dbraw/zinc/16/09/61/171160961.db2.gz	YLNPMBIUFXJKCY-PRHODGIISA-N	-1	0	294.307	2.132	10	5		CEBERM
COc1ccc(OCCCCC(=O)[O-])c([N+](=O)[O-])c1	ZINC000020474339	171218705	/nfs/dbraw/zinc/21/87/05/171218705.db2.gz	ZQDWCBAIZIMGPC-UHFFFAOYSA-N	-1	0	269.253	2.237	10	5		CEBERM
Cc1cc(COc2ccc(C(=O)[O-])cc2[N+](=O)[O-])on1	ZINC000037295698	173099289	/nfs/dbraw/zinc/09/92/89/173099289.db2.gz	HFDLODLMXBICFE-UHFFFAOYSA-N	-1	0	278.220	2.168	10	5		CEBERM
Cc1c(OC[C@H]2CCCO2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386572	175032663	/nfs/dbraw/zinc/03/26/63/175032663.db2.gz	IMHZBVHWJNFSPR-SNVBAGLBSA-N	-1	0	281.264	2.159	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000070555013	175983562	/nfs/dbraw/zinc/98/35/62/175983562.db2.gz	HVBMOAVSBLJYBQ-YUMQZZPRSA-N	-1	0	298.320	2.030	10	5		CEBERM
CC(C)CN(CC(=O)[O-])c1ccc([N+](=O)[O-])cc1F	ZINC000062742685	519712189	/nfs/dbraw/zinc/71/21/89/519712189.db2.gz	XJTDFEWJVDSNIL-UHFFFAOYSA-N	-1	0	270.260	2.281	10	5		CEBERM
CCN(C(=O)c1ccc(F)c([N+](=O)[O-])c1)[C@@H](C)CC(=O)[O-]	ZINC000061180292	520084664	/nfs/dbraw/zinc/08/46/64/520084664.db2.gz	UHMSUYOOFCJVOP-QMMMGPOBSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCCOCCC(=O)Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000054434319	520253609	/nfs/dbraw/zinc/25/36/09/520253609.db2.gz	KDCVVUXTNHDPLI-UHFFFAOYSA-N	-1	0	296.279	2.048	10	5		CEBERM
CCO[C@@H](CCOc1ccc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000062763941	520305113	/nfs/dbraw/zinc/30/51/13/520305113.db2.gz	YATOWEULDPTCJV-LBPRGKRZSA-N	-1	0	283.280	2.162	10	5		CEBERM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000068688770	520649083	/nfs/dbraw/zinc/64/90/83/520649083.db2.gz	JHWCLEVLBDGFQP-UWVGGRQHSA-N	-1	0	296.254	2.029	10	5		CEBERM
CCCC[C@@H](Nc1ncc([N+](=O)[O-])s1)C(=O)[O-]	ZINC000226760193	521107211	/nfs/dbraw/zinc/10/72/11/521107211.db2.gz	LJIQZIBDEIDSNZ-ZCFIWIBFSA-N	-1	0	259.287	2.107	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1ccc(C)c([N+](=O)[O-])c1	ZINC000061700639	521199664	/nfs/dbraw/zinc/19/96/64/521199664.db2.gz	SICFAVCKZHIJBP-SNVBAGLBSA-N	-1	0	266.297	2.450	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1ccc([N+](=O)[O-])cc1F	ZINC000061217892	521248096	/nfs/dbraw/zinc/24/80/96/521248096.db2.gz	VCOUNNVNFWDEIN-QMMMGPOBSA-N	-1	0	270.260	2.281	10	5		CEBERM
CC[C@H](C(=O)[O-])N(C)c1cccc([N+](=O)[O-])c1C	ZINC000062723547	523808639	/nfs/dbraw/zinc/80/86/39/523808639.db2.gz	MKUKJMDDNUZHAV-SECBINFHSA-N	-1	0	252.270	2.203	10	5		CEBERM
Cc1cc(C)c(OC[C@@H]2CC[C@H](C(=O)[O-])O2)c([N+](=O)[O-])c1	ZINC000051393955	524311635	/nfs/dbraw/zinc/31/16/35/524311635.db2.gz	CEBNUZQHNALIME-CMPLNLGQSA-N	-1	0	295.291	2.223	10	5		CEBERM
Cc1cc(N(C)C(C)(C)C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000061171172	525014165	/nfs/dbraw/zinc/01/41/65/525014165.db2.gz	ILYQAFJFDALOSY-UHFFFAOYSA-N	-1	0	252.270	2.203	10	5		CEBERM
Cc1cc(N[C@@H](C(=O)[O-])C2CC2)ccc1[N+](=O)[O-]	ZINC000054521889	525291230	/nfs/dbraw/zinc/29/12/30/525291230.db2.gz	LPOBYJGWFKAYNF-LLVKDONJSA-N	-1	0	250.254	2.178	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1CC(C)(C)C(=O)[O-]	ZINC000054631464	525458750	/nfs/dbraw/zinc/45/87/50/525458750.db2.gz	FMEFSLXZRRPLQH-UHFFFAOYSA-N	-1	0	253.254	2.257	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1NC(C)(C)CCC(=O)[O-]	ZINC000052812106	525575734	/nfs/dbraw/zinc/57/57/34/525575734.db2.gz	PZBYHQPBMLBAEU-UHFFFAOYSA-N	-1	0	267.285	2.354	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(OCc2cscn2)c1	ZINC000049826976	526383760	/nfs/dbraw/zinc/38/37/60/526383760.db2.gz	GHJUWSJYHOCVML-UHFFFAOYSA-N	-1	0	280.261	2.329	10	5		CEBERM
O=C([O-])c1ccc([S@](=O)Cc2ccc([N+](=O)[O-])cc2)o1	ZINC000069363263	526384945	/nfs/dbraw/zinc/38/49/45/526384945.db2.gz	YVQINQVYEGBUOA-FQEVSTJZSA-N	-1	0	295.272	2.194	10	5		CEBERM
O=C([O-])/C=C/c1cc([N+](=O)[O-])ccc1OC1CCOCC1	ZINC000069308380	527544899	/nfs/dbraw/zinc/54/48/99/527544899.db2.gz	UGDREZURLHIFMJ-DAFODLJHSA-N	-1	0	293.275	2.250	10	5		CEBERM
O=C([O-])C1(CCc2ccc([N+](=O)[O-])cc2)CCOCC1	ZINC000061674722	527555263	/nfs/dbraw/zinc/55/52/63/527555263.db2.gz	NJVFOOOLXCTSPR-UHFFFAOYSA-N	-1	0	279.292	2.409	10	5		CEBERM
O=C([O-])C[C@H](Oc1ccccc1[N+](=O)[O-])C(F)(F)F	ZINC000062763582	527634477	/nfs/dbraw/zinc/63/44/77/527634477.db2.gz	XIDVQKLBQZSIFP-QMMMGPOBSA-N	-1	0	279.170	2.379	10	5		CEBERM
Cc1cc(=O)c2c([O-])c3c(O)cc(O)cc3cc2o1	ZINC000014815122	560099045	/nfs/dbraw/zinc/09/90/45/560099045.db2.gz	RVRLLYKHCMHGKV-UHFFFAOYSA-N	-1	0	258.229	2.371	10	5	endogenous,in-man	CEBERM
Cc1cc([N+](=O)[O-])ccc1N1C[C@H](C(=O)[O-])[C@H](C)C1	ZINC000223797414	639435570	/nfs/dbraw/zinc/43/55/70/639435570.db2.gz	RLMHLZHWXQNWPR-KOLCDFICSA-N	-1	0	264.281	2.060	10	5		CEBERM
O=C([O-])c1ccc(-c2ccccc2CO)cc1[N+](=O)[O-]	ZINC000095495065	184997931	/nfs/dbraw/zinc/99/79/31/184997931.db2.gz	CACVWDWLZUUQQP-UHFFFAOYSA-N	-1	0	273.244	2.452	10	5		CEBERM
Cc1c(NC(=O)[C@@H]2[C@@H](C(=O)[O-])C2(C)C)cccc1[N+](=O)[O-]	ZINC000085408016	179055324	/nfs/dbraw/zinc/05/53/24/179055324.db2.gz	INKQJXSSGONOTI-QWRGUYRKSA-N	-1	0	292.291	2.199	10	5		CEBERM
O=C([O-])c1ccc(NC[C@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000086016869	179216571	/nfs/dbraw/zinc/21/65/71/179216571.db2.gz	LOLNHPKHBXIJBD-MFKMUULPSA-N	-1	0	294.307	2.256	10	5		CEBERM
CCN(C(=O)c1cc(C)ccc1[N+](=O)[O-])[C@H](C)CC(=O)[O-]	ZINC000088147292	179556761	/nfs/dbraw/zinc/55/67/61/179556761.db2.gz	ULTLEOPOYONDCV-SNVBAGLBSA-N	-1	0	294.307	2.229	10	5		CEBERM
O=C([O-])c1ccc(NC[C@H]2CCC[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000089502209	179805338	/nfs/dbraw/zinc/80/53/38/179805338.db2.gz	QZURTGVZOFMQGQ-GHMZBOCLSA-N	-1	0	294.307	2.114	10	5		CEBERM
O=C([O-])c1csc(CNc2ccccc2[N+](=O)[O-])n1	ZINC000090933270	180066622	/nfs/dbraw/zinc/06/66/22/180066622.db2.gz	RLAUTTICWKLIEH-UHFFFAOYSA-N	-1	0	279.277	2.362	10	5		CEBERM
O=C([O-])c1csc(CNc2cccc([N+](=O)[O-])c2)n1	ZINC000090933266	180066874	/nfs/dbraw/zinc/06/68/74/180066874.db2.gz	AOOWWCOOMWVMKI-UHFFFAOYSA-N	-1	0	279.277	2.362	10	5		CEBERM
O=C([O-])c1csc(CCNc2ccccc2[N+](=O)[O-])n1	ZINC000090943936	180069583	/nfs/dbraw/zinc/06/95/83/180069583.db2.gz	IAGBBPTWXLNZLR-UHFFFAOYSA-N	-1	0	293.304	2.404	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1NC[C@H](CC)C(=O)[O-]	ZINC000091555915	180190271	/nfs/dbraw/zinc/19/02/71/180190271.db2.gz	TZWNPDRUYYWSFN-VIFPVBQESA-N	-1	0	284.316	2.032	10	5		CEBERM
CCc1nn(C)c(SCC2(CC(=O)[O-])CC2)c1[N+](=O)[O-]	ZINC000091559813	180191223	/nfs/dbraw/zinc/19/12/23/180191223.db2.gz	COZDAKPYMTUVOJ-UHFFFAOYSA-N	-1	0	299.352	2.238	10	5		CEBERM
O=C([O-])c1cccn1CCc1ccc([N+](=O)[O-])cc1	ZINC000091840292	180269111	/nfs/dbraw/zinc/26/91/11/180269111.db2.gz	KSLDMFHVROBNML-UHFFFAOYSA-N	-1	0	260.249	2.337	10	5		CEBERM
O=C([O-])c1ccc(NC(=O)N2CCCCC2)c([N+](=O)[O-])c1	ZINC000091968988	180294385	/nfs/dbraw/zinc/29/43/85/180294385.db2.gz	QYFSXCVUFASEIS-UHFFFAOYSA-N	-1	0	293.279	2.311	10	5		CEBERM
Cc1nn(C(C)C)c(N[C@@H]2C=C[C@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000092183547	180339189	/nfs/dbraw/zinc/33/91/89/180339189.db2.gz	AYTQBCYIRDBFJG-VHSXEESVSA-N	-1	0	294.311	2.122	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N(CC(=O)[O-])C(C)(C)C	ZINC000092448785	180386949	/nfs/dbraw/zinc/38/69/49/180386949.db2.gz	RRVLOEMEZDDOKF-UHFFFAOYSA-N	-1	0	298.343	2.199	10	5		CEBERM
O=C([O-])c1cn(-c2ccc([N+](=O)[O-])c3cnccc32)cn1	ZINC000109476474	186254762	/nfs/dbraw/zinc/25/47/62/186254762.db2.gz	WKHRRNZLNXGSIY-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
CCC[C@@H]1C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000075559972	363474503	/nfs/dbraw/zinc/47/45/03/363474503.db2.gz	UADOBWAXYUIPGQ-SCZZXKLOSA-N	-1	0	264.281	2.219	10	5		CEBERM
COc1cc([S-])c([N+](=O)[O-])cc1OC(F)F	ZINC000575666527	366323676	/nfs/dbraw/zinc/32/36/76/366323676.db2.gz	VXFQFSKVRLDLDR-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
Cc1cc([C@H](O)C(=O)[O-])c(C(F)(F)F)c([N+](=O)[O-])c1	ZINC000575673403	366323804	/nfs/dbraw/zinc/32/38/04/366323804.db2.gz	IWMNTZJCUQTXKE-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
COc1c(CC(=O)[O-])c([N+](=O)[O-])ccc1C(F)(F)F	ZINC000575679457	366325792	/nfs/dbraw/zinc/32/57/92/366325792.db2.gz	SOPDQTMJSSCCHP-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
COc1cc(C(F)(F)F)cc([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575678785	366325871	/nfs/dbraw/zinc/32/58/71/366325871.db2.gz	LXHFMNODCAIQOJ-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
CCOc1c(C(=O)[O-])ccc(OC(F)F)c1[N+](=O)[O-]	ZINC000575656825	366316487	/nfs/dbraw/zinc/31/64/87/366316487.db2.gz	GXEXSTWLCHRQMB-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCc1ccc([N+](=O)[O-])c(OC(F)F)c1C(=O)[O-]	ZINC000575657729	366317702	/nfs/dbraw/zinc/31/77/02/366317702.db2.gz	AKZKFDHTDHNOTD-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cc(F)c1OC(F)F	ZINC000575661421	366320807	/nfs/dbraw/zinc/32/08/07/366320807.db2.gz	PCXWSKRJNNZWMN-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
CCOc1cc([N+](=O)[O-])c(CC)cc1CC(=O)[O-]	ZINC000575695518	366331321	/nfs/dbraw/zinc/33/13/21/366331321.db2.gz	JQSJJCTXGSNBCR-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
O=C([O-])[C@H]1CCCN(c2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000095077970	304184363	/nfs/dbraw/zinc/18/43/63/304184363.db2.gz	VWCKLTBBDMMBLM-QMMMGPOBSA-N	-1	0	291.263	2.037	10	5		CEBERM
O=C([O-])Cc1ccc([N+](=O)[O-])c(OC(F)(F)F)c1	ZINC000575345761	395660567	/nfs/dbraw/zinc/66/05/67/395660567.db2.gz	WTINCPODGGGVRJ-UHFFFAOYSA-N	-1	0	265.143	2.121	10	5		CEBERM
CCC(=O)c1ccc(N(C)[C@H](C)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000263486440	154098494	/nfs/dbraw/zinc/09/84/94/154098494.db2.gz	HLLYPJBPOPUOFA-MRVPVSSYSA-N	-1	0	280.280	2.097	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000005584082	170116211	/nfs/dbraw/zinc/11/62/11/170116211.db2.gz	LKPLYMRJMSBEIO-NXEZZACHSA-N	-1	0	292.291	2.424	10	5		CEBERM
COc1ccc(CSCCC(=O)[O-])cc1[N+](=O)[O-]	ZINC000021008750	171285430	/nfs/dbraw/zinc/28/54/30/171285430.db2.gz	RSDPPPJWHOOFTI-UHFFFAOYSA-N	-1	0	271.294	2.311	10	5		CEBERM
O=C([O-])c1ccoc1COc1ccc([N+](=O)[O-])cc1	ZINC000035205808	172049571	/nfs/dbraw/zinc/04/95/71/172049571.db2.gz	QDWOEPNMZKPAHF-UHFFFAOYSA-N	-1	0	263.205	2.465	10	5		CEBERM
C[C@H](CC(=O)[O-])Nc1ccc2scnc2c1[N+](=O)[O-]	ZINC000035344191	172136627	/nfs/dbraw/zinc/13/66/27/172136627.db2.gz	BUWGTMAUEYZLSL-ZCFIWIBFSA-N	-1	0	281.293	2.480	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000038037114	174037585	/nfs/dbraw/zinc/03/75/85/174037585.db2.gz	IOODLGOSFYSYBR-LBPRGKRZSA-N	-1	0	279.296	2.435	10	5		CEBERM
Cc1ccc([N-]c2ncnc(-n3ccnc3)c2[N+](=O)[O-])nc1	ZINC000040660657	174365806	/nfs/dbraw/zinc/36/58/06/174365806.db2.gz	YOMBFAUZFQRJBT-UHFFFAOYSA-N	-1	0	297.278	2.018	10	5		CEBERM
O=C([O-])Cc1csc(Sc2ccc([N+](=O)[O-])nc2)n1	ZINC000071300846	176113690	/nfs/dbraw/zinc/11/36/90/176113690.db2.gz	IVBJQJWAJUKFKL-UHFFFAOYSA-N	-1	0	297.317	2.225	10	5		CEBERM
Cc1ccc(NC(=O)CC(C)(C)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000078880347	177399955	/nfs/dbraw/zinc/39/99/55/177399955.db2.gz	CNXPSZWYWPTULP-UHFFFAOYSA-N	-1	0	280.280	2.343	10	5		CEBERM
O=C([O-])c1ccncc1NC(=O)c1csc([N+](=O)[O-])c1	ZINC000079700712	177539291	/nfs/dbraw/zinc/53/92/91/177539291.db2.gz	CHCUYJHUGWXUAB-UHFFFAOYSA-N	-1	0	293.260	2.002	10	5		CEBERM
C[C@@H](CCC(=O)[O-])Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000080176208	177617721	/nfs/dbraw/zinc/61/77/21/177617721.db2.gz	IXGHCTSVCYGDJJ-ZETCQYMHSA-N	-1	0	256.233	2.399	10	5		CEBERM
COc1ccc2nc3ccccc3nc2c1C(=O)[O-]	ZINC000014502692	295280285	/nfs/dbraw/zinc/28/02/85/295280285.db2.gz	WGKAMFOCCGEMAM-UHFFFAOYSA-N	-1	0	254.245	2.490	10	5		CEBERM
CC(C)[C@@H](Nc1cc(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000052099793	519799808	/nfs/dbraw/zinc/79/98/08/519799808.db2.gz	HRMRBFQUKAHHAW-SNVBAGLBSA-N	-1	0	256.233	2.255	10	5		CEBERM
CCO[C@@H](COc1c(C)cc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000062763227	520313353	/nfs/dbraw/zinc/31/33/53/520313353.db2.gz	HAADZIWPVGPTPX-NSHDSACASA-N	-1	0	283.280	2.080	10	5		CEBERM
CCO[C@H](COc1c(C)cc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000062763228	520521940	/nfs/dbraw/zinc/52/19/40/520521940.db2.gz	HAADZIWPVGPTPX-LLVKDONJSA-N	-1	0	283.280	2.080	10	5		CEBERM
CCN(c1ccc([N+](=O)[O-])cc1)[C@H](C)CC(=O)[O-]	ZINC000061181816	521492951	/nfs/dbraw/zinc/49/29/51/521492951.db2.gz	RTJQIUHOBSYUNB-SECBINFHSA-N	-1	0	252.270	2.284	10	5		CEBERM
CCN(c1ccc([N+](=O)[O-])cc1F)C(C)(C)C(=O)[O-]	ZINC000061171532	521493225	/nfs/dbraw/zinc/49/32/25/521493225.db2.gz	VLAFYDSWLPAVMU-UHFFFAOYSA-N	-1	0	270.260	2.423	10	5		CEBERM
C[C@@H]1CN(c2cc(C(=O)[O-])c([N+](=O)[O-])cc2F)C[C@@H](C)O1	ZINC000050019591	525061252	/nfs/dbraw/zinc/06/12/52/525061252.db2.gz	CBNXKQFPARKXAI-HTQZYQBOSA-N	-1	0	298.270	2.046	10	5		CEBERM
C[C@@H]1C[C@H]1Nc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000052293909	525499728	/nfs/dbraw/zinc/49/97/28/525499728.db2.gz	XQRUQTCRUFSIJX-SVGQVSJJSA-N	-1	0	254.217	2.252	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N[C@H](C(=O)[O-])C1CC1	ZINC000054522062	525571037	/nfs/dbraw/zinc/57/10/37/525571037.db2.gz	RSTKVXGLDMEHSH-NSHDSACASA-N	-1	0	250.254	2.178	10	5		CEBERM
Cc1cnc(CNc2ccc([N+](=O)[O-])c(C(=O)[O-])c2)cn1	ZINC000061322975	526051969	/nfs/dbraw/zinc/05/19/69/526051969.db2.gz	IJVJFUKYHSSXFI-UHFFFAOYSA-N	-1	0	288.263	2.004	10	5		CEBERM
O=C([O-])c1ccc(NCc2nccs2)c([N+](=O)[O-])c1	ZINC000049534894	526379546	/nfs/dbraw/zinc/37/95/46/526379546.db2.gz	HKYQJOHKWJZAMP-UHFFFAOYSA-N	-1	0	279.277	2.362	10	5		CEBERM
Cc1nn(-c2cc(C)ccc2C(=O)[O-])c(C)c1[N+](=O)[O-]	ZINC000054552527	527517762	/nfs/dbraw/zinc/51/77/62/527517762.db2.gz	WHZSZVLDJUVTPB-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccncc1[N+](=O)[O-])c1ccccc1	ZINC000050506982	527655637	/nfs/dbraw/zinc/65/56/37/527655637.db2.gz	FZUGFWTWWFVJFZ-LBPRGKRZSA-N	-1	0	273.248	2.228	10	5		CEBERM
CCC[C@H]1C[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000155588862	528426193	/nfs/dbraw/zinc/42/61/93/528426193.db2.gz	BTFNDGKBLSHBSK-WPRPVWTQSA-N	-1	0	264.281	2.219	10	5		CEBERM
O=C([O-])c1ccc([S@@](=O)Cc2cccc([N+](=O)[O-])c2)o1	ZINC000083388056	178394744	/nfs/dbraw/zinc/39/47/44/178394744.db2.gz	BBHZOQCUXFEFRC-HXUWFJFHSA-N	-1	0	295.272	2.194	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(NCC[C@@H]2CCCO2)c1	ZINC000211902915	344531926	/nfs/dbraw/zinc/53/19/26/344531926.db2.gz	VKHJWFCYPHZLEH-JTQLQIEISA-N	-1	0	280.280	2.274	10	5		CEBERM
O=C([O-])[C@H]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000097065320	185520492	/nfs/dbraw/zinc/52/04/92/185520492.db2.gz	OVKNQACYPPDFHP-YUMQZZPRSA-N	-1	0	295.251	2.168	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H]1Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000085329257	179019668	/nfs/dbraw/zinc/01/96/68/179019668.db2.gz	LRWIBHJBACDVPK-WDEREUQCSA-N	-1	0	268.244	2.399	10	5		CEBERM
CCOCOc1cc(/C=C/C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000087888829	179513101	/nfs/dbraw/zinc/51/31/01/179513101.db2.gz	DVLPACHAQOFRGH-GQCTYLIASA-N	-1	0	267.237	2.065	10	5		CEBERM
CCC[C@]1(C(=O)[O-])CCN(c2ncc(C)cc2[N+](=O)[O-])C1	ZINC000090691743	180024922	/nfs/dbraw/zinc/02/49/22/180024922.db2.gz	UZNCXOAAAWMWFI-AWEZNQCLSA-N	-1	0	293.323	2.379	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1NC(C)(C)C(C)(C)C(=O)[O-]	ZINC000091550017	180188883	/nfs/dbraw/zinc/18/88/83/180188883.db2.gz	ZDFVVKWFVOMYFN-UHFFFAOYSA-N	-1	0	298.343	2.421	10	5		CEBERM
O=C([O-])c1cccn1Cc1cc(F)ccc1[N+](=O)[O-]	ZINC000091840439	180269549	/nfs/dbraw/zinc/26/95/49/180269549.db2.gz	FRGUMPIGOSDMJI-UHFFFAOYSA-N	-1	0	264.212	2.282	10	5		CEBERM
CCC[C@H](CNc1cc(C)c([N+](=O)[O-])cn1)C(=O)[O-]	ZINC000092026531	180308743	/nfs/dbraw/zinc/30/87/43/180308743.db2.gz	PRVVDFWQBUBDAZ-SECBINFHSA-N	-1	0	267.285	2.211	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@H](Nc2cc(F)ccc2[N+](=O)[O-])C1	ZINC000092183856	180340035	/nfs/dbraw/zinc/34/00/35/180340035.db2.gz	FZPNCEMPAFPQGW-APPZFPTMSA-N	-1	0	266.228	2.175	10	5		CEBERM
COc1cc(S[C@H](C)C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000110625036	186306352	/nfs/dbraw/zinc/30/63/52/186306352.db2.gz	QOAUKWMMAQNHFG-RXMQYKEDSA-N	-1	0	275.257	2.308	10	5		CEBERM
O=C([O-])c1cc(Sc2cnccn2)c(F)cc1[N+](=O)[O-]	ZINC000110911907	186332540	/nfs/dbraw/zinc/33/25/40/186332540.db2.gz	DZCWMTBSFHRSQL-UHFFFAOYSA-N	-1	0	295.251	2.373	10	5		CEBERM
Cc1c(CC(=O)[O-])c(OC(F)F)ccc1[N+](=O)[O-]	ZINC000575668205	366323261	/nfs/dbraw/zinc/32/32/61/366323261.db2.gz	SAUBTGLFTNSIFO-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
CCc1c(CC(=O)[O-])cc(OC(F)F)cc1[N+](=O)[O-]	ZINC000575660033	366320542	/nfs/dbraw/zinc/32/05/42/366320542.db2.gz	LEEVVEAZXQXSOQ-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CCc1c([N+](=O)[O-])ccc(C(=O)[O-])c1OC(F)F	ZINC000575660613	366320902	/nfs/dbraw/zinc/32/09/02/366320902.db2.gz	ZFEXGAFCBZLLIK-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1c(F)cc([N+](=O)[O-])cc1OC(F)F	ZINC000575660930	366321242	/nfs/dbraw/zinc/32/12/42/366321242.db2.gz	DEZXWPKYPKBZMR-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])Cc1cc([N+](=O)[O-])c(OC(F)(F)F)cc1F	ZINC000575711016	366338700	/nfs/dbraw/zinc/33/87/00/366338700.db2.gz	NSVBRJQXXGDGRM-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
O=C([O-])c1c(F)cc([N+](=O)[O-])cc1OC(F)(F)F	ZINC000575711745	366339937	/nfs/dbraw/zinc/33/99/37/366339937.db2.gz	XOXHQQIXTLTNEK-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
O=C([O-])[C@@H](O)c1c(Cl)cc([N+](=O)[O-])cc1C(F)(F)F	ZINC000575694776	366331158	/nfs/dbraw/zinc/33/11/58/366331158.db2.gz	NMXGYTDKIDBMIC-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
Nc1nc(=O)c2c[n-]c3c(cccc3C(F)(F)F)c-2n1	ZINC000026507503	361641259	/nfs/dbraw/zinc/64/12/59/361641259.db2.gz	JEXGZJRVUYOUBF-UHFFFAOYSA-N	-1	0	280.209	2.072	10	5		CEBERM
Cc1cnc(NCc2ccc(C(=O)[O-])o2)c([N+](=O)[O-])c1	ZINC000094554949	184817725	/nfs/dbraw/zinc/81/77/25/184817725.db2.gz	KNJRIXDSYOXXHQ-UHFFFAOYSA-N	-1	0	277.236	2.202	10	5		CEBERM
O=C([O-])c1cccc(NCc2ccc([N+](=O)[O-])o2)c1	ZINC000037251477	173063634	/nfs/dbraw/zinc/06/36/34/173063634.db2.gz	HREBSGNKFOTUMD-UHFFFAOYSA-N	-1	0	262.221	2.498	10	5		CEBERM
CCCN(CC(=O)[O-])c1ccc([N+](=O)[O-])c2ncccc12	ZINC000038021155	174000046	/nfs/dbraw/zinc/00/00/46/174000046.db2.gz	PCYTVYUOYPOVRA-UHFFFAOYSA-N	-1	0	289.291	2.444	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000038037115	174037474	/nfs/dbraw/zinc/03/74/74/174037474.db2.gz	IOODLGOSFYSYBR-GFCCVEGCSA-N	-1	0	279.296	2.435	10	5		CEBERM
CCN(CCC(=O)[O-])C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000040574489	174340167	/nfs/dbraw/zinc/34/01/67/174340167.db2.gz	VTONFUOTNIBCER-UHFFFAOYSA-N	-1	0	299.258	2.062	10	5		CEBERM
CCC1CCC(Nc2ncc([N+](=O)[O-])cn2)(C(=O)[O-])CC1	ZINC000041038528	174461343	/nfs/dbraw/zinc/46/13/43/174461343.db2.gz	SZPBSOFTGNGLFN-UHFFFAOYSA-N	-1	0	294.311	2.220	10	5		CEBERM
Cc1nnc(Sc2cc(C(=O)[O-])cc([N+](=O)[O-])c2C)[nH]1	ZINC000043387305	175032764	/nfs/dbraw/zinc/03/27/64/175032764.db2.gz	CQIDJYMLRVCKNJ-UHFFFAOYSA-N	-1	0	294.292	2.179	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[C@@H](C(=O)[O-])C1	ZINC000070556606	175984727	/nfs/dbraw/zinc/98/47/27/175984727.db2.gz	SHXXOKUXWIVYHE-ZJUUUORDSA-N	-1	0	279.296	2.354	10	5		CEBERM
O=C([O-])c1nc(C2CCC2)n(-c2cccc([N+](=O)[O-])c2)n1	ZINC000536960595	330384147	/nfs/dbraw/zinc/38/41/47/330384147.db2.gz	XHDXHWNTIKJEMU-UHFFFAOYSA-N	-1	0	288.263	2.141	10	5		CEBERM
CC(C)[C@H](Nc1cc(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000052099792	519821763	/nfs/dbraw/zinc/82/17/63/519821763.db2.gz	HRMRBFQUKAHHAW-JTQLQIEISA-N	-1	0	256.233	2.255	10	5		CEBERM
CCOC[C@@H](C)Nc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000050032431	520078800	/nfs/dbraw/zinc/07/88/00/520078800.db2.gz	GKNSDENOSJEMPE-SSDOTTSWSA-N	-1	0	286.259	2.269	10	5		CEBERM
CCN(CCC(=O)[O-])c1cccc([N+](=O)[O-])c1C	ZINC000062723489	520987516	/nfs/dbraw/zinc/98/75/16/520987516.db2.gz	HFYWYAOGPGEGHH-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])C(=O)c1ccc([N+](=O)[O-])cc1C	ZINC000061216676	521245869	/nfs/dbraw/zinc/24/58/69/521245869.db2.gz	VOKMAUZOWMOOAI-JTQLQIEISA-N	-1	0	294.307	2.086	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1ccc(F)cc1[N+](=O)[O-]	ZINC000061217871	521247450	/nfs/dbraw/zinc/24/74/50/521247450.db2.gz	IPQXFTXRBBLBQS-QMMMGPOBSA-N	-1	0	270.260	2.281	10	5		CEBERM
COc1ccc(-c2nc(C(=O)[O-])c(C)o2)cc1[N+](=O)[O-]	ZINC000051075555	523191490	/nfs/dbraw/zinc/19/14/90/523191490.db2.gz	YLMQZSVFTNKHEY-UHFFFAOYSA-N	-1	0	278.220	2.265	10	5		CEBERM
Cc1ccc(N[C@H](C(=O)[O-])C2CC2)cc1[N+](=O)[O-]	ZINC000061700632	525314147	/nfs/dbraw/zinc/31/41/47/525314147.db2.gz	FGFVRHPLDOYGSY-NSHDSACASA-N	-1	0	250.254	2.178	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1Oc1nccnc1C(=O)[O-]	ZINC000054553563	526084315	/nfs/dbraw/zinc/08/43/15/526084315.db2.gz	TUFHWYKEKRVWLA-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
O=C([O-])[C@]1(Cc2ccc([N+](=O)[O-])cc2Cl)CCOC1	ZINC000054634396	526337595	/nfs/dbraw/zinc/33/75/95/526337595.db2.gz	QCACCKCMCWLCAK-LBPRGKRZSA-N	-1	0	285.683	2.282	10	5		CEBERM
O=C([O-])c1c(Cl)cccc1-n1ccc([N+](=O)[O-])n1	ZINC000054552638	526339884	/nfs/dbraw/zinc/33/98/84/526339884.db2.gz	NASYCKAWYSGQQU-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
O=C([O-])c1ccc(N2CCC[C@@H]2CCCO)c([N+](=O)[O-])c1	ZINC000052763839	526373584	/nfs/dbraw/zinc/37/35/84/526373584.db2.gz	YXNAZGFHOQLKQS-LLVKDONJSA-N	-1	0	294.307	2.034	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1NC(=O)C1CC=CC1	ZINC000069412840	526383767	/nfs/dbraw/zinc/38/37/67/526383767.db2.gz	AESQRFGOYDABJT-UHFFFAOYSA-N	-1	0	276.248	2.198	10	5		CEBERM
O=C([O-])[C@@H](Nc1cc([N+](=O)[O-])ccn1)c1ccccc1	ZINC000050506738	527655908	/nfs/dbraw/zinc/65/59/08/527655908.db2.gz	OSWGUBWQZTUIBR-LBPRGKRZSA-N	-1	0	273.248	2.228	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(Cl)c([N+](=O)[O-])cc1Cl	ZINC000396120465	344845357	/nfs/dbraw/zinc/84/53/57/344845357.db2.gz	RTVKALVBPBXYDE-ZETCQYMHSA-N	-1	0	266.036	2.020	10	5		CEBERM
Cc1c(Br)ccc(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000396140618	344845887	/nfs/dbraw/zinc/84/58/87/344845887.db2.gz	AYYSERMCYGGVTE-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@@H]1Nc1ccccc1[N+](=O)[O-]	ZINC000085328513	179019209	/nfs/dbraw/zinc/01/92/09/179019209.db2.gz	WFYHYCLMMUTYBE-IUCAKERBSA-N	-1	0	250.254	2.260	10	5		CEBERM
COc1cc(N[C@H]2CCC[C@H]2C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000085328950	179019828	/nfs/dbraw/zinc/01/98/28/179019828.db2.gz	YFHJOEAJMZVIPK-APPZFPTMSA-N	-1	0	298.270	2.408	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1SC[C@H](C)C(=O)[O-]	ZINC000086111041	179232928	/nfs/dbraw/zinc/23/29/28/179232928.db2.gz	XIGPCHHSTFRRKA-ZETCQYMHSA-N	-1	0	256.283	2.111	10	5		CEBERM
COc1cc(N2CC[C@@H](CC(=O)[O-])C2)c([N+](=O)[O-])cc1F	ZINC000089712964	179852445	/nfs/dbraw/zinc/85/24/45/179852445.db2.gz	LYJPFGVTVRIBCQ-QMMMGPOBSA-N	-1	0	298.270	2.044	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1NCCCCC(=O)[O-]	ZINC000091555394	180190531	/nfs/dbraw/zinc/19/05/31/180190531.db2.gz	TZQDTTNEUGFDQF-UHFFFAOYSA-N	-1	0	284.316	2.177	10	5		CEBERM
CC[C@H](C)N(CC(=O)[O-])c1c([N+](=O)[O-])c(C(C)C)nn1C	ZINC000091577852	180197805	/nfs/dbraw/zinc/19/78/05/180197805.db2.gz	DALJFNDOPUCIKG-VIFPVBQESA-N	-1	0	298.343	2.141	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCCC[C@@H]1C(=O)[O-]	ZINC000091549542	180189138	/nfs/dbraw/zinc/18/91/38/180189138.db2.gz	XJJRRCMBPAKJPW-UWVGGRQHSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1N[C@H](CC(C)C)C(=O)[O-]	ZINC000091554016	180189688	/nfs/dbraw/zinc/18/96/88/180189688.db2.gz	GCHYYAUGYYEZCC-SECBINFHSA-N	-1	0	284.316	2.031	10	5		CEBERM
Cc1cc(N[C@H]2C=C[C@@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092182561	180339070	/nfs/dbraw/zinc/33/90/70/180339070.db2.gz	YXESLKMGINPUIY-KOLCDFICSA-N	-1	0	262.265	2.344	10	5		CEBERM
Cc1nn(C(C)C)c(N[C@@H]2C=C[C@@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000092183545	180339253	/nfs/dbraw/zinc/33/92/53/180339253.db2.gz	AYTQBCYIRDBFJG-NXEZZACHSA-N	-1	0	294.311	2.122	10	5		CEBERM
Cc1ccc(N[C@@H]2C=C[C@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000092183791	180339852	/nfs/dbraw/zinc/33/98/52/180339852.db2.gz	ACHWASQBZHTXSU-VHSXEESVSA-N	-1	0	262.265	2.344	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1Sc1cnccn1	ZINC000110911853	186332619	/nfs/dbraw/zinc/33/26/19/186332619.db2.gz	OWOUWOAXEDYCDT-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
COc1c(C(=O)[O-])cc([N+](=O)[O-])cc1C(F)(F)F	ZINC000575673332	366323371	/nfs/dbraw/zinc/32/33/71/366323371.db2.gz	IVBNVHFNYKNTBG-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
Cc1c(OC(F)(F)F)ccc([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575673318	366323618	/nfs/dbraw/zinc/32/36/18/366323618.db2.gz	HJLSVYAPECCLEF-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
CCc1c(CC(=O)[O-])ccc([N+](=O)[O-])c1OC(F)F	ZINC000575658616	366318877	/nfs/dbraw/zinc/31/88/77/366318877.db2.gz	CURUEEZSPXVRRN-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CCc1c([N+](=O)[O-])ccc(CC(=O)[O-])c1OC(F)F	ZINC000575659376	366319022	/nfs/dbraw/zinc/31/90/22/366319022.db2.gz	GDSUKXUJWYLTTN-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=C([O-])c1cc(OC(F)(F)F)c([N+](=O)[O-])cc1F	ZINC000575710429	366339111	/nfs/dbraw/zinc/33/91/11/366339111.db2.gz	HLBZXJOTSRLFAO-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
O=C([O-])c1ccc(C(F)(F)F)c(F)c1[N+](=O)[O-]	ZINC000575708625	366339258	/nfs/dbraw/zinc/33/92/58/366339258.db2.gz	NABLEOUSRLSEEW-UHFFFAOYSA-N	-1	0	253.107	2.451	10	5		CEBERM
CCOC(=O)Cc1ccc(F)c([N+](=O)[O-])c1[S-]	ZINC000575701135	366333842	/nfs/dbraw/zinc/33/38/42/366333842.db2.gz	JFEKECGZXLTYMG-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
O=C([O-])c1cc(NCC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000019845350	170893430	/nfs/dbraw/zinc/89/34/30/170893430.db2.gz	DLLPGWKCRAJWGC-UHFFFAOYSA-N	-1	0	264.159	2.267	10	5		CEBERM
Cc1ccc(-c2nnc(SCC(=O)[O-])o2)cc1[N+](=O)[O-]	ZINC000020159315	171040070	/nfs/dbraw/zinc/04/00/70/171040070.db2.gz	MYYARGIQCJPPIF-UHFFFAOYSA-N	-1	0	295.276	2.130	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1O[C@@H](C(=O)[O-])C(C)C	ZINC000035677986	172349072	/nfs/dbraw/zinc/34/90/72/172349072.db2.gz	IWJPGNSOFVUNTR-LLVKDONJSA-N	-1	0	253.254	2.391	10	5		CEBERM
CC(C)N(CC(=O)[O-])C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000040574486	174340319	/nfs/dbraw/zinc/34/03/19/174340319.db2.gz	VSWZACAQSBSDOU-UHFFFAOYSA-N	-1	0	299.258	2.061	10	5		CEBERM
Cc1ccnc([N-]c2ncnc(-n3ccnc3)c2[N+](=O)[O-])c1	ZINC000040588368	174345884	/nfs/dbraw/zinc/34/58/84/174345884.db2.gz	XGRZMNSZDFMAPU-UHFFFAOYSA-N	-1	0	297.278	2.018	10	5		CEBERM
C[C@@H]1CCC[C@@](Nc2ccncc2[N+](=O)[O-])(C(=O)[O-])C1	ZINC000041035196	174458528	/nfs/dbraw/zinc/45/85/28/174458528.db2.gz	AFERPGTXRRWAOV-RNCFNFMXSA-N	-1	0	279.296	2.435	10	5		CEBERM
Cc1nn(-c2ccc(F)cc2[N+](=O)[O-])c(C)c1C(=O)[O-]	ZINC000043299307	175000221	/nfs/dbraw/zinc/00/02/21/175000221.db2.gz	USIZNUUHAKOWFW-UHFFFAOYSA-N	-1	0	279.227	2.235	10	5		CEBERM
COC[C@H](C)N(C)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043387133	175032763	/nfs/dbraw/zinc/03/27/63/175032763.db2.gz	UGODSHYXAFGKCW-QMMMGPOBSA-N	-1	0	282.296	2.073	10	5		CEBERM
Cc1ccnc(NC2(C(=O)[O-])CCCC2)c1[N+](=O)[O-]	ZINC000070495570	175956989	/nfs/dbraw/zinc/95/69/89/175956989.db2.gz	FXWVPAVITXTRTJ-UHFFFAOYSA-N	-1	0	265.269	2.108	10	5		CEBERM
CC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1[O-])C(C)C	ZINC000228072830	270312169	/nfs/dbraw/zinc/31/21/69/270312169.db2.gz	DGOKIXNHXZQQBV-JTQLQIEISA-N	-1	0	266.297	2.465	10	5		CEBERM
CCN(C(=O)c1ccc(F)c([N+](=O)[O-])c1)[C@H](C)CC(=O)[O-]	ZINC000061180294	520085009	/nfs/dbraw/zinc/08/50/09/520085009.db2.gz	UHMSUYOOFCJVOP-MRVPVSSYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CN(Cc1cscn1)c1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070232792	523540361	/nfs/dbraw/zinc/54/03/61/523540361.db2.gz	MAXNUWOBVBTLBM-UHFFFAOYSA-N	-1	0	293.304	2.386	10	5		CEBERM
CCn1ccnc1COc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000054743623	523542625	/nfs/dbraw/zinc/54/26/25/523542625.db2.gz	NENSFMUDXXFOAG-UHFFFAOYSA-N	-1	0	291.263	2.088	10	5		CEBERM
CN(c1ccc(F)cc1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061171294	523638518	/nfs/dbraw/zinc/63/85/18/523638518.db2.gz	FWCQHWCAEMXPEL-UHFFFAOYSA-N	-1	0	256.233	2.033	10	5		CEBERM
COc1ccc(C(=O)[O-])c(OCc2ccc([N+](=O)[O-])o2)c1	ZINC000048762891	523766877	/nfs/dbraw/zinc/76/68/77/523766877.db2.gz	WRPIIHMEQRYCRA-UHFFFAOYSA-N	-1	0	293.231	2.474	10	5		CEBERM
C[C@H]1CN(c2cc([N+](=O)[O-])ccc2C(=O)[O-])CC(C)(C)O1	ZINC000070232888	524666322	/nfs/dbraw/zinc/66/63/22/524666322.db2.gz	RNEZZFPXWZRUOH-VIFPVBQESA-N	-1	0	294.307	2.297	10	5		CEBERM
Cc1c([N+](=O)[O-])cccc1N1CC[C@](C)(C(=O)[O-])C1	ZINC000062926470	525930173	/nfs/dbraw/zinc/93/01/73/525930173.db2.gz	IDYNLEHWNZLTRU-ZDUSSCGKSA-N	-1	0	264.281	2.204	10	5		CEBERM
CC(C)(C)OC(=O)c1nc2ccc([N+](=O)[O-])cc2[n-]1	ZINC000095627158	185016213	/nfs/dbraw/zinc/01/62/13/185016213.db2.gz	WPIZVRRMIKZZCG-UHFFFAOYSA-N	-1	0	263.253	2.426	10	5		CEBERM
CN(CCC(=O)[O-])c1cc(F)c(Cl)cc1[N+](=O)[O-]	ZINC000097355482	185588040	/nfs/dbraw/zinc/58/80/40/185588040.db2.gz	RVZJVNZBSYNMNB-UHFFFAOYSA-N	-1	0	276.651	2.298	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1[C@@H](C(=O)[O-])C1(C)C	ZINC000085407984	179055303	/nfs/dbraw/zinc/05/53/03/179055303.db2.gz	GZMKHNZYLPAFTA-MNOVXSKESA-N	-1	0	292.291	2.199	10	5		CEBERM
CC[C@H](Sc1cc([N+](=O)[O-])c(C)cn1)C(=O)[O-]	ZINC000097824199	185671936	/nfs/dbraw/zinc/67/19/36/185671936.db2.gz	BLENERFOHUJXAE-QMMMGPOBSA-N	-1	0	256.283	2.254	10	5		CEBERM
CCC[C@@H](CNc1nc2sccn2c1[N+](=O)[O-])C(=O)[O-]	ZINC000087512040	179437422	/nfs/dbraw/zinc/43/74/22/179437422.db2.gz	ITUAWJDVRSKBKA-ZETCQYMHSA-N	-1	0	298.324	2.217	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1O[C@H](C(=O)[O-])C1CC1	ZINC000088793805	179673104	/nfs/dbraw/zinc/67/31/04/179673104.db2.gz	SMRIMJJLOCSHEQ-NSHDSACASA-N	-1	0	251.238	2.145	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NCc1cscn1	ZINC000104440154	186003271	/nfs/dbraw/zinc/00/32/71/186003271.db2.gz	BATLQUZUNWOUPS-UHFFFAOYSA-N	-1	0	279.277	2.362	10	5		CEBERM
Nc1cc([N+](=O)[O-])ccc1S(=O)(=O)[N-]c1ccsc1	ZINC000090868447	180049110	/nfs/dbraw/zinc/04/91/10/180049110.db2.gz	DLQDURWKFVAUOX-UHFFFAOYSA-N	-1	0	299.333	2.039	10	5		CEBERM
CCc1nn(C)c(Oc2ccccc2C(=O)[O-])c1[N+](=O)[O-]	ZINC000091560325	180191260	/nfs/dbraw/zinc/19/12/60/180191260.db2.gz	FQUWYTNAOJRNAZ-UHFFFAOYSA-N	-1	0	291.263	2.381	10	5		CEBERM
O=C([O-])c1cccn1CCc1ccccc1[N+](=O)[O-]	ZINC000091840350	180269515	/nfs/dbraw/zinc/26/95/15/180269515.db2.gz	AKKIBSSHKVPNBO-UHFFFAOYSA-N	-1	0	260.249	2.337	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])C(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000092447625	180386913	/nfs/dbraw/zinc/38/69/13/180386913.db2.gz	UVQYNWLYXJDGNL-UHFFFAOYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])C(=O)c1ccc(F)c([N+](=O)[O-])c1	ZINC000092447866	180386931	/nfs/dbraw/zinc/38/69/31/180386931.db2.gz	DEHRBJIZEAMOFL-UHFFFAOYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CN(C[C@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000113371737	186573814	/nfs/dbraw/zinc/57/38/14/186573814.db2.gz	JWMCTLADQXLHGQ-SNVBAGLBSA-N	-1	0	294.307	2.156	10	5		CEBERM
CCCC[C@@H](Nc1ccc([N+](=O)[O-])c(C)n1)C(=O)[O-]	ZINC000123331736	187085532	/nfs/dbraw/zinc/08/55/32/187085532.db2.gz	PFLYRYNBDFJTSJ-SECBINFHSA-N	-1	0	267.285	2.354	10	5		CEBERM
Cc1c(CC(=O)[O-])cc([N+](=O)[O-])cc1OC(F)F	ZINC000575668237	366323502	/nfs/dbraw/zinc/32/35/02/366323502.db2.gz	SQRHAQSDNXPRDB-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
CCOc1cc([N+](=O)[O-])cc(OC(F)F)c1CC(=O)[O-]	ZINC000575656171	366315115	/nfs/dbraw/zinc/31/51/15/366315115.db2.gz	DGFZQILSJMWJJQ-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCOc1cc(C(=O)[O-])c(OC(F)F)c([N+](=O)[O-])c1	ZINC000575656591	366315584	/nfs/dbraw/zinc/31/55/84/366315584.db2.gz	ISTGCUNQJLUWJP-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1cc(C(=O)[O-])c(OC(F)F)cc1[N+](=O)[O-]	ZINC000575658260	366318184	/nfs/dbraw/zinc/31/81/84/366318184.db2.gz	RPVAKPUAHFEGBY-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
O=C([O-])c1cc(F)cc(OC(F)(F)F)c1[N+](=O)[O-]	ZINC000575710498	366338657	/nfs/dbraw/zinc/33/86/57/366338657.db2.gz	IISDIOZNAVKCLX-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(Cl)cc([N+](=O)[O-])c1C(F)(F)F	ZINC000575694852	366331488	/nfs/dbraw/zinc/33/14/88/366331488.db2.gz	OJSQOUURIDOUJS-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)Cc1cc(Cl)cc([O-])c1[N+](=O)[O-]	ZINC000575699681	366333481	/nfs/dbraw/zinc/33/34/81/366333481.db2.gz	BWLUIBDIBGGWCV-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
Cc1c([N+](=O)[O-])cc(C(=O)[O-])cc1N1C[C@H](C)O[C@@H](C)C1	ZINC000043386717	134900087	/nfs/dbraw/zinc/90/00/87/134900087.db2.gz	ZNHILKCRWJEQOH-IUCAKERBSA-N	-1	0	294.307	2.215	10	5		CEBERM
Cc1c([N+](=O)[O-])cc(C(=O)[O-])cc1N1C[C@@H](C)O[C@@H](C)C1	ZINC000043386713	134900347	/nfs/dbraw/zinc/90/03/47/134900347.db2.gz	ZNHILKCRWJEQOH-DTORHVGOSA-N	-1	0	294.307	2.215	10	5		CEBERM
CCSCCNc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000021993969	171346533	/nfs/dbraw/zinc/34/65/33/171346533.db2.gz	FBOKJSWXJWIQON-UHFFFAOYSA-N	-1	0	270.310	2.458	10	5		CEBERM
CCCc1c(C(=O)[O-])nnn1-c1cc([N+](=O)[O-])ccc1C	ZINC000037291093	173096429	/nfs/dbraw/zinc/09/64/29/173096429.db2.gz	RAKBKKINKOWJBX-UHFFFAOYSA-N	-1	0	290.279	2.135	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])cc2C(=O)[O-])c(C)c1C	ZINC000040729273	174388361	/nfs/dbraw/zinc/38/83/61/174388361.db2.gz	YEWHPQOCFFNGML-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
O=C([O-])c1ccn(-c2cc([N+](=O)[O-])ccc2Cl)n1	ZINC000043493203	175057694	/nfs/dbraw/zinc/05/76/94/175057694.db2.gz	KXMVSHJAFLAJPT-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
O=C([O-])CCCc1nc(-c2ccccc2[N+](=O)[O-])no1	ZINC000044732040	175240946	/nfs/dbraw/zinc/24/09/46/175240946.db2.gz	FICXHQVTZNAUAZ-UHFFFAOYSA-N	-1	0	277.236	2.052	10	5		CEBERM
CCc1ccc(Oc2cnc(C(=O)[O-])cn2)c([N+](=O)[O-])c1	ZINC000071182500	176057565	/nfs/dbraw/zinc/05/75/65/176057565.db2.gz	HYUZYTSCHWHUHK-UHFFFAOYSA-N	-1	0	289.247	2.438	10	5		CEBERM
O=C([O-])CCCCCOc1cccnc1[N+](=O)[O-]	ZINC000071278412	176107856	/nfs/dbraw/zinc/10/78/56/176107856.db2.gz	SBQDLCNQHWYYGR-UHFFFAOYSA-N	-1	0	254.242	2.014	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1c(F)c(F)ccc1[N+](=O)[O-]	ZINC000061217560	521247479	/nfs/dbraw/zinc/24/74/79/521247479.db2.gz	BTVVPYRSTYZGKX-ZETCQYMHSA-N	-1	0	288.250	2.420	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1cccc(F)c1[N+](=O)[O-]	ZINC000061217487	521247812	/nfs/dbraw/zinc/24/78/12/521247812.db2.gz	WAGRYOLONRMPIO-QMMMGPOBSA-N	-1	0	270.260	2.281	10	5		CEBERM
CCC[C@@](C)(Nc1ncc([N+](=O)[O-])cc1C)C(=O)[O-]	ZINC000052812052	520926584	/nfs/dbraw/zinc/92/65/84/520926584.db2.gz	AFMUNJDFLPNDEO-GFCCVEGCSA-N	-1	0	267.285	2.354	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1cc([N+](=O)[O-])ccc1C	ZINC000061217564	521247418	/nfs/dbraw/zinc/24/74/18/521247418.db2.gz	OUODXXSYXWUMBI-JTQLQIEISA-N	-1	0	266.297	2.450	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1ccc([N+](=O)[O-])cc1C	ZINC000061217916	521247717	/nfs/dbraw/zinc/24/77/17/521247717.db2.gz	UBQWITYUQCGAQB-JTQLQIEISA-N	-1	0	266.297	2.450	10	5		CEBERM
CN(c1c(F)c(F)ccc1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061171122	523632138	/nfs/dbraw/zinc/63/21/38/523632138.db2.gz	OKOJHPQVUPENKZ-UHFFFAOYSA-N	-1	0	274.223	2.172	10	5		CEBERM
C[C@@H](C(=O)[O-])N(C)c1ccc([N+](=O)[O-])c2cccnc21	ZINC000054054723	524295202	/nfs/dbraw/zinc/29/52/02/524295202.db2.gz	IDKPVPXFTIFMHO-QMMMGPOBSA-N	-1	0	275.264	2.052	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N1CCCC[C@H]1C(=O)[O-]	ZINC000053734278	526076793	/nfs/dbraw/zinc/07/67/93/526076793.db2.gz	AJIZPLPEVWUVJO-NSHDSACASA-N	-1	0	264.281	2.347	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N[C@@H](C(=O)[O-])C(C)C	ZINC000053734321	526082868	/nfs/dbraw/zinc/08/28/68/526082868.db2.gz	CYMZIVOBCMTEBM-LLVKDONJSA-N	-1	0	252.270	2.424	10	5		CEBERM
O=C([O-])c1cc(COc2ccccc2[N+](=O)[O-])ccn1	ZINC000068764858	526344389	/nfs/dbraw/zinc/34/43/89/526344389.db2.gz	DSRWAQINHZQGRQ-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
O=C([O-])c1cc(COc2cc(F)ccc2[N+](=O)[O-])ccn1	ZINC000068764848	526345181	/nfs/dbraw/zinc/34/51/81/526345181.db2.gz	DVXCOYRKKAFKAA-UHFFFAOYSA-N	-1	0	292.222	2.406	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1-n1ccc(C2CC2)n1	ZINC000052855718	526355306	/nfs/dbraw/zinc/35/53/06/526355306.db2.gz	AKLRCQKZWQAUJD-UHFFFAOYSA-N	-1	0	273.248	2.356	10	5		CEBERM
C[C@@H]1CN(c2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1C(=O)[O-]	ZINC000235394469	625377713	/nfs/dbraw/zinc/37/77/13/625377713.db2.gz	XXITVJWQIVAVPN-VXNVDRBHSA-N	-1	0	284.699	2.405	10	5		CEBERM
Cc1c(C(=O)[O-])ccc(Br)c1[N+](=O)[O-]	ZINC000137849763	344388534	/nfs/dbraw/zinc/38/85/34/344388534.db2.gz	MXZFUBKSBUDBHZ-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@@H]1Nc1cc(F)ccc1[N+](=O)[O-]	ZINC000085329489	179019791	/nfs/dbraw/zinc/01/97/91/179019791.db2.gz	XFYCJXDIMWDFMQ-BDAKNGLRSA-N	-1	0	268.244	2.399	10	5		CEBERM
O=C([O-])Cc1ccc(Sc2ncc([N+](=O)[O-])cn2)cc1	ZINC000085959929	179204162	/nfs/dbraw/zinc/20/41/62/179204162.db2.gz	QGUQGNRNOIXYJH-UHFFFAOYSA-N	-1	0	291.288	2.163	10	5		CEBERM
C[C@H](CSc1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)[O-]	ZINC000086111051	179233196	/nfs/dbraw/zinc/23/31/96/179233196.db2.gz	BOEODDOLZVHAJK-SSDOTTSWSA-N	-1	0	299.304	2.179	10	5		CEBERM
CC(C)(NC(=O)c1ccccc1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000087622755	179457085	/nfs/dbraw/zinc/45/70/85/179457085.db2.gz	HRJFZAHFTWMXSN-UHFFFAOYSA-N	-1	0	294.307	2.214	10	5		CEBERM
O=C([O-])C[C@H]1CCN(c2cc(F)ccc2[N+](=O)[O-])C1	ZINC000089713465	179852463	/nfs/dbraw/zinc/85/24/63/179852463.db2.gz	VKOATGWECOPYQS-MRVPVSSYSA-N	-1	0	268.244	2.035	10	5		CEBERM
CCc1nn(C)c(Sc2ccc(C(=O)[O-])o2)c1[N+](=O)[O-]	ZINC000091562489	180193018	/nfs/dbraw/zinc/19/30/18/180193018.db2.gz	YANXMKDIJRPICE-UHFFFAOYSA-N	-1	0	297.292	2.333	10	5		CEBERM
CC(C)c1nn(C)c(NC2(C(=O)[O-])CCCC2)c1[N+](=O)[O-]	ZINC000091578779	180198414	/nfs/dbraw/zinc/19/84/14/180198414.db2.gz	YBYUGHFYMNWFEY-UHFFFAOYSA-N	-1	0	296.327	2.261	10	5		CEBERM
O=C([O-])c1cc(NCCc2cscn2)ccc1[N+](=O)[O-]	ZINC000113622614	186588335	/nfs/dbraw/zinc/58/83/35/186588335.db2.gz	PEVLLMVMBDIUME-UHFFFAOYSA-N	-1	0	293.304	2.404	10	5		CEBERM
CC[C@@H](CC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000675073272	540115158	/nfs/dbraw/zinc/11/51/58/540115158.db2.gz	IHLFDKOEVGXWIY-QMMMGPOBSA-N	-1	0	251.238	2.278	10	5		CEBERM
Cc1c([C@H](O)C(=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575673681	366324627	/nfs/dbraw/zinc/32/46/27/366324627.db2.gz	LYKXCAJIVQVHCB-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
COc1c([S-])cc([N+](=O)[O-])cc1OC(F)F	ZINC000575664611	366322281	/nfs/dbraw/zinc/32/22/81/366322281.db2.gz	JQCPDQMDVOAFRQ-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
CCOc1cc(CC(=O)[O-])c([N+](=O)[O-])cc1CC	ZINC000575696445	366332732	/nfs/dbraw/zinc/33/27/32/366332732.db2.gz	OZCRAHUXYXRABB-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
O=C([O-])c1cccnc1Sc1ccc([N+](=O)[O-])nc1	ZINC000019868737	170900041	/nfs/dbraw/zinc/90/00/41/170900041.db2.gz	ZSYCZFSOEHAGMG-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
CCCCn1nc([N+](=O)[O-])c(Br)c1C(=O)[O-]	ZINC000020313914	171145608	/nfs/dbraw/zinc/14/56/08/171145608.db2.gz	MWOUKUYJXYZNNO-UHFFFAOYSA-N	-1	0	292.089	2.052	10	5		CEBERM
O=C([O-])CCCCNc1ccc(F)c([N+](=O)[O-])c1	ZINC000020474559	171218714	/nfs/dbraw/zinc/21/87/14/171218714.db2.gz	BVJJXBLMCKWODX-UHFFFAOYSA-N	-1	0	256.233	2.401	10	5		CEBERM
C[C@H](Nc1ccc([N+](=O)[O-])c2ncccc12)C(=O)[O-]	ZINC000035407109	172177866	/nfs/dbraw/zinc/17/78/66/172177866.db2.gz	JSEZDKORLMYGJB-ZETCQYMHSA-N	-1	0	261.237	2.028	10	5		CEBERM
Cn1cnc([N+](=O)[O-])c1Sc1ccc(C(=O)[O-])cc1	ZINC000035663870	172342655	/nfs/dbraw/zinc/34/26/55/172342655.db2.gz	JWAZDYYSABGLMR-UHFFFAOYSA-N	-1	0	279.277	2.178	10	5		CEBERM
C[C@H](SCCc1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000035677517	172348750	/nfs/dbraw/zinc/34/87/50/172348750.db2.gz	HCEMFQPDAVQJDI-QMMMGPOBSA-N	-1	0	255.295	2.344	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(C)c1-n1ccc(C(=O)[O-])n1	ZINC000037291182	173096891	/nfs/dbraw/zinc/09/68/91/173096891.db2.gz	YHXGXSVPNMJCDC-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])cc2C)c(C)c1C(=O)[O-]	ZINC000043299316	175000165	/nfs/dbraw/zinc/00/01/65/175000165.db2.gz	PATPZPKZMQZEFJ-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
CCc1nc(-c2ccccc2[N+](=O)[O-])ncc1C(=O)[O-]	ZINC000044732109	175240773	/nfs/dbraw/zinc/24/07/73/175240773.db2.gz	AQWXSJCTAGOBFP-UHFFFAOYSA-N	-1	0	273.248	2.312	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1[N-]S(=O)(=O)c1ccccc1	ZINC000075312232	176686785	/nfs/dbraw/zinc/68/67/85/176686785.db2.gz	IWSBIARRQIQNAA-UHFFFAOYSA-N	-1	0	293.304	2.099	10	5		CEBERM
O=C([O-])c1ccn(Cc2c(Cl)cccc2[N+](=O)[O-])n1	ZINC000080050527	177602829	/nfs/dbraw/zinc/60/28/29/177602829.db2.gz	OQCFBRLVKAHEBL-UHFFFAOYSA-N	-1	0	281.655	2.191	10	5		CEBERM
O=C([O-])c1ccnn1Cc1c(Cl)cccc1[N+](=O)[O-]	ZINC000080050919	177602991	/nfs/dbraw/zinc/60/29/91/177602991.db2.gz	HRTQYERWXUGPQS-UHFFFAOYSA-N	-1	0	281.655	2.191	10	5		CEBERM
CC(C)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000130312557	279933694	/nfs/dbraw/zinc/93/36/94/279933694.db2.gz	KLUQSFHALSWJAT-QMMMGPOBSA-N	-1	0	252.270	2.075	10	5		CEBERM
COc1cc(Br)c([N+](=O)[O-])cc1C(=O)[O-]	ZINC000169046596	333180507	/nfs/dbraw/zinc/18/05/07/333180507.db2.gz	OVNILFVSSDOBJR-UHFFFAOYSA-N	-1	0	276.042	2.064	10	5		CEBERM
CCN(C(=O)c1cc([N+](=O)[O-])ccc1C)[C@@H](C)CC(=O)[O-]	ZINC000061180942	520072186	/nfs/dbraw/zinc/07/21/86/520072186.db2.gz	XTKSNVFKUCKXLQ-JTQLQIEISA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(c1ccccc1[N+](=O)[O-])[C@H](C)CC(=O)[O-]	ZINC000061181878	521501598	/nfs/dbraw/zinc/50/15/98/521501598.db2.gz	LCZLKJYTLUGGDY-SECBINFHSA-N	-1	0	252.270	2.284	10	5		CEBERM
C[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)C(=O)[O-]	ZINC000054334608	524507140	/nfs/dbraw/zinc/50/71/40/524507140.db2.gz	CCAAUQTYMOLSKW-MRVPVSSYSA-N	-1	0	275.264	2.276	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1NC1(C(=O)[O-])CCCCC1	ZINC000052812077	525576748	/nfs/dbraw/zinc/57/67/48/525576748.db2.gz	XSACUWBGFFYWOG-UHFFFAOYSA-N	-1	0	279.296	2.498	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N[C@H](C(=O)[O-])C(C)C	ZINC000053734320	526084742	/nfs/dbraw/zinc/08/47/42/526084742.db2.gz	CYMZIVOBCMTEBM-NSHDSACASA-N	-1	0	252.270	2.424	10	5		CEBERM
C[C@H](O)c1cc(Br)cc([N+](=O)[O-])c1[O-]	ZINC000167471554	344478653	/nfs/dbraw/zinc/47/86/53/344478653.db2.gz	BSBQIXXMOGJDCZ-BYPYZUCNSA-N	-1	0	262.059	2.116	10	5		CEBERM
C[C@@](Nc1ccc([N+](=O)[O-])cc1)(C(=O)[O-])C1CC1	ZINC000084095674	178787581	/nfs/dbraw/zinc/78/75/81/178787581.db2.gz	FSBKEWWSJVWXMO-LBPRGKRZSA-N	-1	0	250.254	2.260	10	5		CEBERM
COc1cc(N[C@@](C)(C(=O)[O-])C2CC2)c([N+](=O)[O-])cc1F	ZINC000084096308	178788071	/nfs/dbraw/zinc/78/80/71/178788071.db2.gz	QPHWLTAPDFHFRM-CYBMUJFWSA-N	-1	0	298.270	2.408	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@@H]1Nc1cccc(F)c1[N+](=O)[O-]	ZINC000085329090	179019534	/nfs/dbraw/zinc/01/95/34/179019534.db2.gz	HHYSFSBUUXAOHC-CBAPKCEASA-N	-1	0	268.244	2.399	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CCCC[C@@H]1C(=O)[O-]	ZINC000085330572	179020851	/nfs/dbraw/zinc/02/08/51/179020851.db2.gz	MOWYRPZCAIZAIN-WDEREUQCSA-N	-1	0	279.296	2.354	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1[C@@H](C(=O)[O-])C1(C)C	ZINC000085411062	179056898	/nfs/dbraw/zinc/05/68/98/179056898.db2.gz	ZHSBZEZLVPHJHU-MNOVXSKESA-N	-1	0	292.291	2.199	10	5		CEBERM
O=C([O-])c1ccc(NC[C@@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000086016866	179216472	/nfs/dbraw/zinc/21/64/72/179216472.db2.gz	LOLNHPKHBXIJBD-GWCFXTLKSA-N	-1	0	294.307	2.256	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(O[C@H]2CCCCC[C@H]2O)c1	ZINC000088762824	179668198	/nfs/dbraw/zinc/66/81/98/179668198.db2.gz	HHINESVQNXIUAI-NEPJUHHUSA-N	-1	0	295.291	2.365	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NC[C@H]1CCC[C@@H]1CO	ZINC000089502133	179805594	/nfs/dbraw/zinc/80/55/94/179805594.db2.gz	NTDOQCRVWXZGKS-NXEZZACHSA-N	-1	0	294.307	2.114	10	5		CEBERM
Cc1cnc(Oc2cccnc2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090692803	180025196	/nfs/dbraw/zinc/02/51/96/180025196.db2.gz	RWWSMJMPJTZCRN-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1C[C@@H]1Cc2ccccc21	ZINC000090977810	180078681	/nfs/dbraw/zinc/07/86/81/180078681.db2.gz	LGULKTUTLCCOGT-JTQLQIEISA-N	-1	0	272.260	2.434	10	5		CEBERM
Cc1cc(Oc2cncc(C(=O)[O-])n2)ccc1[N+](=O)[O-]	ZINC000091417368	180149625	/nfs/dbraw/zinc/14/96/25/180149625.db2.gz	LDSUDIBRQPTGCN-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
Cc1ccc(Nc2cncc(C(=O)[O-])n2)cc1[N+](=O)[O-]	ZINC000091418858	180150026	/nfs/dbraw/zinc/15/00/26/180150026.db2.gz	OFPPGAWGBXOJJV-UHFFFAOYSA-N	-1	0	274.236	2.135	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1NC1(CC(=O)[O-])CCCC1	ZINC000091549296	180188918	/nfs/dbraw/zinc/18/89/18/180188918.db2.gz	VKOILRMFBCVTMW-UHFFFAOYSA-N	-1	0	296.327	2.319	10	5		CEBERM
Cc1cc(N[C@@H]2CCC[C@H](C(=O)[O-])C2)ncc1[N+](=O)[O-]	ZINC000092026451	180308278	/nfs/dbraw/zinc/30/82/78/180308278.db2.gz	BNQODXONLZIYPE-VHSXEESVSA-N	-1	0	279.296	2.354	10	5		CEBERM
COc1ccc(N[C@H]2C=C[C@@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000092183564	180339662	/nfs/dbraw/zinc/33/96/62/180339662.db2.gz	KPCHXVJGASUVAI-BDAKNGLRSA-N	-1	0	278.264	2.045	10	5		CEBERM
O=C([O-])c1cn(-c2ccc([N+](=O)[O-])c3cccnc32)cn1	ZINC000109476416	186254902	/nfs/dbraw/zinc/25/49/02/186254902.db2.gz	IXVIMHULOUIRKQ-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
COc1cc(CC(=O)[O-])c(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575678618	366326014	/nfs/dbraw/zinc/32/60/14/366326014.db2.gz	IMEQSLLBTJJGAQ-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
CCc1cc(C(=O)[O-])c(OC(F)F)c([N+](=O)[O-])c1	ZINC000575660506	366320059	/nfs/dbraw/zinc/32/00/59/366320059.db2.gz	XGEUNDQIBYEHBA-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCc1ccc(CC(=O)[O-])c(OC(F)F)c1[N+](=O)[O-]	ZINC000575659607	366320201	/nfs/dbraw/zinc/32/02/01/366320201.db2.gz	JSFPEPUCSWWINO-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=C([O-])c1cc(OC(F)F)cc(F)c1[N+](=O)[O-]	ZINC000575661327	366320910	/nfs/dbraw/zinc/32/09/10/366320910.db2.gz	LQZJCMZWMVIXFC-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(CC(=O)[O-])c1OC(F)F	ZINC000575665468	366322259	/nfs/dbraw/zinc/32/22/59/366322259.db2.gz	FAFRMVJTLRZVGY-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
CCc1cc([C@@H](O)C(=O)[O-])c(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575706858	366337525	/nfs/dbraw/zinc/33/75/25/366337525.db2.gz	YFICURIUAFUTNP-SECBINFHSA-N	-1	0	293.197	2.294	10	5		CEBERM
CC[C@@H](NC(=O)C(F)F)c1cccc([N+](=O)[O-])c1	ZINC000194726561	370068433	/nfs/dbraw/zinc/06/84/33/370068433.db2.gz	LYIMWJSTLJGSIG-SECBINFHSA-N	-1	0	258.224	2.427	10	5		CEBERM
O=C([O-])[C@@]12CCC[C@H]1CN(c1cccc(F)c1[N+](=O)[O-])C2	ZINC000263516243	304168838	/nfs/dbraw/zinc/16/88/38/304168838.db2.gz	ACGLFLJYOVWEDJ-LKFCYVNXSA-N	-1	0	294.282	2.425	10	5		CEBERM
CC[C@@H](CCO)CNc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000094957016	184903989	/nfs/dbraw/zinc/90/39/89/184903989.db2.gz	KMCJOXMOGXUQJC-JTQLQIEISA-N	-1	0	296.323	2.422	10	5		CEBERM
O=C([O-])c1ccn(-c2c(Cl)cccc2[N+](=O)[O-])n1	ZINC000020353680	171156830	/nfs/dbraw/zinc/15/68/30/171156830.db2.gz	VWHFDIRJHJHBLR-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
COc1ccc(CS[C@H](C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000020565636	171254083	/nfs/dbraw/zinc/25/40/83/171254083.db2.gz	CYDMRXAQAXQOKR-SSDOTTSWSA-N	-1	0	271.294	2.310	10	5		CEBERM
C[C@@H](Nc1ccc2scnc2c1[N+](=O)[O-])C(=O)[O-]	ZINC000035407087	172177597	/nfs/dbraw/zinc/17/75/97/172177597.db2.gz	RUZZKHOENVWKIG-RXMQYKEDSA-N	-1	0	267.266	2.090	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(Cl)c1C(=O)[O-]	ZINC000037326900	173127869	/nfs/dbraw/zinc/12/78/69/173127869.db2.gz	FQQQHVHXBPLNSH-UHFFFAOYSA-N	-1	0	281.655	2.441	10	5		CEBERM
CCN(CC(=O)[O-])c1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000038017267	173991431	/nfs/dbraw/zinc/99/14/31/173991431.db2.gz	OXELSWLDWAQOGI-UHFFFAOYSA-N	-1	0	275.264	2.054	10	5		CEBERM
CCCNc1ncnc([N-]c2ccccn2)c1[N+](=O)[O-]	ZINC000040596899	174349223	/nfs/dbraw/zinc/34/92/23/174349223.db2.gz	AWOIJGVATWXUKD-UHFFFAOYSA-N	-1	0	274.284	2.345	10	5		CEBERM
O=C([O-])c1cnn(-c2ccc([N+](=O)[O-])c3ncccc23)c1	ZINC000043299410	175000120	/nfs/dbraw/zinc/00/01/20/175000120.db2.gz	ASOMDIVWXJVLQZ-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])s1	ZINC000070525210	175969967	/nfs/dbraw/zinc/96/99/67/175969967.db2.gz	AAYZIGQWODOPAH-HTQZYQBOSA-N	-1	0	298.320	2.030	10	5		CEBERM
O=[N+]([O-])c1ccc([O-])c(-c2n[nH]c(-c3ccc(O)cc3)n2)c1	ZINC000072237753	176346515	/nfs/dbraw/zinc/34/65/15/176346515.db2.gz	JYYOPCXDUXFRSW-UHFFFAOYSA-N	-1	0	298.258	2.458	10	5		CEBERM
Cc1nn(Cc2ccc(Cl)cc2[N+](=O)[O-])cc1C(=O)[O-]	ZINC000080044755	177600843	/nfs/dbraw/zinc/60/08/43/177600843.db2.gz	RPLFDGUJOILUDD-UHFFFAOYSA-N	-1	0	295.682	2.500	10	5		CEBERM
CC(C)(CCC(=O)[O-])NC(=O)c1ccc(F)c([N+](=O)[O-])c1	ZINC000050195798	519208317	/nfs/dbraw/zinc/20/83/17/519208317.db2.gz	VSHGMNXNRPGLLE-UHFFFAOYSA-N	-1	0	298.270	2.107	10	5		CEBERM
CC(C)CN(CC(=O)[O-])c1ccc(F)cc1[N+](=O)[O-]	ZINC000062742547	519712257	/nfs/dbraw/zinc/71/22/57/519712257.db2.gz	MMVGSUWZYAUISJ-UHFFFAOYSA-N	-1	0	270.260	2.281	10	5		CEBERM
CCC[C@@]1(C(=O)[O-])CCN(c2ccncc2[N+](=O)[O-])C1	ZINC000062934556	520947344	/nfs/dbraw/zinc/94/73/44/520947344.db2.gz	MLDUNLATKUJSQV-CYBMUJFWSA-N	-1	0	279.296	2.071	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])C(=O)c1ccc([N+](=O)[O-])cc1C	ZINC000061216674	521197065	/nfs/dbraw/zinc/19/70/65/521197065.db2.gz	VOKMAUZOWMOOAI-SNVBAGLBSA-N	-1	0	294.307	2.086	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1ccc(F)cc1[N+](=O)[O-]	ZINC000061217869	521199688	/nfs/dbraw/zinc/19/96/88/521199688.db2.gz	IPQXFTXRBBLBQS-MRVPVSSYSA-N	-1	0	270.260	2.281	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1ccc([N+](=O)[O-])c(C)c1	ZINC000061217680	521200267	/nfs/dbraw/zinc/20/02/67/521200267.db2.gz	OWLKUPHIQOYXBN-SNVBAGLBSA-N	-1	0	266.297	2.450	10	5		CEBERM
CCN(c1ccc(F)cc1[N+](=O)[O-])[C@@H](C)CC(=O)[O-]	ZINC000061182093	521489367	/nfs/dbraw/zinc/48/93/67/521489367.db2.gz	AEQYTMRROOAGOB-QMMMGPOBSA-N	-1	0	270.260	2.423	10	5		CEBERM
CCCN(C)c1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000050029880	521514096	/nfs/dbraw/zinc/51/40/96/521514096.db2.gz	LTCGHPXYDVUHNS-UHFFFAOYSA-N	-1	0	256.233	2.278	10	5		CEBERM
CC[C@@H](C(=O)[O-])N(C)c1ccc(C)c([N+](=O)[O-])c1	ZINC000061700612	521882954	/nfs/dbraw/zinc/88/29/54/521882954.db2.gz	DSJSNTBYIVUKCS-JTQLQIEISA-N	-1	0	252.270	2.203	10	5		CEBERM
CC[C@H](Oc1ccc([N+](=O)[O-])c(Cl)c1)C(=O)[O-]	ZINC000050469927	522874967	/nfs/dbraw/zinc/87/49/67/522874967.db2.gz	LEMBXQXVXYNAKP-VIFPVBQESA-N	-1	0	259.645	2.490	10	5		CEBERM
C[C@H](CCC(=O)[O-])Oc1ccc([N+](=O)[O-])cc1F	ZINC000050955333	524122310	/nfs/dbraw/zinc/12/23/10/524122310.db2.gz	FEBRJBIZEKFJNU-SSDOTTSWSA-N	-1	0	257.217	2.366	10	5		CEBERM
Cc1cc(SCC(=O)[O-])n(-c2ccccc2[N+](=O)[O-])n1	ZINC000052307035	525434923	/nfs/dbraw/zinc/43/49/23/525434923.db2.gz	QLYATHXVTGWUJG-UHFFFAOYSA-N	-1	0	293.304	2.266	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[C@@H](C)CC(=O)[O-]	ZINC000061835750	525567925	/nfs/dbraw/zinc/56/79/25/525567925.db2.gz	BUSNKDAPXOVQER-MRVPVSSYSA-N	-1	0	280.280	2.343	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N1CCCC[C@H]1CC(=O)[O-]	ZINC000052812071	525575240	/nfs/dbraw/zinc/57/52/40/525575240.db2.gz	UMPGHBVOESECKS-JTQLQIEISA-N	-1	0	279.296	2.132	10	5		CEBERM
Cc1cnc(CNc2ccc([N+](=O)[O-])cc2C(=O)[O-])cn1	ZINC000061322971	526052798	/nfs/dbraw/zinc/05/27/98/526052798.db2.gz	HLVMSLRNYJKHFT-UHFFFAOYSA-N	-1	0	288.263	2.004	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000054522045	526315726	/nfs/dbraw/zinc/31/57/26/526315726.db2.gz	YRELDWZIDDVZPE-SNVBAGLBSA-N	-1	0	254.217	2.009	10	5		CEBERM
O=C([O-])c1ccc(-n2ccc(C3CC3)n2)c([N+](=O)[O-])c1	ZINC000052855716	526359502	/nfs/dbraw/zinc/35/95/02/526359502.db2.gz	GFMOIXCDRZYCGV-UHFFFAOYSA-N	-1	0	273.248	2.356	10	5		CEBERM
O=C([O-])c1ccc(Sc2ccc([N+](=O)[O-])nc2)o1	ZINC000069362439	526383032	/nfs/dbraw/zinc/38/30/32/526383032.db2.gz	UVMUGPGWBOCPDU-UHFFFAOYSA-N	-1	0	266.234	2.432	10	5		CEBERM
O=C([O-])c1cnn(Cc2ccc([N+](=O)[O-])cc2Cl)c1	ZINC000049964030	526405020	/nfs/dbraw/zinc/40/50/20/526405020.db2.gz	ZSWUWKCVSCRSNH-UHFFFAOYSA-N	-1	0	281.655	2.191	10	5		CEBERM
O=C([O-])c1nccnc1Oc1cc(F)ccc1[N+](=O)[O-]	ZINC000054553539	526410627	/nfs/dbraw/zinc/41/06/27/526410627.db2.gz	ONWOIUAQQROTEO-UHFFFAOYSA-N	-1	0	279.183	2.014	10	5		CEBERM
O=C([O-])C1(Cc2ccc([N+](=O)[O-])cc2)CCOCC1	ZINC000061674703	527554810	/nfs/dbraw/zinc/55/48/10/527554810.db2.gz	PSGQDMHHAZHHGM-UHFFFAOYSA-N	-1	0	265.265	2.019	10	5		CEBERM
O=C([O-])CC[C@@H]1CCCCN1c1cc([N+](=O)[O-])ccn1	ZINC000050923685	527595812	/nfs/dbraw/zinc/59/58/12/527595812.db2.gz	IXAGQHLIBDWRCS-JTQLQIEISA-N	-1	0	279.296	2.214	10	5		CEBERM
O=C([O-])CC[C@H]1CCCCN1c1ccc([N+](=O)[O-])cn1	ZINC000050923593	527600505	/nfs/dbraw/zinc/60/05/05/527600505.db2.gz	VKMXAJBLWGHAAG-SNVBAGLBSA-N	-1	0	279.296	2.214	10	5		CEBERM
CCCn1cc(C(=O)[O-])c(=O)c2ccc([N+](=O)[O-])cc21	ZINC000053994966	362503076	/nfs/dbraw/zinc/50/30/76/362503076.db2.gz	RSCNSFSDTXBCCR-UHFFFAOYSA-N	-1	0	276.248	2.018	10	5		CEBERM
Cc1cc(N[C@@H]2CCO[C@@H]2C)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000592973980	345417661	/nfs/dbraw/zinc/41/76/61/345417661.db2.gz	QMFRITJVUMDKLG-PSASIEDQSA-N	-1	0	280.280	2.191	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1c([N+](=O)[O-])c(C)nn1C(C)C	ZINC000097127998	185542669	/nfs/dbraw/zinc/54/26/69/185542669.db2.gz	JNWIWTKXGKMBDZ-VIFPVBQESA-N	-1	0	298.343	2.228	10	5		CEBERM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000085407991	179055395	/nfs/dbraw/zinc/05/53/95/179055395.db2.gz	BRNLXLIBKTYZCH-ZJUUUORDSA-N	-1	0	296.254	2.029	10	5		CEBERM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1ccc(F)cc1[N+](=O)[O-]	ZINC000085407820	179055617	/nfs/dbraw/zinc/05/56/17/179055617.db2.gz	JSERXHKNMFZOAQ-UWVGGRQHSA-N	-1	0	296.254	2.029	10	5		CEBERM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(F)cc1[N+](=O)[O-]	ZINC000085407818	179055655	/nfs/dbraw/zinc/05/56/55/179055655.db2.gz	JSERXHKNMFZOAQ-NXEZZACHSA-N	-1	0	296.254	2.029	10	5		CEBERM
Cc1ccc(NC(=O)[C@H]2[C@@H](C(=O)[O-])C2(C)C)c([N+](=O)[O-])c1	ZINC000085411051	179057185	/nfs/dbraw/zinc/05/71/85/179057185.db2.gz	FAZVRWOQBOMSQN-MNOVXSKESA-N	-1	0	292.291	2.199	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1OCc1n[n-]c(=S)o1	ZINC000064872444	362796669	/nfs/dbraw/zinc/79/66/69/362796669.db2.gz	QVEBLLGCXACWMA-UHFFFAOYSA-N	-1	0	267.266	2.154	10	5		CEBERM
CCCc1nn(C)c(S[C@H](C)CC(=O)[O-])c1[N+](=O)[O-]	ZINC000090098660	179914145	/nfs/dbraw/zinc/91/41/45/179914145.db2.gz	NMHRWWVIIPKSAN-SSDOTTSWSA-N	-1	0	287.341	2.236	10	5		CEBERM
O=C([O-])c1ccc(Oc2cccc([N+](=O)[O-])c2)cn1	ZINC000090469320	179988564	/nfs/dbraw/zinc/98/85/64/179988564.db2.gz	SUVTYHGHGUHXAT-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
C[C@H](Nc1ccc([N+](=O)[O-])cn1)c1nc(C(=O)[O-])cs1	ZINC000090943069	180068768	/nfs/dbraw/zinc/06/87/68/180068768.db2.gz	LVONJEWXKGKTNO-LURJTMIESA-N	-1	0	294.292	2.318	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(C)cc1Oc1cncc(C(=O)[O-])n1	ZINC000091417543	180150018	/nfs/dbraw/zinc/15/00/18/180150018.db2.gz	NGJULWUZNBWKTC-UHFFFAOYSA-N	-1	0	289.247	2.492	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N(CC)[C@H](C)CC(=O)[O-]	ZINC000091555374	180190140	/nfs/dbraw/zinc/19/01/40/180190140.db2.gz	OCYHJPSFDGKRFP-SECBINFHSA-N	-1	0	298.343	2.199	10	5		CEBERM
CC(C)c1nn(C)c(NCCCCC(=O)[O-])c1[N+](=O)[O-]	ZINC000091582809	180199188	/nfs/dbraw/zinc/19/91/88/180199188.db2.gz	KZUOYGQCDJFTMW-UHFFFAOYSA-N	-1	0	284.316	2.119	10	5		CEBERM
CCN(CC)C(=O)Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000091961390	180292966	/nfs/dbraw/zinc/29/29/66/180292966.db2.gz	XDHDAFCCMLOOQQ-UHFFFAOYSA-N	-1	0	281.268	2.167	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@H](Nc2cc(F)cc([N+](=O)[O-])c2)C1	ZINC000092183576	180339384	/nfs/dbraw/zinc/33/93/84/180339384.db2.gz	NXIQVNLWFKMKRQ-APPZFPTMSA-N	-1	0	266.228	2.175	10	5		CEBERM
CC(C)c1c([O-])nc(-c2ccc([N+](=O)[O-])cc2)[nH]c1=O	ZINC000110620098	186305342	/nfs/dbraw/zinc/30/53/42/186305342.db2.gz	JIIYLGYHXAULSC-UHFFFAOYSA-N	-1	0	275.264	2.174	10	5		CEBERM
C[C@H]1CN(c2c(F)c(F)ccc2[N+](=O)[O-])C[C@@H]1C(=O)[O-]	ZINC000111253794	186377631	/nfs/dbraw/zinc/37/76/31/186377631.db2.gz	GZIXYJSEZCQJFX-BQBZGAKWSA-N	-1	0	286.234	2.030	10	5		CEBERM
CC[C@@H](Oc1cc(F)c([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000113201121	186559278	/nfs/dbraw/zinc/55/92/78/186559278.db2.gz	UNBAXKVJNDNBHI-MRVPVSSYSA-N	-1	0	261.180	2.115	10	5		CEBERM
CCOc1cc(CC(=O)[O-])c(OC(F)F)c([N+](=O)[O-])c1	ZINC000575656187	366315167	/nfs/dbraw/zinc/31/51/67/366315167.db2.gz	FAGDRUPMVRDYLF-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCOc1ccc([N+](=O)[O-])c(OC(F)F)c1C(=O)[O-]	ZINC000575657457	366316280	/nfs/dbraw/zinc/31/62/80/366316280.db2.gz	MZTPBOJBOTZWPX-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1cc(OC(F)F)c(CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000575657687	366318138	/nfs/dbraw/zinc/31/81/38/366318138.db2.gz	LFBJLICZYUKMGE-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cc(C(F)(F)F)c1F	ZINC000575708027	366339449	/nfs/dbraw/zinc/33/94/49/366339449.db2.gz	GCFCNWXPWLAROR-UHFFFAOYSA-N	-1	0	253.107	2.451	10	5		CEBERM
CC(=O)c1cc([O-])cc([N+](=O)[O-])c1Br	ZINC000575691122	366329928	/nfs/dbraw/zinc/32/99/28/366329928.db2.gz	IJMBKXVTRNOMMI-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CC(=O)c1c([O-])ccc([N+](=O)[O-])c1Br	ZINC000575692564	366331696	/nfs/dbraw/zinc/33/16/96/366331696.db2.gz	YWVJJVLJYLVIES-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CCOC(=O)Cc1cc([S-])c(F)c([N+](=O)[O-])c1	ZINC000575701637	366334272	/nfs/dbraw/zinc/33/42/72/366334272.db2.gz	SCAUQXPBEDQXEL-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
O=[N+]([O-])c1cc([O-])c(F)c(I)c1	ZINC000575707220	366337333	/nfs/dbraw/zinc/33/73/33/366337333.db2.gz	QACYGWUATYVALT-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
CCC(CC)(NC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000094240479	184768693	/nfs/dbraw/zinc/76/86/93/184768693.db2.gz	RTZPKZOJRJFCPR-UHFFFAOYSA-N	-1	0	295.295	2.360	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@@H]2CCCC[C@@H]2O)c1	ZINC000211472665	394448414	/nfs/dbraw/zinc/44/84/14/394448414.db2.gz	GIGMGMPSUHAKBH-GWCFXTLKSA-N	-1	0	294.307	2.256	10	5		CEBERM
C[C@@H]1OCCC[C@H]1C(=O)Nc1ccc([O-])c([N+](=O)[O-])c1	ZINC000191275119	153165134	/nfs/dbraw/zinc/16/51/34/153165134.db2.gz	CRULMSXPKHHXSJ-WCBMZHEXSA-N	-1	0	280.280	2.054	10	5		CEBERM
C/C=C/C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1C)C(=O)[O-]	ZINC000263231766	154037793	/nfs/dbraw/zinc/03/77/93/154037793.db2.gz	BSMKKWJKGYIYAJ-AAOUONPWSA-N	-1	0	292.291	2.052	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c2c(=O)c3ccccc3[nH]c12	ZINC000005546033	170111594	/nfs/dbraw/zinc/11/15/94/170111594.db2.gz	RZCJSUVWYHPKQD-UHFFFAOYSA-N	-1	0	284.227	2.288	10	5		CEBERM
CC[C@H](C)[C@H](NC(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)[O-]	ZINC000020362126	171161001	/nfs/dbraw/zinc/16/10/01/171161001.db2.gz	YLNPMBIUFXJKCY-UFBFGSQYSA-N	-1	0	294.307	2.132	10	5		CEBERM
O=C([O-])c1cccnc1Sc1ccncc1[N+](=O)[O-]	ZINC000020370108	171167550	/nfs/dbraw/zinc/16/75/50/171167550.db2.gz	WVUOHBZNMBLFCU-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1OCc1ccncc1	ZINC000021952861	171340757	/nfs/dbraw/zinc/34/07/57/171340757.db2.gz	WLBBWZGZVATMHT-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
CCCCOc1cc([N+](=O)[O-])c(C(=O)[O-])cc1OC	ZINC000037226477	173046193	/nfs/dbraw/zinc/04/61/93/173046193.db2.gz	QEHUTJLPIXZGBQ-UHFFFAOYSA-N	-1	0	269.253	2.481	10	5		CEBERM
CCC[C@H](Nc1cccc(F)c1[N+](=O)[O-])C(=O)[O-]	ZINC000037418972	173196576	/nfs/dbraw/zinc/19/65/76/173196576.db2.gz	RFAWIMNUJZPCSC-VIFPVBQESA-N	-1	0	256.233	2.399	10	5		CEBERM
O=[N+]([O-])c1c(Cl)ncnc1[N-]c1nccs1	ZINC000040571311	174338615	/nfs/dbraw/zinc/33/86/15/174338615.db2.gz	MOAMZAXNKMKVRV-UHFFFAOYSA-N	-1	0	257.662	2.238	10	5		CEBERM
CN(C)N=c1[n-]cnc(Sc2ccccc2)c1[N+](=O)[O-]	ZINC000040628762	174357389	/nfs/dbraw/zinc/35/73/89/174357389.db2.gz	IRJSVBBYUDBKGF-UHFFFAOYSA-N	-1	0	291.336	2.425	10	5		CEBERM
Cc1c(N(C)C2CC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386859	175032468	/nfs/dbraw/zinc/03/24/68/175032468.db2.gz	FIHAJJDXYXWBKW-UHFFFAOYSA-N	-1	0	250.254	2.200	10	5		CEBERM
Cc1c(NC[C@H]2CCCO2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386809	175032525	/nfs/dbraw/zinc/03/25/25/175032525.db2.gz	GKQQUNWQZOGYOI-SNVBAGLBSA-N	-1	0	280.280	2.192	10	5		CEBERM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000068688769	520629428	/nfs/dbraw/zinc/62/94/28/520629428.db2.gz	JHWCLEVLBDGFQP-NXEZZACHSA-N	-1	0	296.254	2.029	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1cc(F)cc([N+](=O)[O-])c1	ZINC000061217492	521198502	/nfs/dbraw/zinc/19/85/02/521198502.db2.gz	JQOLSRMOFFIITG-MRVPVSSYSA-N	-1	0	270.260	2.281	10	5		CEBERM
CCC[C@]1(C(=O)[O-])CCN(c2ncccc2[N+](=O)[O-])C1	ZINC000062934205	521304784	/nfs/dbraw/zinc/30/47/84/521304784.db2.gz	MOCLPIKLHDRGAX-ZDUSSCGKSA-N	-1	0	279.296	2.071	10	5		CEBERM
CCN(c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)CC(=O)[O-]	ZINC000061181777	521492323	/nfs/dbraw/zinc/49/23/23/521492323.db2.gz	HEKOLPULNWDJGO-QMMMGPOBSA-N	-1	0	297.267	2.193	10	5		CEBERM
Cc1ccc(N(C)C(C)(C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000061700635	524887138	/nfs/dbraw/zinc/88/71/38/524887138.db2.gz	OIXOQTSQYLHMQR-UHFFFAOYSA-N	-1	0	252.270	2.203	10	5		CEBERM
Cc1ccc(N(CC(=O)[O-])CC(C)C)c([N+](=O)[O-])c1	ZINC000062742692	524896396	/nfs/dbraw/zinc/89/63/96/524896396.db2.gz	UWDKZXNWMPJAHF-UHFFFAOYSA-N	-1	0	266.297	2.450	10	5		CEBERM
Cc1c(N[C@@H](C(=O)[O-])C2CC2)cccc1[N+](=O)[O-]	ZINC000062723582	525873164	/nfs/dbraw/zinc/87/31/64/525873164.db2.gz	XKDMVCNUJBDKLY-LLVKDONJSA-N	-1	0	250.254	2.178	10	5		CEBERM
O=C([O-])c1cc(-n2ccc(C3CC3)n2)c(F)cc1[N+](=O)[O-]	ZINC000052855759	526342409	/nfs/dbraw/zinc/34/24/09/526342409.db2.gz	WSMFKXZAJYRKQP-UHFFFAOYSA-N	-1	0	291.238	2.495	10	5		CEBERM
O=C([O-])c1cc(COc2ccc(F)cc2[N+](=O)[O-])ccn1	ZINC000068764828	526345284	/nfs/dbraw/zinc/34/52/84/526345284.db2.gz	SISFHJAHJUJJPR-UHFFFAOYSA-N	-1	0	292.222	2.406	10	5		CEBERM
O=C([O-])c1ccc(Sc2ccc([N+](=O)[O-])cn2)o1	ZINC000069362780	526383014	/nfs/dbraw/zinc/38/30/14/526383014.db2.gz	QKCNMQFULBZPIX-UHFFFAOYSA-N	-1	0	266.234	2.432	10	5		CEBERM
O=C([O-])c1coc(-c2ccc([N+](=O)[O-])cc2F)n1	ZINC000051075459	526406206	/nfs/dbraw/zinc/40/62/06/526406206.db2.gz	AJGYPYZWZGICGR-UHFFFAOYSA-N	-1	0	252.157	2.087	10	5		CEBERM
O=C([O-])c1ncccc1COc1ccc([N+](=O)[O-])cc1F	ZINC000062763813	526408104	/nfs/dbraw/zinc/40/81/04/526408104.db2.gz	XKMPIQYXURSSNA-UHFFFAOYSA-N	-1	0	292.222	2.406	10	5		CEBERM
Cc1nn(-c2ccc(C(=O)[O-])cc2C)c(C)c1[N+](=O)[O-]	ZINC000054552524	527521401	/nfs/dbraw/zinc/52/14/01/527521401.db2.gz	XBRDHXNIDAWQSD-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
CCC[C@H]1C[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000155589077	528436648	/nfs/dbraw/zinc/43/66/48/528436648.db2.gz	BTFNDGKBLSHBSK-WCBMZHEXSA-N	-1	0	264.281	2.219	10	5		CEBERM
CCCc1nc(C(=O)[O-])c2c(F)ccc([N+](=O)[O-])c2n1	ZINC000757120704	622765092	/nfs/dbraw/zinc/76/50/92/622765092.db2.gz	FWGKXHGQELDGMM-UHFFFAOYSA-N	-1	0	279.227	2.328	10	5		CEBERM
Cc1cccc(N2C[C@H](C)[C@@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000235677673	625707767	/nfs/dbraw/zinc/70/77/67/625707767.db2.gz	KXHVKSBJXLSGNL-UWVGGRQHSA-N	-1	0	264.281	2.060	10	5		CEBERM
O=C([O-])C[C@@H]1CCCN1c1cccc([N+](=O)[O-])c1	ZINC000042162067	362063898	/nfs/dbraw/zinc/06/38/98/362063898.db2.gz	ZELGBUGNPIYFBE-JTQLQIEISA-N	-1	0	250.254	2.038	10	5		CEBERM
O=C([O-])c1c(F)c(Br)cc([N+](=O)[O-])c1F	ZINC000160793809	344461047	/nfs/dbraw/zinc/46/10/47/344461047.db2.gz	DEPJMJRAYUPJOE-UHFFFAOYSA-N	-1	0	281.996	2.334	10	5		CEBERM
CC(C)(CC(=O)[O-])Nc1ncnc2ccc([N+](=O)[O-])cc21	ZINC000084147931	178803825	/nfs/dbraw/zinc/80/38/25/178803825.db2.gz	UHPKXLLJIYYVLN-UHFFFAOYSA-N	-1	0	290.279	2.203	10	5		CEBERM
COc1ccc(SC[C@H](C)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000086111090	179232885	/nfs/dbraw/zinc/23/28/85/179232885.db2.gz	KQVXWRLQOSLNRB-ZETCQYMHSA-N	-1	0	271.294	2.416	10	5		CEBERM
Cc1cnc(N(CC(=O)[O-])C2CCCC2)c([N+](=O)[O-])c1	ZINC000090691655	180024847	/nfs/dbraw/zinc/02/48/47/180024847.db2.gz	OEOLITIMYVCFPI-UHFFFAOYSA-N	-1	0	279.296	2.132	10	5		CEBERM
C[C@H](Nc1cc([N+](=O)[O-])ccn1)c1nc(C(=O)[O-])cs1	ZINC000090942856	180069033	/nfs/dbraw/zinc/06/90/33/180069033.db2.gz	OQZXHTXDXWOUBL-LURJTMIESA-N	-1	0	294.292	2.318	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCC[C@@H](C(=O)[O-])C1	ZINC000091556596	180190942	/nfs/dbraw/zinc/19/09/42/180190942.db2.gz	AQETVORPXARLPS-ZJUUUORDSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCCc1nn(C)c(SC[C@@H](C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091560155	180191358	/nfs/dbraw/zinc/19/13/58/180191358.db2.gz	FPZWCGCLCBVLDM-SSDOTTSWSA-N	-1	0	287.341	2.094	10	5		CEBERM
CCCc1nn(C)c(NC2(C(=O)[O-])CCCC2)c1[N+](=O)[O-]	ZINC000091562227	180192994	/nfs/dbraw/zinc/19/29/94/180192994.db2.gz	QDFBDKMNCKUIGF-UHFFFAOYSA-N	-1	0	296.327	2.090	10	5		CEBERM
Cc1cc(NC[C@@H]2CCC[C@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000092026554	180308830	/nfs/dbraw/zinc/30/88/30/180308830.db2.gz	RRWLYNCOJPIUHO-VHSXEESVSA-N	-1	0	279.296	2.211	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@@H](Nc2cc(F)cc([N+](=O)[O-])c2)C1	ZINC000092183577	180339391	/nfs/dbraw/zinc/33/93/91/180339391.db2.gz	NXIQVNLWFKMKRQ-VXNVDRBHSA-N	-1	0	266.228	2.175	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@H](Nc2cccc(F)c2[N+](=O)[O-])C1	ZINC000092183846	180340145	/nfs/dbraw/zinc/34/01/45/180340145.db2.gz	ZXBUIDVOGCHCHD-YUMQZZPRSA-N	-1	0	266.228	2.175	10	5		CEBERM
O=c1c2c([n-]n1-c1ccc([N+](=O)[O-])cc1)CCCC2	ZINC000106102690	186102856	/nfs/dbraw/zinc/10/28/56/186102856.db2.gz	SYFKAFSNWUUHGY-UHFFFAOYSA-N	-1	0	259.265	2.365	10	5		CEBERM
Cc1c(=O)n(-c2cccc([N+](=O)[O-])c2)[n-]c1C(F)(F)F	ZINC000111308867	186394767	/nfs/dbraw/zinc/39/47/67/186394767.db2.gz	WFFQMFLXUUVOFX-ZCFIWIBFSA-N	-1	0	287.197	2.496	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(C(F)(F)F)cc1[C@@H](O)C(=O)[O-]	ZINC000575673381	366323868	/nfs/dbraw/zinc/32/38/68/366323868.db2.gz	INMLCTPWTKRFAW-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCc1cc(OC(F)F)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575658560	366319034	/nfs/dbraw/zinc/31/90/34/366319034.db2.gz	GOCAUWVEWBLEQM-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCc1cc([N+](=O)[O-])cc(OC(F)F)c1C(=O)[O-]	ZINC000575659661	366320019	/nfs/dbraw/zinc/32/00/19/366320019.db2.gz	ONAPJYXUJISXKA-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCc1cc(C(=O)[O-])cc([N+](=O)[O-])c1OC(F)F	ZINC000575659719	366320301	/nfs/dbraw/zinc/32/03/01/366320301.db2.gz	PCRKEHKMMOYUGG-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
Cc1cc(CC(=O)[O-])c([N+](=O)[O-])cc1OC(F)F	ZINC000575665441	366322457	/nfs/dbraw/zinc/32/24/57/366322457.db2.gz	DTBKTHYXQWNCSR-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
O=C([O-])c1c(F)cc(OC(F)(F)F)cc1[N+](=O)[O-]	ZINC000575710538	366339403	/nfs/dbraw/zinc/33/94/03/366339403.db2.gz	JNKDCRVDUIZAFU-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
CCOc1c(CC(=O)[O-])cc(CC)cc1[N+](=O)[O-]	ZINC000575695258	366331371	/nfs/dbraw/zinc/33/13/71/366331371.db2.gz	HMZFXXBYUQDLAN-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
O=C([O-])[C@H](O)c1cc([N+](=O)[O-])c(C(F)(F)F)cc1Cl	ZINC000575694257	366331599	/nfs/dbraw/zinc/33/15/99/366331599.db2.gz	KWTJECBOYKXZMU-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
C[C@@H]1[C@H](C(=O)[O-])CCN1c1cc(F)ccc1[N+](=O)[O-]	ZINC000092921962	184635156	/nfs/dbraw/zinc/63/51/56/184635156.db2.gz	ZSRYUYKZVQKCPZ-VXNVDRBHSA-N	-1	0	268.244	2.033	10	5		CEBERM
Cc1ccc(-c2c[nH]c(SCC(=O)[O-])n2)cc1[N+](=O)[O-]	ZINC000094727683	184847997	/nfs/dbraw/zinc/84/79/97/184847997.db2.gz	XZYIMTWBTPRZEO-UHFFFAOYSA-N	-1	0	293.304	2.470	10	5		CEBERM
O=C([O-])Cc1cc(OC(F)(F)F)cc([N+](=O)[O-])c1	ZINC000575345641	395660611	/nfs/dbraw/zinc/66/06/11/395660611.db2.gz	JTSAAJUGWLYIGU-UHFFFAOYSA-N	-1	0	265.143	2.121	10	5		CEBERM
O=C([O-])c1ccc(Sc2nncs2)c([N+](=O)[O-])c1	ZINC000019845457	170893937	/nfs/dbraw/zinc/89/39/37/170893937.db2.gz	KBEWZRNRIUEFBN-UHFFFAOYSA-N	-1	0	283.290	2.296	10	5		CEBERM
C[C@H](SCc1cc(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000035307902	172121261	/nfs/dbraw/zinc/12/12/61/172121261.db2.gz	QXFROOOSHKFXML-LURJTMIESA-N	-1	0	259.258	2.440	10	5		CEBERM
O=C([O-])CSc1ccc([N+](=O)[O-])c2ncccc12	ZINC000035340537	172132271	/nfs/dbraw/zinc/13/22/71/172132271.db2.gz	GLGQUZLIVJCJKH-UHFFFAOYSA-N	-1	0	264.262	2.320	10	5		CEBERM
CC(C)N(CCCC(=O)[O-])c1ccc([N+](=O)[O-])cn1	ZINC000037592970	173541598	/nfs/dbraw/zinc/54/15/98/173541598.db2.gz	MLKRYKMYPYLXOG-UHFFFAOYSA-N	-1	0	267.285	2.069	10	5		CEBERM
Cc1c([N+](=O)[O-])cc(C(=O)[O-])cc1N1CC[C@@H](C)C1	ZINC000043387057	175032622	/nfs/dbraw/zinc/03/26/22/175032622.db2.gz	YIENGWXKWFPBLO-MRVPVSSYSA-N	-1	0	264.281	2.448	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000070555014	175983443	/nfs/dbraw/zinc/98/34/43/175983443.db2.gz	HVBMOAVSBLJYBQ-HTQZYQBOSA-N	-1	0	298.320	2.030	10	5		CEBERM
C/C(C(=O)[O-])=C(\C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000071164618	176047614	/nfs/dbraw/zinc/04/76/14/176047614.db2.gz	JLACMIAMCFXTPX-FPLPWBNLSA-N	-1	0	278.264	2.263	10	5		CEBERM
O=C([O-])c1ccc(Nc2ncc([N+](=O)[O-])cn2)c(Cl)c1	ZINC000071393277	176149183	/nfs/dbraw/zinc/14/91/83/176149183.db2.gz	BQKDHDSWAQHAAB-UHFFFAOYSA-N	-1	0	294.654	2.480	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N[C@H]1[C@@H]2CC[C@@H](C2)[C@@H]1C(=O)[O-]	ZINC000079560962	177520711	/nfs/dbraw/zinc/52/07/11/177520711.db2.gz	IHWIECKTRPWYLH-QCMRWSPLSA-N	-1	0	291.307	2.209	10	5		CEBERM
CC(C)Cc1nc(C(=O)[O-])nn1-c1cccc([N+](=O)[O-])c1	ZINC000536960791	330384316	/nfs/dbraw/zinc/38/43/16/330384316.db2.gz	YMAIVSYDFYHZJP-UHFFFAOYSA-N	-1	0	290.279	2.072	10	5		CEBERM
CCCN(CC(=O)[O-])c1ccc(C)c([N+](=O)[O-])c1	ZINC000061700578	521562592	/nfs/dbraw/zinc/56/25/92/521562592.db2.gz	NIJLMLDUGCBRQO-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
CC1(C)[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2F)[C@@H]1C(=O)[O-]	ZINC000068688768	520648702	/nfs/dbraw/zinc/64/87/02/520648702.db2.gz	JHWCLEVLBDGFQP-VHSXEESVSA-N	-1	0	296.254	2.029	10	5		CEBERM
CCCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(F)c1)C(=O)[O-]	ZINC000054415451	521088134	/nfs/dbraw/zinc/08/81/34/521088134.db2.gz	CXORZKTZNBMLFQ-SNVBAGLBSA-N	-1	0	298.270	2.107	10	5		CEBERM
CC[C@@]1(C(=O)[O-])CCN(c2ccccc2[N+](=O)[O-])C1	ZINC000062933762	523703556	/nfs/dbraw/zinc/70/35/56/523703556.db2.gz	FHGNXILOLMDKEI-CYBMUJFWSA-N	-1	0	264.281	2.286	10	5		CEBERM
Cc1cc(C(=O)[O-])nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000054832760	524193649	/nfs/dbraw/zinc/19/36/49/524193649.db2.gz	CRYUMPCRCMZESO-UHFFFAOYSA-N	-1	0	259.221	2.058	10	5		CEBERM
CSCCNc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000069456094	525512440	/nfs/dbraw/zinc/51/24/40/525512440.db2.gz	ZNWPDOQADYHCGP-UHFFFAOYSA-N	-1	0	270.310	2.376	10	5		CEBERM
C[C@@](Nc1ccc([N+](=O)[O-])cn1)(C(=O)[O-])c1ccccc1	ZINC000052879871	525757125	/nfs/dbraw/zinc/75/71/25/525757125.db2.gz	HBCPUIFDWGDAGD-AWEZNQCLSA-N	-1	0	287.275	2.402	10	5		CEBERM
Cc1c(N[C@H]2C[C@H]2C)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000052293929	525878699	/nfs/dbraw/zinc/87/86/99/525878699.db2.gz	FRTMIZGSBBSJSL-MUWHJKNJSA-N	-1	0	250.254	2.422	10	5		CEBERM
Cc1c(Oc2nccnc2C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000054553561	525884126	/nfs/dbraw/zinc/88/41/26/525884126.db2.gz	QCVLQXUGGSEURX-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
O=C([O-])[C@@]1(CCc2ccccc2[N+](=O)[O-])CCOC1	ZINC000062727087	526295468	/nfs/dbraw/zinc/29/54/68/526295468.db2.gz	PTTZQSAHGWAIBC-ZDUSSCGKSA-N	-1	0	265.265	2.019	10	5		CEBERM
O=C([O-])c1ccc(Sc2ccncc2[N+](=O)[O-])o1	ZINC000069362499	526383028	/nfs/dbraw/zinc/38/30/28/526383028.db2.gz	BXQXSQJQZBGNIS-UHFFFAOYSA-N	-1	0	266.234	2.432	10	5		CEBERM
Cc1oc(COc2ccc(C)nc2[N+](=O)[O-])cc1C(=O)[O-]	ZINC000050279521	526776727	/nfs/dbraw/zinc/77/67/27/526776727.db2.gz	GOQHMOPKRQVAFJ-UHFFFAOYSA-N	-1	0	292.247	2.477	10	5		CEBERM
Cn1ccnc1Sc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000050032883	527449939	/nfs/dbraw/zinc/44/99/39/527449939.db2.gz	ZGEKLSSBBPSCRO-UHFFFAOYSA-N	-1	0	297.267	2.317	10	5		CEBERM
O=C([O-])c1cc2ncc(-c3cccc([N+](=O)[O-])c3)cn2n1	ZINC000584880372	344995541	/nfs/dbraw/zinc/99/55/41/344995541.db2.gz	VXLCIDMRQBZNKJ-UHFFFAOYSA-N	-1	0	284.231	2.003	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1NC1(CC(=O)[O-])CCCC1	ZINC000084147832	178803931	/nfs/dbraw/zinc/80/39/31/178803931.db2.gz	UYYRWXNFIURLDJ-UHFFFAOYSA-N	-1	0	279.296	2.498	10	5		CEBERM
O=C([O-])[C@H]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)C1	ZINC000097065208	185520159	/nfs/dbraw/zinc/52/01/59/185520159.db2.gz	PSDSJADLJGFUFW-JGVFFNPUSA-N	-1	0	268.244	2.399	10	5		CEBERM
Cc1nn(C(C)C)c(NC[C@H](C(=O)[O-])C(C)C)c1[N+](=O)[O-]	ZINC000097128049	185542709	/nfs/dbraw/zinc/54/27/09/185542709.db2.gz	NCBKTCMKTKLZEJ-JTQLQIEISA-N	-1	0	298.343	2.449	10	5		CEBERM
O=C([O-])COc1c(Cl)cc(Cl)cc1[N+](=O)[O-]	ZINC000059946451	362655052	/nfs/dbraw/zinc/65/50/52/362655052.db2.gz	AFCVZTDQGOXMCL-UHFFFAOYSA-N	-1	0	266.036	2.365	10	5		CEBERM
C[C@@H]1CCC[C@H](C)N1c1ncc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000097814082	136522916	/nfs/dbraw/zinc/52/29/16/136522916.db2.gz	NSNZUTPWGZTITL-DTORHVGOSA-N	-1	0	279.296	2.455	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000085328414	179019123	/nfs/dbraw/zinc/01/91/23/179019123.db2.gz	FBZOCEYDIPACNE-RKDXNWHRSA-N	-1	0	295.251	2.168	10	5		CEBERM
COc1ccc(N[C@@H]2CCC[C@@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000085329200	179019759	/nfs/dbraw/zinc/01/97/59/179019759.db2.gz	XEHFJTXRXSHRND-VHSXEESVSA-N	-1	0	280.280	2.269	10	5		CEBERM
Cc1ccnc(N[C@@H]2CCCC[C@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000085329844	179020110	/nfs/dbraw/zinc/02/01/10/179020110.db2.gz	LLWYYQQLKJJVPS-NXEZZACHSA-N	-1	0	279.296	2.354	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@H]1Nc1ncccc1[N+](=O)[O-]	ZINC000085330301	179020150	/nfs/dbraw/zinc/02/01/50/179020150.db2.gz	YFXBALKIJJTQON-RKDXNWHRSA-N	-1	0	265.269	2.045	10	5		CEBERM
COc1cc(C(=O)[O-])c([N+](=O)[O-])cc1OCCC1CC1	ZINC000088490838	179613289	/nfs/dbraw/zinc/61/32/89/179613289.db2.gz	XWTCIWSKYRCVPX-UHFFFAOYSA-N	-1	0	281.264	2.481	10	5		CEBERM
Cc1cc(C)c(Oc2cncc(C(=O)[O-])n2)c([N+](=O)[O-])c1	ZINC000091417484	180150101	/nfs/dbraw/zinc/15/01/01/180150101.db2.gz	YIEHOJNEPCGBFB-UHFFFAOYSA-N	-1	0	289.247	2.492	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1N(CCCC(=O)[O-])C(C)C	ZINC000091558942	180191164	/nfs/dbraw/zinc/19/11/64/180191164.db2.gz	NUDGIFGFBGPXBO-UHFFFAOYSA-N	-1	0	298.343	2.199	10	5		CEBERM
CCc1nn(C)c(NC(C)(C)C(C)(C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091559808	180191320	/nfs/dbraw/zinc/19/13/20/180191320.db2.gz	IQMXBTLTRKTAPO-UHFFFAOYSA-N	-1	0	298.343	2.192	10	5		CEBERM
CCc1nn(C)c(NCC[C@@H](C)CCC(=O)[O-])c1[N+](=O)[O-]	ZINC000091562272	180192798	/nfs/dbraw/zinc/19/27/98/180192798.db2.gz	PPVNYRNLXMVCHI-VIFPVBQESA-N	-1	0	298.343	2.194	10	5		CEBERM
CCc1nn(C)c(NCC[C@H](C)CCC(=O)[O-])c1[N+](=O)[O-]	ZINC000091562273	180192817	/nfs/dbraw/zinc/19/28/17/180192817.db2.gz	PPVNYRNLXMVCHI-SECBINFHSA-N	-1	0	298.343	2.194	10	5		CEBERM
CCCc1nn(C)c(N[C@@](C)(CCC)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091562211	180193034	/nfs/dbraw/zinc/19/30/34/180193034.db2.gz	JWGSGXIFTBKJSO-ZDUSSCGKSA-N	-1	0	298.343	2.336	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1CCC[C@@H]1C(=O)[O-]	ZINC000091550254	180188889	/nfs/dbraw/zinc/18/88/89/180188889.db2.gz	GMACKTZCMWFGFC-UWVGGRQHSA-N	-1	0	296.327	2.032	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@@H](C(=O)[O-])C(C)C	ZINC000091554858	180189842	/nfs/dbraw/zinc/18/98/42/180189842.db2.gz	DRFCQYVDJRXFFX-SECBINFHSA-N	-1	0	284.316	2.031	10	5		CEBERM
CCC[C@@H](CNc1cc(C)c([N+](=O)[O-])cn1)C(=O)[O-]	ZINC000092026530	180308429	/nfs/dbraw/zinc/30/84/29/180308429.db2.gz	PRVVDFWQBUBDAZ-VIFPVBQESA-N	-1	0	267.285	2.211	10	5		CEBERM
C[C@H]1CN(c2cc([N+](=O)[O-])ccc2C(=O)[O-])C[C@@H]1C	ZINC000092090970	180322386	/nfs/dbraw/zinc/32/23/86/180322386.db2.gz	PVSBRSHKKIHRHO-IUCAKERBSA-N	-1	0	264.281	2.385	10	5		CEBERM
COc1cc(N[C@@H]2C=C[C@@H](C(=O)[O-])C2)c([N+](=O)[O-])cc1F	ZINC000092182750	180339602	/nfs/dbraw/zinc/33/96/02/180339602.db2.gz	QCOVINRONGDQAD-HTQZYQBOSA-N	-1	0	296.254	2.184	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N(CC(=O)[O-])CC(F)(F)F	ZINC000092436621	180384980	/nfs/dbraw/zinc/38/49/80/180384980.db2.gz	NCLMCJQTSMKXPK-UHFFFAOYSA-N	-1	0	292.213	2.357	10	5		CEBERM
CC[C@H](CC(=O)c1cccc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000675073472	540115097	/nfs/dbraw/zinc/11/50/97/540115097.db2.gz	JRDNTVKIPBGFTI-MRVPVSSYSA-N	-1	0	251.238	2.278	10	5		CEBERM
Cc1cc([N+](=O)[O-])c([C@@H](O)C(=O)[O-])cc1C(F)(F)F	ZINC000575673600	366323388	/nfs/dbraw/zinc/32/33/88/366323388.db2.gz	LKYYVNLFZOEBSA-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCc1c(OC(F)F)cc(CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000575660488	366319701	/nfs/dbraw/zinc/31/97/01/366319701.db2.gz	QJEYTHXDTJSBKG-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CCc1cc(CC(=O)[O-])c(OC(F)F)cc1[N+](=O)[O-]	ZINC000575659962	366320450	/nfs/dbraw/zinc/32/04/50/366320450.db2.gz	KDUJVIIQDOBSIN-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=C([O-])Cc1c([N+](=O)[O-])cc(F)cc1C(F)(F)F	ZINC000575711725	366340222	/nfs/dbraw/zinc/34/02/22/366340222.db2.gz	WSNGAKWXNMJHMQ-UHFFFAOYSA-N	-1	0	267.134	2.380	10	5		CEBERM
O=[N+]([O-])c1c(F)cc([O-])cc1I	ZINC000575707154	366337615	/nfs/dbraw/zinc/33/76/15/366337615.db2.gz	MSHGRBKPOSZRKA-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
C[C@@H](C(=O)[O-])[C@@H](C)C(=O)c1csc([N+](=O)[O-])c1	ZINC000093041102	184644541	/nfs/dbraw/zinc/64/45/41/184644541.db2.gz	FTVQPWPIMAHKOH-PHDIDXHHSA-N	-1	0	257.267	2.196	10	5		CEBERM
CC[C@](C)(Nc1ccc(F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000094221526	184764896	/nfs/dbraw/zinc/76/48/96/184764896.db2.gz	NHRBDZZRPIKXAV-NSHDSACASA-N	-1	0	256.233	2.399	10	5		CEBERM
CC[C@](C)(Nc1ccc([N+](=O)[O-])c(OC)c1)C(=O)[O-]	ZINC000094221528	184765032	/nfs/dbraw/zinc/76/50/32/184765032.db2.gz	RKAJVJQYTUPGEW-LBPRGKRZSA-N	-1	0	268.269	2.269	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(N[C@H]2C=C[C@@H](C(=O)[O-])C2)c1	ZINC000094659194	184836936	/nfs/dbraw/zinc/83/69/36/184836936.db2.gz	HMMPWFWGZVFIAK-ZJUUUORDSA-N	-1	0	262.265	2.344	10	5		CEBERM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1c1ccc([N+](=O)[O-])cn1	ZINC000022162252	171364254	/nfs/dbraw/zinc/36/42/54/171364254.db2.gz	KSQYMMLYEFTJBP-USWWRNFRSA-N	-1	0	291.307	2.212	10	5		CEBERM
CCCC[C@@H](Nc1nc2sccn2c1[N+](=O)[O-])C(=O)[O-]	ZINC000035412592	172184306	/nfs/dbraw/zinc/18/43/06/172184306.db2.gz	XIVKPRFNYBOYNY-SSDOTTSWSA-N	-1	0	298.324	2.359	10	5		CEBERM
O=C([O-])c1ccc(NCc2ccc([N+](=O)[O-])o2)cc1	ZINC000037251283	173063673	/nfs/dbraw/zinc/06/36/73/173063673.db2.gz	KEJMTVUKDIOHTE-UHFFFAOYSA-N	-1	0	262.221	2.498	10	5		CEBERM
O=C([O-])c1ccc(Oc2cccnc2)c([N+](=O)[O-])c1	ZINC000037301205	173107014	/nfs/dbraw/zinc/10/70/14/173107014.db2.gz	MGVWDWWKWLDEBG-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
CCCC[C@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000037669211	173610426	/nfs/dbraw/zinc/61/04/26/173610426.db2.gz	KGSGHQPALPSKDK-JTQLQIEISA-N	-1	0	298.270	2.107	10	5		CEBERM
CCc1ccc(OC[C@@H]2CC[C@H](C(=O)[O-])O2)c([N+](=O)[O-])c1	ZINC000070497375	175957846	/nfs/dbraw/zinc/95/78/46/175957846.db2.gz	NHOAYOGZLAYAIT-GXFFZTMASA-N	-1	0	295.291	2.168	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@@H](Nc2cc([N+](=O)[O-])ccn2)C1	ZINC000070556363	175984564	/nfs/dbraw/zinc/98/45/64/175984564.db2.gz	ZSBARHIYKODDSZ-DTWKUNHWSA-N	-1	0	265.269	2.045	10	5		CEBERM
C/C(C(=O)[O-])=C(\C)C(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000071164615	176047579	/nfs/dbraw/zinc/04/75/79/176047579.db2.gz	IIOJFYIXXSMWID-HJWRWDBZSA-N	-1	0	278.264	2.263	10	5		CEBERM
O=C([O-])Cc1csc(Sc2ccc([N+](=O)[O-])cn2)n1	ZINC000071300748	176113678	/nfs/dbraw/zinc/11/36/78/176113678.db2.gz	SGMNVMJNTPBBDN-UHFFFAOYSA-N	-1	0	297.317	2.225	10	5		CEBERM
O=C([O-])C=CC(=O)Nc1c2ccccc2nc2ccccc21	ZINC000077270633	177247366	/nfs/dbraw/zinc/24/73/66/177247366.db2.gz	KHXHTLMOSJUHKZ-KTKRTIGZSA-N	-1	0	292.294	2.389	10	5	in-vitro	CEBERM
CCN(C(=O)Nc1cccc([N+](=O)[O-])c1)C(C)(C)C(=O)[O-]	ZINC000061151577	520003250	/nfs/dbraw/zinc/00/32/50/520003250.db2.gz	WXGRIPAAYNLZCV-UHFFFAOYSA-N	-1	0	295.295	2.312	10	5		CEBERM
CCOc1oc(-c2cc(F)ccc2[N+](=O)[O-])nc1C(=O)[O-]	ZINC000061641527	521629854	/nfs/dbraw/zinc/62/98/54/521629854.db2.gz	JFESVNRMARCBBU-UHFFFAOYSA-N	-1	0	296.210	2.486	10	5		CEBERM
C[C@H](CCC(=O)[O-])Oc1cc(F)ccc1[N+](=O)[O-]	ZINC000050954802	524121205	/nfs/dbraw/zinc/12/12/05/524121205.db2.gz	VJAQDHQPLKSQNZ-SSDOTTSWSA-N	-1	0	257.217	2.366	10	5		CEBERM
Cc1ccc(N2CCC[C@H]2CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000061700595	524959596	/nfs/dbraw/zinc/95/95/96/524959596.db2.gz	SVWXGDBBXHORBG-JTQLQIEISA-N	-1	0	264.281	2.347	10	5		CEBERM
C[C@H]1C[C@H]1Nc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000052293912	524965100	/nfs/dbraw/zinc/96/51/00/524965100.db2.gz	XQRUQTCRUFSIJX-YLWLKBPMSA-N	-1	0	254.217	2.252	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(OCCc2ccncc2)c1	ZINC000050877886	526383875	/nfs/dbraw/zinc/38/38/75/526383875.db2.gz	DJHJMLAFCAGLPX-UHFFFAOYSA-N	-1	0	288.259	2.310	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000054522044	527655350	/nfs/dbraw/zinc/65/53/50/527655350.db2.gz	YRELDWZIDDVZPE-JTQLQIEISA-N	-1	0	254.217	2.009	10	5		CEBERM
Cc1cc(Br)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000300927763	344701909	/nfs/dbraw/zinc/70/19/09/344701909.db2.gz	VIOCYPKFZICVGV-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
Cc1nn(C(C)C)c(N(CCC(=O)[O-])C2CC2)c1[N+](=O)[O-]	ZINC000097127919	185542107	/nfs/dbraw/zinc/54/21/07/185542107.db2.gz	ZMEIUFVZGJKPIQ-UHFFFAOYSA-N	-1	0	296.327	2.124	10	5		CEBERM
COc1cc(N[C@H]2CCC[C@@H]2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000085328482	179018917	/nfs/dbraw/zinc/01/89/17/179018917.db2.gz	QBRKHCKBPOKTRO-UWVGGRQHSA-N	-1	0	280.280	2.269	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1S[C@H](C(=O)[O-])C(C)C	ZINC000097824971	185671491	/nfs/dbraw/zinc/67/14/91/185671491.db2.gz	FZDVXLHTGFWUQY-VIFPVBQESA-N	-1	0	287.341	2.321	10	5		CEBERM
C[C@@H](CSc1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)[O-]	ZINC000086111050	179232913	/nfs/dbraw/zinc/23/29/13/179232913.db2.gz	BOEODDOLZVHAJK-ZETCQYMHSA-N	-1	0	299.304	2.179	10	5		CEBERM
O=C([O-])[C@@H](F)Oc1ccc(Br)cc1[N+](=O)[O-]	ZINC000086242194	179255007	/nfs/dbraw/zinc/25/50/07/179255007.db2.gz	WFUUQMDRXDTHLI-ZETCQYMHSA-N	-1	0	294.032	2.116	10	5		CEBERM
O=C([O-])c1csc(CNc2ccc([N+](=O)[O-])cc2)n1	ZINC000090933207	180066612	/nfs/dbraw/zinc/06/66/12/180066612.db2.gz	VYJQNXJPKJCKAT-UHFFFAOYSA-N	-1	0	279.277	2.362	10	5		CEBERM
C[C@H](Nc1ccc([N+](=O)[O-])nc1)c1nc(C(=O)[O-])cs1	ZINC000090943009	180068798	/nfs/dbraw/zinc/06/87/98/180068798.db2.gz	DYXXYNMXNDHPLW-LURJTMIESA-N	-1	0	294.292	2.318	10	5		CEBERM
CC(C)c1nn(C)c(N[C@@H]2CCC[C@@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000091584420	180199393	/nfs/dbraw/zinc/19/93/93/180199393.db2.gz	ATCWXTZRSZQMDU-DTWKUNHWSA-N	-1	0	296.327	2.117	10	5		CEBERM
Cc1cc(N[C@H]2CCC[C@@H](C(=O)[O-])C2)ncc1[N+](=O)[O-]	ZINC000092026454	180308301	/nfs/dbraw/zinc/30/83/01/180308301.db2.gz	BNQODXONLZIYPE-ZJUUUORDSA-N	-1	0	279.296	2.354	10	5		CEBERM
CCC[C@@H](Nc1cc(OC)c(F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000110624832	186306931	/nfs/dbraw/zinc/30/69/31/186306931.db2.gz	JXGMIQUMBSRYLM-MRVPVSSYSA-N	-1	0	286.259	2.408	10	5		CEBERM
O=C([O-])c1cc(Sc2ccncn2)c(F)cc1[N+](=O)[O-]	ZINC000111113113	186353479	/nfs/dbraw/zinc/35/34/79/186353479.db2.gz	YLEDWDNWNPQVED-UHFFFAOYSA-N	-1	0	295.251	2.373	10	5		CEBERM
O=C([O-])c1cnn(-c2ccc([N+](=O)[O-])cc2C(F)F)c1	ZINC000111292049	186391405	/nfs/dbraw/zinc/39/14/05/186391405.db2.gz	GFCWTMVBLDESTQ-UHFFFAOYSA-N	-1	0	283.190	2.416	10	5		CEBERM
Cc1ccc(OC(F)F)c([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575667536	366323787	/nfs/dbraw/zinc/32/37/87/366323787.db2.gz	OVDULHXNDZQHGM-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
Cc1cc([C@H](O)C(=O)[O-])c(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575673743	366325018	/nfs/dbraw/zinc/32/50/18/366325018.db2.gz	MXUKPICKVCYXAS-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
COc1cc(C(F)(F)F)cc(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575678679	366326122	/nfs/dbraw/zinc/32/61/22/366326122.db2.gz	JTBAKWGWMQQINV-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
CCOc1cc([N+](=O)[O-])cc(OC(F)F)c1C(=O)[O-]	ZINC000575657420	366316670	/nfs/dbraw/zinc/31/66/70/366316670.db2.gz	MTVHJCKYBPLQEX-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1cc(C(=O)[O-])cc([N+](=O)[O-])c1OC(F)F	ZINC000575657937	366317446	/nfs/dbraw/zinc/31/74/46/366317446.db2.gz	NMPFSHCNXJAPOD-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1cc(C(=O)[O-])c([N+](=O)[O-])cc1OC(F)F	ZINC000575659613	366319931	/nfs/dbraw/zinc/31/99/31/366319931.db2.gz	WKRFQOSSPGTIFI-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CC(=O)c1c([O-])c(Br)ccc1[N+](=O)[O-]	ZINC000575692044	366330261	/nfs/dbraw/zinc/33/02/61/366330261.db2.gz	SUTSYIPNFSUBEB-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CC(=O)c1c([O-])ccc(Br)c1[N+](=O)[O-]	ZINC000575692083	366330444	/nfs/dbraw/zinc/33/04/44/366330444.db2.gz	TWHMVCFAUGKNRZ-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CCOC(=O)Cc1cc([N+](=O)[O-])c(F)cc1[S-]	ZINC000575701470	366333394	/nfs/dbraw/zinc/33/33/94/366333394.db2.gz	PSBQNWKYBZVQPD-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
Cc1cc([N+](=O)[O-])cc(Br)c1C(=O)[O-]	ZINC000306978223	540299256	/nfs/dbraw/zinc/29/92/56/540299256.db2.gz	OEZGSEGSWSTHCF-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(N(C)C(C)(C)C(=O)[O-])c1	ZINC000094659076	184836949	/nfs/dbraw/zinc/83/69/49/184836949.db2.gz	OTLODJOZWQRKAK-UHFFFAOYSA-N	-1	0	252.270	2.203	10	5		CEBERM
O=C([O-])[C@@H]1CCCCN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000034740976	134779718	/nfs/dbraw/zinc/77/97/18/134779718.db2.gz	SJTATXVLFCYLLC-QMMMGPOBSA-N	-1	0	285.687	2.087	10	5		CEBERM
Cc1ccc(N2CCSC[C@@H]2CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000091130372	135067055	/nfs/dbraw/zinc/06/70/55/135067055.db2.gz	DLDCMGCXYBEIHA-NSHDSACASA-N	-1	0	296.348	2.300	10	5		CEBERM
C[C@H](C(=O)[O-])N(Cc1c(F)cccc1[N+](=O)[O-])C1CC1	ZINC000263184192	154032833	/nfs/dbraw/zinc/03/28/33/154032833.db2.gz	UPNXTPHHIQJNKJ-MRVPVSSYSA-N	-1	0	282.271	2.171	10	5		CEBERM
COc1cc(O)c2c(=O)c3ccccc3n(C)c2c1	ZINC000006494597	170206735	/nfs/dbraw/zinc/20/67/35/170206735.db2.gz	OCUBFJMZYYIVBO-UHFFFAOYSA-N	-1	0	255.273	2.406	10	5	endogenous,in-man	CEBERM
CC(C)[C@H](Oc1cc(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000019410057	170788963	/nfs/dbraw/zinc/78/89/63/170788963.db2.gz	IBWPDDUKRCKOLB-JTQLQIEISA-N	-1	0	257.217	2.222	10	5		CEBERM
O=C([O-])CCCCNc1cc([N+](=O)[O-])ccc1F	ZINC000020474558	171218746	/nfs/dbraw/zinc/21/87/46/171218746.db2.gz	UOIPYUACJTZFQB-UHFFFAOYSA-N	-1	0	256.233	2.401	10	5		CEBERM
O=C([O-])[C@H](Nc1ccncc1[N+](=O)[O-])C1CCCCC1	ZINC000038037097	174036600	/nfs/dbraw/zinc/03/66/00/174036600.db2.gz	SGFXWAOLNYOAKT-GFCCVEGCSA-N	-1	0	279.296	2.435	10	5		CEBERM
Cc1cc2nc3ccc(C(=O)[O-])cn3c(=O)c2cc1C	ZINC000039240209	174166710	/nfs/dbraw/zinc/16/67/10/174166710.db2.gz	BVMSPQCVUCWBTA-UHFFFAOYSA-N	-1	0	268.272	2.163	10	5		CEBERM
O=C([O-])c1cnn(-c2ccc([N+](=O)[O-])c3cnccc32)c1	ZINC000043299434	175000137	/nfs/dbraw/zinc/00/01/37/175000137.db2.gz	KKNQOEQSWZYQLC-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
Cc1c(N(C)C[C@@H]2CCCO2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043387115	175032688	/nfs/dbraw/zinc/03/26/88/175032688.db2.gz	UXUPAUHQBQNTPV-NSHDSACASA-N	-1	0	294.307	2.217	10	5		CEBERM
O=C([O-])c1cnc(Sc2ccc([N+](=O)[O-])cc2)cn1	ZINC000071182537	176057553	/nfs/dbraw/zinc/05/75/53/176057553.db2.gz	GJCFFFGMWNJMCH-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
C[C@@]1(C(=O)[O-])CCCN1c1cc(F)ccc1[N+](=O)[O-]	ZINC000079497652	177507549	/nfs/dbraw/zinc/50/75/49/177507549.db2.gz	RTSFUMXRXVMZSJ-LBPRGKRZSA-N	-1	0	268.244	2.177	10	5		CEBERM
CCO[C@@H](COc1ccc([N+](=O)[O-])c(Cl)c1)C(=O)[O-]	ZINC000062763252	520314920	/nfs/dbraw/zinc/31/49/20/520314920.db2.gz	OKVYCEAKRUANCF-JTQLQIEISA-N	-1	0	289.671	2.117	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1ccc([N+](=O)[O-])cc1	ZINC000061217542	521247783	/nfs/dbraw/zinc/24/77/83/521247783.db2.gz	BUBMBGONUPZAOD-VIFPVBQESA-N	-1	0	252.270	2.142	10	5		CEBERM
CC(C)(CCC(=O)[O-])NC(=O)c1ccc([N+](=O)[O-])c(F)c1	ZINC000054415494	519207140	/nfs/dbraw/zinc/20/71/40/519207140.db2.gz	BPSZVOLDMFMEAP-UHFFFAOYSA-N	-1	0	298.270	2.107	10	5		CEBERM
CC(C)=CC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000062823556	519399847	/nfs/dbraw/zinc/39/98/47/519399847.db2.gz	CVAPNNQIKDNKJW-UHFFFAOYSA-N	-1	0	264.237	2.198	10	5		CEBERM
CCN(C(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H](C)CC(=O)[O-]	ZINC000061181095	520003426	/nfs/dbraw/zinc/00/34/26/520003426.db2.gz	AKLVXVXFIDEMIO-VIFPVBQESA-N	-1	0	295.295	2.312	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])C(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000061215077	521244710	/nfs/dbraw/zinc/24/47/10/521244710.db2.gz	QEDPUFMVQFEPQP-JTQLQIEISA-N	-1	0	294.307	2.086	10	5		CEBERM
CC[C@@]1(C(=O)[O-])CCN(c2cccc([N+](=O)[O-])c2)C1	ZINC000062933854	523704497	/nfs/dbraw/zinc/70/44/97/523704497.db2.gz	GHNDVEOURZPXLF-CYBMUJFWSA-N	-1	0	264.281	2.286	10	5		CEBERM
Cc1ccc(N[C@H](C(=O)[O-])C2CC2)c([N+](=O)[O-])c1	ZINC000054522064	525315297	/nfs/dbraw/zinc/31/52/97/525315297.db2.gz	RBOYCTUXUBEFET-NSHDSACASA-N	-1	0	250.254	2.178	10	5		CEBERM
O=C([O-])[C@H](Nc1ccncc1[N+](=O)[O-])c1ccccc1	ZINC000050506984	526315623	/nfs/dbraw/zinc/31/56/23/526315623.db2.gz	FZUGFWTWWFVJFZ-GFCCVEGCSA-N	-1	0	273.248	2.228	10	5		CEBERM
Cc1nnc(Oc2ccc([N+](=O)[O-])cc2)c(C(=O)[O-])c1C	ZINC000054553543	526376487	/nfs/dbraw/zinc/37/64/87/526376487.db2.gz	MVATZNLTNQUBFX-UHFFFAOYSA-N	-1	0	289.247	2.492	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(OCCc2cccnc2)c1	ZINC000063222776	526384046	/nfs/dbraw/zinc/38/40/46/526384046.db2.gz	CQSZOLRMLFKNFW-UHFFFAOYSA-N	-1	0	288.259	2.310	10	5		CEBERM
O=C([O-])c1coc(-c2cc(F)ccc2[N+](=O)[O-])n1	ZINC000051075435	526405595	/nfs/dbraw/zinc/40/55/95/526405595.db2.gz	KUBPTXHRVKHVRX-UHFFFAOYSA-N	-1	0	252.157	2.087	10	5		CEBERM
O=C([O-])C1(Cc2cccc([N+](=O)[O-])c2)CCOCC1	ZINC000061674671	527554535	/nfs/dbraw/zinc/55/45/35/527554535.db2.gz	VGSLPMHMKSDLNJ-UHFFFAOYSA-N	-1	0	265.265	2.019	10	5		CEBERM
O=C([O-])CCSCCc1ccccc1[N+](=O)[O-]	ZINC000062726095	527594083	/nfs/dbraw/zinc/59/40/83/527594083.db2.gz	HEUMXXQMSBTWLE-UHFFFAOYSA-N	-1	0	255.295	2.345	10	5		CEBERM
CCC[C@@H](NC(=O)c1cc(F)cc(C)c1[N+](=O)[O-])C(=O)[O-]	ZINC000236882874	528991545	/nfs/dbraw/zinc/99/15/45/528991545.db2.gz	KUSIAAYFTQKMKS-SNVBAGLBSA-N	-1	0	298.270	2.025	10	5		CEBERM
CCCc1c(C(=O)[O-])cnn1-c1cccc([N+](=O)[O-])c1	ZINC000034956950	361800399	/nfs/dbraw/zinc/80/03/99/361800399.db2.gz	ABLHLCYNZFRIBF-UHFFFAOYSA-N	-1	0	275.264	2.431	10	5		CEBERM
O=C([O-])[C@@H](O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-]	ZINC000396119473	344845503	/nfs/dbraw/zinc/84/55/03/344845503.db2.gz	PBIXDFVPAOKYOV-ZETCQYMHSA-N	-1	0	266.036	2.020	10	5		CEBERM
COc1ccc2c(c1)[nH]c1c(C(=O)[O-])cccc1c2=O	ZINC000584635622	344970580	/nfs/dbraw/zinc/97/05/80/344970580.db2.gz	AIXDWBWBHAFINF-UHFFFAOYSA-N	-1	0	269.256	2.388	10	5		CEBERM
O=C([O-])C1(c2nccc3c2cccc3[N+](=O)[O-])CC1	ZINC000584880643	344995640	/nfs/dbraw/zinc/99/56/40/344995640.db2.gz	KJKYWGGPLUHICL-UHFFFAOYSA-N	-1	0	258.233	2.259	10	5		CEBERM
Cc1cc(N2CC[C@@H](F)C2)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000592969204	345417092	/nfs/dbraw/zinc/41/70/92/345417092.db2.gz	FEFJZSJTWHBXBY-MRVPVSSYSA-N	-1	0	268.244	2.150	10	5		CEBERM
CC(C)(CC(=O)Nc1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000087726706	179478468	/nfs/dbraw/zinc/47/84/68/179478468.db2.gz	PBPUEGWALPPXMA-UHFFFAOYSA-N	-1	0	284.243	2.173	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1SCCC(=O)[O-]	ZINC000091556416	180190501	/nfs/dbraw/zinc/19/05/01/180190501.db2.gz	WQDFWGBCSMHSMG-UHFFFAOYSA-N	-1	0	273.314	2.077	10	5		CEBERM
CCCc1nn(C)c(NC[C@H](C(=O)[O-])C(C)C)c1[N+](=O)[O-]	ZINC000091560770	180192218	/nfs/dbraw/zinc/19/22/18/180192218.db2.gz	FOPVDTASMWSXFP-VIFPVBQESA-N	-1	0	298.343	2.050	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])c1ccc(F)cc1[N+](=O)[O-]	ZINC000092448641	180386909	/nfs/dbraw/zinc/38/69/09/180386909.db2.gz	JQAKINFKARJCED-UHFFFAOYSA-N	-1	0	270.260	2.423	10	5		CEBERM
Cc1cc(CC(=O)[O-])c([N+](=O)[O-])c(OC(F)(F)F)c1	ZINC000575674194	366324884	/nfs/dbraw/zinc/32/48/84/366324884.db2.gz	QDEFLYDHURXOTI-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
CCOc1ccc(OC(F)F)c(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575656647	366314940	/nfs/dbraw/zinc/31/49/40/366314940.db2.gz	FOGMVCQDWRIUHH-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])c(F)cc1OC(F)F	ZINC000575661387	366321452	/nfs/dbraw/zinc/32/14/52/366321452.db2.gz	NWXNFWISEFSTIK-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
COc1cc(OC(F)F)c([S-])c([N+](=O)[O-])c1	ZINC000575664456	366322318	/nfs/dbraw/zinc/32/23/18/366322318.db2.gz	FXCRFSQSQWCZGM-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
O=C([O-])Cc1cc(OC(F)(F)F)c([N+](=O)[O-])cc1F	ZINC000575711062	366339275	/nfs/dbraw/zinc/33/92/75/366339275.db2.gz	ODLODELWMNDSCT-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
Cc1nn(C)cc1Nc1ncc([N+](=O)[O-])cc1Cl	ZINC000226226692	370330584	/nfs/dbraw/zinc/33/05/84/370330584.db2.gz	XFPSNVVQZYAGGY-UHFFFAOYSA-N	-1	0	267.676	2.429	10	5		CEBERM
O=C([O-])c1ccc(OCCc2ccccc2[N+](=O)[O-])cn1	ZINC000094213795	184763766	/nfs/dbraw/zinc/76/37/66/184763766.db2.gz	JHSHITHQUKCUQG-UHFFFAOYSA-N	-1	0	288.259	2.310	10	5		CEBERM
CC(C)c1c([N+](=O)[O-])cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000098177616	394702190	/nfs/dbraw/zinc/70/21/90/394702190.db2.gz	ZPYTYYDCWSHUFM-UHFFFAOYSA-N	-1	0	254.198	2.325	10	5		CEBERM
C[C@@H](C(=O)[O-])N(Cc1c(F)cccc1[N+](=O)[O-])C1CC1	ZINC000263184193	154030325	/nfs/dbraw/zinc/03/03/25/154030325.db2.gz	UPNXTPHHIQJNKJ-QMMMGPOBSA-N	-1	0	282.271	2.171	10	5		CEBERM
O=C([O-])c1csc(-c2ccc([N+](=O)[O-])s2)n1	ZINC000006093670	170175554	/nfs/dbraw/zinc/17/55/54/170175554.db2.gz	SNNIGNLXYVEYOC-UHFFFAOYSA-N	-1	0	256.264	2.478	10	5		CEBERM
CC(C)Oc1ccc([N+](=O)[O-])cc1/C=C/C(=O)[O-]	ZINC000020576469	171256090	/nfs/dbraw/zinc/25/60/90/171256090.db2.gz	DPAXZLCSLCFTKP-ZZXKWVIFSA-N	-1	0	251.238	2.480	10	5		CEBERM
Cc1onc(C(=O)[O-])c1COc1ccccc1[N+](=O)[O-]	ZINC000024548708	171436929	/nfs/dbraw/zinc/43/69/29/171436929.db2.gz	AIXNZPPLXFRRLS-UHFFFAOYSA-N	-1	0	278.220	2.168	10	5		CEBERM
C[C@@H](SCc1cc(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000035307906	172121144	/nfs/dbraw/zinc/12/11/44/172121144.db2.gz	QXFROOOSHKFXML-ZCFIWIBFSA-N	-1	0	259.258	2.440	10	5		CEBERM
CCCC[C@H](Nc1ccncc1[N+](=O)[O-])C(=O)[O-]	ZINC000035411218	172183093	/nfs/dbraw/zinc/18/30/93/172183093.db2.gz	SNUXUOYONDPBHI-VIFPVBQESA-N	-1	0	253.258	2.045	10	5		CEBERM
CCN(CC(=O)[O-])c1ccc([N+](=O)[O-])c2ncccc12	ZINC000038017272	173991550	/nfs/dbraw/zinc/99/15/50/173991550.db2.gz	VCHDQDAGBFFJOJ-UHFFFAOYSA-N	-1	0	275.264	2.054	10	5		CEBERM
Cc1ccc([N-]c2ncnc(Cl)c2[N+](=O)[O-])nc1	ZINC000040571499	174338480	/nfs/dbraw/zinc/33/84/80/174338480.db2.gz	MRWSAITZBYVKSO-UHFFFAOYSA-N	-1	0	265.660	2.485	10	5		CEBERM
O=C([O-])C1(Nc2ncccc2[N+](=O)[O-])CCCCC1	ZINC000041033010	174456257	/nfs/dbraw/zinc/45/62/57/174456257.db2.gz	MURNELFJXSLIAI-UHFFFAOYSA-N	-1	0	265.269	2.189	10	5		CEBERM
O=C([O-])c1cc(Cl)ccc1-n1cnc([N+](=O)[O-])c1	ZINC000042801903	174882481	/nfs/dbraw/zinc/88/24/81/174882481.db2.gz	VCLNYYCZMBPKHS-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
Cc1cc(C)n(-c2cc(C(=O)[O-])cc([N+](=O)[O-])c2C)n1	ZINC000043386510	175031971	/nfs/dbraw/zinc/03/19/71/175031971.db2.gz	AICIJRFFVOPFCC-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
C/C(C(=O)[O-])=C(\C)C(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000071165746	176048261	/nfs/dbraw/zinc/04/82/61/176048261.db2.gz	GRULRODMEADREK-SREVYHEPSA-N	-1	0	282.227	2.093	10	5		CEBERM
CC(C)(C)c1nc(C(=O)[O-])nn1-c1ccccc1[N+](=O)[O-]	ZINC000536958784	330383805	/nfs/dbraw/zinc/38/38/05/330383805.db2.gz	KSAXFLGSKJLWDO-UHFFFAOYSA-N	-1	0	290.279	2.171	10	5		CEBERM
CCO[C@H](CCOc1c(C)cc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000062763230	520513148	/nfs/dbraw/zinc/51/31/48/520513148.db2.gz	SAJVSNKHVUDNNG-GFCCVEGCSA-N	-1	0	297.307	2.470	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1cc(F)ccc1[N+](=O)[O-]	ZINC000061217590	521199492	/nfs/dbraw/zinc/19/94/92/521199492.db2.gz	OMXWBJYXAFPVQS-MRVPVSSYSA-N	-1	0	270.260	2.281	10	5		CEBERM
C[C@@H](CC(=O)[O-])CC(=O)Nc1ccc(F)cc1[N+](=O)[O-]	ZINC000061834806	524392265	/nfs/dbraw/zinc/39/22/65/524392265.db2.gz	ICALWENXKCZDTK-SSDOTTSWSA-N	-1	0	284.243	2.173	10	5		CEBERM
Cc1ccc(N2CCCC[C@@H]2C(=O)[O-])cc1[N+](=O)[O-]	ZINC000061700556	524944858	/nfs/dbraw/zinc/94/48/58/524944858.db2.gz	XDMVTEZVUBJZIE-LLVKDONJSA-N	-1	0	264.281	2.347	10	5		CEBERM
Cc1ccc(N2CC[C@@](C)(C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000062933087	524972933	/nfs/dbraw/zinc/97/29/33/524972933.db2.gz	GQLPVUPBMHCLQC-CYBMUJFWSA-N	-1	0	264.281	2.204	10	5		CEBERM
C[C@]1(C(=O)[O-])CCCN(c2cc(F)ccc2[N+](=O)[O-])C1	ZINC000062874428	525228536	/nfs/dbraw/zinc/22/85/36/525228536.db2.gz	DUHYDQSVWUAJDI-ZDUSSCGKSA-N	-1	0	282.271	2.425	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N[C@@H](CC(C)C)C(=O)[O-]	ZINC000052812096	525577858	/nfs/dbraw/zinc/57/78/58/525577858.db2.gz	YDHNBLUGOYUWBV-JTQLQIEISA-N	-1	0	267.285	2.209	10	5		CEBERM
C[C@@](Nc1ccc([N+](=O)[O-])nc1)(C(=O)[O-])c1ccccc1	ZINC000052879978	525756605	/nfs/dbraw/zinc/75/66/05/525756605.db2.gz	KXODCNPYMSSBGC-AWEZNQCLSA-N	-1	0	287.275	2.402	10	5		CEBERM
Cc1c(N[C@@H](C(=O)[O-])C(C)C)cccc1[N+](=O)[O-]	ZINC000062723529	525872099	/nfs/dbraw/zinc/87/20/99/525872099.db2.gz	HMMZQLNVUZLYCT-LLVKDONJSA-N	-1	0	252.270	2.424	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc2scnc2c1[N+](=O)[O-])C1CC1	ZINC000054521945	526315921	/nfs/dbraw/zinc/31/59/21/526315921.db2.gz	MSAHZAGYPQNPGD-SECBINFHSA-N	-1	0	293.304	2.480	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(OCCc2ccccn2)c1	ZINC000050517637	526384123	/nfs/dbraw/zinc/38/41/23/526384123.db2.gz	RKAFOEVUCJBQOU-UHFFFAOYSA-N	-1	0	288.259	2.310	10	5		CEBERM
Cc1nc(-c2ccccc2[N+](=O)[O-])nc(C)c1C(=O)[O-]	ZINC000054836312	526609702	/nfs/dbraw/zinc/60/97/02/526609702.db2.gz	DQCPYDNGTUSBCH-UHFFFAOYSA-N	-1	0	273.248	2.367	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc2ncccc2c1[N+](=O)[O-])C1CC1	ZINC000054505827	527655759	/nfs/dbraw/zinc/65/57/59/527655759.db2.gz	OOAMMYJAGQAHPW-LBPRGKRZSA-N	-1	0	287.275	2.418	10	5		CEBERM
Cc1nn(-c2cccc([N+](=O)[O-])c2)c(C)c1C(=O)[O-]	ZINC000034956945	361800378	/nfs/dbraw/zinc/80/03/78/361800378.db2.gz	UPNZLZGCZBIWKS-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1CCc1ccccc1	ZINC000041040475	362014654	/nfs/dbraw/zinc/01/46/54/362014654.db2.gz	GUMFTFZAGPLJBZ-UHFFFAOYSA-N	-1	0	260.249	2.337	10	5		CEBERM
COc1cccc2nc3cccc(C(=O)[O-])c3nc21	ZINC000014502710	343368614	/nfs/dbraw/zinc/36/86/14/343368614.db2.gz	DBKFFLIOIULEFA-UHFFFAOYSA-N	-1	0	254.245	2.490	10	5		CEBERM
Cc1cc(Br)c(CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000396135150	344846137	/nfs/dbraw/zinc/84/61/37/344846137.db2.gz	HGQXHOWIWOCDBD-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
C[C@@H](C(=O)[O-])N(C)c1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000054054691	362507695	/nfs/dbraw/zinc/50/76/95/362507695.db2.gz	UKMFXVFXSXNGPQ-QMMMGPOBSA-N	-1	0	275.264	2.052	10	5		CEBERM
Cc1ccc(NC(=O)[C@H]2[C@H](C(=O)[O-])C2(C)C)c([N+](=O)[O-])c1	ZINC000085411049	179057167	/nfs/dbraw/zinc/05/71/67/179057167.db2.gz	FAZVRWOQBOMSQN-GHMZBOCLSA-N	-1	0	292.291	2.199	10	5		CEBERM
O=C([O-])c1cc(NC[C@H]2CCCC[C@H]2O)ccc1[N+](=O)[O-]	ZINC000086016930	179216814	/nfs/dbraw/zinc/21/68/14/179216814.db2.gz	IWJHCCJCKSOZSC-NOZJJQNGSA-N	-1	0	294.307	2.256	10	5		CEBERM
C[C@H](Nc1ccc(Br)c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000086763698	179325611	/nfs/dbraw/zinc/32/56/11/179325611.db2.gz	FZZGIRTYKODPAA-YFKPBYRVSA-N	-1	0	289.085	2.242	10	5		CEBERM
Cc1cnc(S[C@H](C)CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691877	180024528	/nfs/dbraw/zinc/02/45/28/180024528.db2.gz	WUJCXMQUASKJGE-SSDOTTSWSA-N	-1	0	256.283	2.254	10	5		CEBERM
C[C@@H](CCO)Sc1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000091261766	180115810	/nfs/dbraw/zinc/11/58/10/180115810.db2.gz	GZERIMVWIXSUQA-ZETCQYMHSA-N	-1	0	271.294	2.156	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCC[C@@H]1C(=O)[O-]	ZINC000091555896	180190118	/nfs/dbraw/zinc/19/01/18/180190118.db2.gz	OXGRQCNOHNIGBN-UWVGGRQHSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCCc1nn(C)c(N[C@H](CC(C)C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091562420	180193011	/nfs/dbraw/zinc/19/30/11/180193011.db2.gz	PIMLTCMCTVDRBK-SNVBAGLBSA-N	-1	0	298.343	2.192	10	5		CEBERM
CC(C)c1nn(C)c(N[C@H]2CC[C@@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000091577859	180197782	/nfs/dbraw/zinc/19/77/82/180197782.db2.gz	RMKNNFFLBMEFOW-BDAKNGLRSA-N	-1	0	296.327	2.117	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1C[C@H]1COc2ccccc21	ZINC000092303016	180359190	/nfs/dbraw/zinc/35/91/90/180359190.db2.gz	FNZOAPRSBZNJFO-VIFPVBQESA-N	-1	0	288.259	2.271	10	5		CEBERM
O=C([O-])c1cn(-c2ccc3cc([N+](=O)[O-])ccc3n2)cn1	ZINC000109476403	186255388	/nfs/dbraw/zinc/25/53/88/186255388.db2.gz	RTSSPOWUKWHUMZ-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
COc1cc(S[C@@H](C)C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000110625034	186306720	/nfs/dbraw/zinc/30/67/20/186306720.db2.gz	QOAUKWMMAQNHFG-YFKPBYRVSA-N	-1	0	275.257	2.308	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(C(F)(F)F)cc1[C@H](O)C(=O)[O-]	ZINC000575673383	366323528	/nfs/dbraw/zinc/32/35/28/366323528.db2.gz	INMLCTPWTKRFAW-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
Cc1cc(OC(F)(F)F)c([N+](=O)[O-])cc1CC(=O)[O-]	ZINC000575674385	366325160	/nfs/dbraw/zinc/32/51/60/366325160.db2.gz	ROCIQEVYHIHAJW-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
CCc1ccc([N+](=O)[O-])c(C(=O)[O-])c1OC(F)F	ZINC000575659922	366319892	/nfs/dbraw/zinc/31/98/92/366319892.db2.gz	POKRQIAKNABRHX-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCc1ccc([N+](=O)[O-])c(OC(F)F)c1CC(=O)[O-]	ZINC000575660789	366320746	/nfs/dbraw/zinc/32/07/46/366320746.db2.gz	YGKOBAFTSTUMII-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cc(F)c1OC(F)(F)F	ZINC000575711300	366340025	/nfs/dbraw/zinc/34/00/25/366340025.db2.gz	QMWGBJSAFWVIBB-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
O=C([O-])[C@H](O)c1c(Cl)c(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000575693580	366330996	/nfs/dbraw/zinc/33/09/96/366330996.db2.gz	BJAGKURGFMMTDD-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCC[C@H]1C[C@@H]1NC(=O)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000233391734	370518255	/nfs/dbraw/zinc/51/82/55/370518255.db2.gz	LPVTZSQKAPNSPL-KWQFWETISA-N	-1	0	264.281	2.219	10	5		CEBERM
O=C([O-])[C@@]12CCC[C@H]1CN(c1ccccc1[N+](=O)[O-])C2	ZINC000263565026	304168744	/nfs/dbraw/zinc/16/87/44/304168744.db2.gz	VGRFLLCBLLRNFS-IINYFYTJSA-N	-1	0	276.292	2.286	10	5		CEBERM
O=C([O-])c1sc([N+](=O)[O-])cc1Br	ZINC000000967492	304285550	/nfs/dbraw/zinc/28/55/50/304285550.db2.gz	RRCPEQKVVUVCLY-UHFFFAOYSA-N	-1	0	252.045	2.117	10	5		CEBERM
O=C([O-])c1cc(-n2nnc3ccccc32)ccc1[N+](=O)[O-]	ZINC000020303807	171140219	/nfs/dbraw/zinc/14/02/19/171140219.db2.gz	FKUCQLDMUBXVKD-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
COc1ccc(CS[C@@H](C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000020565635	171253882	/nfs/dbraw/zinc/25/38/82/171253882.db2.gz	CYDMRXAQAXQOKR-ZETCQYMHSA-N	-1	0	271.294	2.310	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1OCCCCC(=O)[O-]	ZINC000034957357	171903094	/nfs/dbraw/zinc/90/30/94/171903094.db2.gz	FMPBFUFTGLCBKB-UHFFFAOYSA-N	-1	0	269.253	2.237	10	5		CEBERM
CCCC[C@@H](Nc1ccncc1[N+](=O)[O-])C(=O)[O-]	ZINC000035411219	172182839	/nfs/dbraw/zinc/18/28/39/172182839.db2.gz	SNUXUOYONDPBHI-SECBINFHSA-N	-1	0	253.258	2.045	10	5		CEBERM
CCCN(CC(=O)[O-])c1ccc([N+](=O)[O-])cc1C	ZINC000038021310	173999888	/nfs/dbraw/zinc/99/98/88/173999888.db2.gz	VTOUPWJOBWDOPG-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
CCN(CC)c1ncnc([N-]c2nccs2)c1[N+](=O)[O-]	ZINC000040608042	174353078	/nfs/dbraw/zinc/35/30/78/174353078.db2.gz	XSQBOHQJARJYDD-UHFFFAOYSA-N	-1	0	294.340	2.431	10	5		CEBERM
CCOc1nc[n-]c(=NNc2ccccc2)c1[N+](=O)[O-]	ZINC000040624627	174356361	/nfs/dbraw/zinc/35/63/61/174356361.db2.gz	OKOCIGVEMZAYFS-UHFFFAOYSA-N	-1	0	275.268	2.223	10	5		CEBERM
Cc1nn(-c2cccc(F)c2[N+](=O)[O-])c(C)c1CC(=O)[O-]	ZINC000043299260	175000020	/nfs/dbraw/zinc/00/00/20/175000020.db2.gz	VWCDHIOXHXWECH-UHFFFAOYSA-N	-1	0	293.254	2.164	10	5		CEBERM
CCOCCNc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043387009	175032547	/nfs/dbraw/zinc/03/25/47/175032547.db2.gz	TZLUGLJRABVYNU-UHFFFAOYSA-N	-1	0	268.269	2.050	10	5		CEBERM
O=C([O-])c1cc(Cn2ccc3c2cccc3[N+](=O)[O-])on1	ZINC000071163713	176047009	/nfs/dbraw/zinc/04/70/09/176047009.db2.gz	LBLKOPFBDPOVGB-UHFFFAOYSA-N	-1	0	287.231	2.284	10	5		CEBERM
CC(C)CN(CC(=O)[O-])c1cc(F)ccc1[N+](=O)[O-]	ZINC000062742611	519712217	/nfs/dbraw/zinc/71/22/17/519712217.db2.gz	JXZJOIAZUUDAQM-UHFFFAOYSA-N	-1	0	270.260	2.281	10	5		CEBERM
CCN(C(=O)c1cc(F)ccc1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061149712	520068612	/nfs/dbraw/zinc/06/86/12/520068612.db2.gz	KGVHMYQKTHWSNG-UHFFFAOYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCO[C@H](CSc1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000062766003	520522745	/nfs/dbraw/zinc/52/27/45/520522745.db2.gz	OBAGUCGHCZJQEN-SECBINFHSA-N	-1	0	271.294	2.177	10	5		CEBERM
CCC[C@@H](NC(=O)c1cc([N+](=O)[O-])c(C)cc1C)C(=O)[O-]	ZINC000263198779	520753245	/nfs/dbraw/zinc/75/32/45/520753245.db2.gz	MCRMXVSTIAOVAD-LLVKDONJSA-N	-1	0	294.307	2.195	10	5		CEBERM
CCN(c1cccc(F)c1[N+](=O)[O-])[C@@H](C)CC(=O)[O-]	ZINC000061181769	521496250	/nfs/dbraw/zinc/49/62/50/521496250.db2.gz	JDKJCRZBRCLCIS-QMMMGPOBSA-N	-1	0	270.260	2.423	10	5		CEBERM
CCOc1oc(-c2ccc([N+](=O)[O-])cc2F)nc1C(=O)[O-]	ZINC000061641561	521629744	/nfs/dbraw/zinc/62/97/44/521629744.db2.gz	SLSHPJFSMJKHDK-UHFFFAOYSA-N	-1	0	296.210	2.486	10	5		CEBERM
CN(c1ccc([N+](=O)[O-])cc1F)C(C)(C)C(=O)[O-]	ZINC000061171311	523641390	/nfs/dbraw/zinc/64/13/90/523641390.db2.gz	CJJPDWWHAPUVSO-UHFFFAOYSA-N	-1	0	256.233	2.033	10	5		CEBERM
CO[C@@H]1CCC[C@H]1Nc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000050375508	523662112	/nfs/dbraw/zinc/66/21/12/523662112.db2.gz	OEAKBFPYQZRJOC-BXKDBHETSA-N	-1	0	298.270	2.412	10	5		CEBERM
C[C@H](CCC(=O)[O-])n1ncc2ccc([N+](=O)[O-])cc21	ZINC000050956161	524122668	/nfs/dbraw/zinc/12/26/68/524122668.db2.gz	IYZHYKHYLPSCLJ-MRVPVSSYSA-N	-1	0	263.253	2.370	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N(C)C(C)(C)C(=O)[O-]	ZINC000061171329	525567218	/nfs/dbraw/zinc/56/72/18/525567218.db2.gz	QMXQTQQPTXGIAK-UHFFFAOYSA-N	-1	0	252.270	2.203	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N(CCCC(=O)[O-])C(C)C	ZINC000052812060	525575148	/nfs/dbraw/zinc/57/51/48/525575148.db2.gz	QGNZTBYVMHDWCC-UHFFFAOYSA-N	-1	0	281.312	2.378	10	5		CEBERM
O=C([O-])c1cc(COc2ccc([N+](=O)[O-])cc2)ccn1	ZINC000068764854	526344659	/nfs/dbraw/zinc/34/46/59/526344659.db2.gz	AUSIFOPXIUGHPW-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
Cc1nnc(Sc2cc(C(=O)[O-])cc([N+](=O)[O-])c2C)o1	ZINC000051037563	526391038	/nfs/dbraw/zinc/39/10/38/526391038.db2.gz	SSVWLGWWHZYEAI-UHFFFAOYSA-N	-1	0	295.276	2.444	10	5		CEBERM
O=C([O-])c1cccc(NCCc2ccc([N+](=O)[O-])cc2)n1	ZINC000051043451	526392383	/nfs/dbraw/zinc/39/23/83/526392383.db2.gz	YEQIGBAMYSVKIV-UHFFFAOYSA-N	-1	0	287.275	2.343	10	5		CEBERM
O=C([O-])c1nc(COc2ccc(F)cc2[N+](=O)[O-])cs1	ZINC000052064547	526407592	/nfs/dbraw/zinc/40/75/92/526407592.db2.gz	DTLKUFFLIDKETF-UHFFFAOYSA-N	-1	0	298.251	2.468	10	5		CEBERM
O=C([O-])c1nccnc1Sc1ccc([N+](=O)[O-])cc1	ZINC000054554112	526410659	/nfs/dbraw/zinc/41/06/59/526410659.db2.gz	YDAWBRXQGPVOSN-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@H]1Nc1ccncc1[N+](=O)[O-]	ZINC000085330311	179020115	/nfs/dbraw/zinc/02/01/15/179020115.db2.gz	BUEJAQBQQOEJDI-DTWKUNHWSA-N	-1	0	265.269	2.045	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@@H]1Nc1cc([N+](=O)[O-])ccn1	ZINC000085329769	179020132	/nfs/dbraw/zinc/02/01/32/179020132.db2.gz	OWHRNNASXYRDRL-UWVGGRQHSA-N	-1	0	265.269	2.045	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@@H]1Nc1ccncc1[N+](=O)[O-]	ZINC000085330317	179020449	/nfs/dbraw/zinc/02/04/49/179020449.db2.gz	BUEJAQBQQOEJDI-BDAKNGLRSA-N	-1	0	265.269	2.045	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1[C@@H](C(=O)[O-])C1(C)C	ZINC000085407982	179055598	/nfs/dbraw/zinc/05/55/98/179055598.db2.gz	GZMKHNZYLPAFTA-QWRGUYRKSA-N	-1	0	292.291	2.199	10	5		CEBERM
CCCC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1CC)C(=O)[O-]	ZINC000091557539	180190756	/nfs/dbraw/zinc/19/07/56/180190756.db2.gz	ZRHVTRJLRQXOTE-SECBINFHSA-N	-1	0	284.316	2.175	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@@H](Nc2c(F)c(F)ccc2[N+](=O)[O-])C1	ZINC000092182862	180339498	/nfs/dbraw/zinc/33/94/98/180339498.db2.gz	BPGJHLLWORTMHY-RNFRBKRXSA-N	-1	0	284.218	2.314	10	5		CEBERM
Cc1c(C(=O)N(CC(=O)[O-])C(C)(C)C)cccc1[N+](=O)[O-]	ZINC000092446792	180386426	/nfs/dbraw/zinc/38/64/26/180386426.db2.gz	NEQIHBZEKNTMEM-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])Cc1csc([N+](=O)[O-])c1	ZINC000092450860	180387545	/nfs/dbraw/zinc/38/75/45/180387545.db2.gz	QCIQIMWBPHBQAC-UHFFFAOYSA-N	-1	0	272.326	2.341	10	5		CEBERM
Cc1cc(C(=O)[O-])c(NC(=O)c2ccc([N+](=O)[O-])[nH]2)s1	ZINC000110775039	186323136	/nfs/dbraw/zinc/32/31/36/186323136.db2.gz	DVYHVMDCZHSINL-UHFFFAOYSA-N	-1	0	295.276	2.243	10	5		CEBERM
CCC[C@H]1C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000075559975	363474672	/nfs/dbraw/zinc/47/46/72/363474672.db2.gz	UADOBWAXYUIPGQ-WPRPVWTQSA-N	-1	0	264.281	2.219	10	5		CEBERM
COc1cc(C(F)(F)F)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575673060	366323697	/nfs/dbraw/zinc/32/36/97/366323697.db2.gz	BBYRJCVDXYVINI-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
CCOc1c([N+](=O)[O-])ccc(OC(F)F)c1C(=O)[O-]	ZINC000575658681	366318751	/nfs/dbraw/zinc/31/87/51/366318751.db2.gz	RFMTUZLOHXXZJK-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCc1cc([N+](=O)[O-])c(OC(F)F)cc1CC(=O)[O-]	ZINC000575659555	366319771	/nfs/dbraw/zinc/31/97/71/366319771.db2.gz	IPCYPSCTYRPOML-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
Cc1cc([N+](=O)[O-])cc(CC(=O)[O-])c1OC(F)F	ZINC000575665401	366322286	/nfs/dbraw/zinc/32/22/86/366322286.db2.gz	DBFMFFKZMODNTP-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
COc1c([S-])cc(OC(F)F)cc1[N+](=O)[O-]	ZINC000575665690	366322441	/nfs/dbraw/zinc/32/24/41/366322441.db2.gz	SJBVKNIDXONLGY-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
O=C([O-])c1cc(F)c(OC(F)(F)F)c([N+](=O)[O-])c1	ZINC000575711739	366340193	/nfs/dbraw/zinc/34/01/93/366340193.db2.gz	XIITXZCPCXIQNP-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
CCOc1cc(CC(=O)[O-])c(CC)c([N+](=O)[O-])c1	ZINC000575696340	366331383	/nfs/dbraw/zinc/33/13/83/366331383.db2.gz	LYVQNGGEPWBXHO-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
CCOc1cc([N+](=O)[O-])cc(CC(=O)[O-])c1CC	ZINC000575697108	366332258	/nfs/dbraw/zinc/33/22/58/366332258.db2.gz	UAANWHQEKSACRD-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
CCOc1cc([N+](=O)[O-])cc(CC)c1CC(=O)[O-]	ZINC000575696435	366332907	/nfs/dbraw/zinc/33/29/07/366332907.db2.gz	OKODHAFTFKXSHZ-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
CCOC(=O)Cc1c([O-])cc(Cl)cc1[N+](=O)[O-]	ZINC000575701320	366334393	/nfs/dbraw/zinc/33/43/93/366334393.db2.gz	VTDFYBPQSFJQGP-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
CCOC(=O)c1cc([O-])cc(Br)c1[N+](=O)[O-]	ZINC000575699555	366334462	/nfs/dbraw/zinc/33/44/62/366334462.db2.gz	JAOJEJOFXBZAQS-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
CC(C)C[S@](=O)C=C([O-])c1cccc([N+](=O)[O-])c1	ZINC000081917426	177892714	/nfs/dbraw/zinc/89/27/14/177892714.db2.gz	XNHNKUPOWSRLRO-GOSISDBHSA-N	-1	0	269.322	2.182	10	5		CEBERM
C/C=C/C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(C)c1)C(=O)[O-]	ZINC000263305852	154051333	/nfs/dbraw/zinc/05/13/33/154051333.db2.gz	VXAFNPUJOCXVRW-PGLGOXFNSA-N	-1	0	292.291	2.052	10	5		CEBERM
CC(C)[C@@H](Nc1ncnc2sc([N+](=O)[O-])cc21)C(=O)[O-]	ZINC000263400760	154076225	/nfs/dbraw/zinc/07/62/25/154076225.db2.gz	IUVWHBJANXEPFG-MRVPVSSYSA-N	-1	0	296.308	2.121	10	5		CEBERM
CC[C@H](C)Oc1cc([N+](=O)[O-])c(C(=O)[O-])cc1OC	ZINC000037226497	173046580	/nfs/dbraw/zinc/04/65/80/173046580.db2.gz	ODXYZINWDWQQKF-ZETCQYMHSA-N	-1	0	269.253	2.479	10	5		CEBERM
CCC[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1F)C(=O)[O-]	ZINC000040574484	174340232	/nfs/dbraw/zinc/34/02/32/174340232.db2.gz	ZPNNLCXJPAZHJJ-VIFPVBQESA-N	-1	0	299.258	2.109	10	5		CEBERM
Cc1nc([N-]c2ncnc(N(C)C)c2[N+](=O)[O-])sc1C	ZINC000040608467	174353189	/nfs/dbraw/zinc/35/31/89/174353189.db2.gz	PEOWEGFBEMMNQL-UHFFFAOYSA-N	-1	0	294.340	2.268	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1-c1nnc(CCCC(=O)[O-])o1	ZINC000044747966	175243703	/nfs/dbraw/zinc/24/37/03/175243703.db2.gz	UWRQCLLWRZINPW-UHFFFAOYSA-N	-1	0	291.263	2.361	10	5		CEBERM
Cc1ccnc(N[C@@H](CC(C)C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000070495590	175957117	/nfs/dbraw/zinc/95/71/17/175957117.db2.gz	OFPYCKNCHPRKDV-VIFPVBQESA-N	-1	0	267.285	2.209	10	5		CEBERM
C[C@@H](CCNC(=O)c1ccccc1[N+](=O)[O-])CCC(=O)[O-]	ZINC000079057040	177423498	/nfs/dbraw/zinc/42/34/98/177423498.db2.gz	UJVVSPCBQJAVQA-SNVBAGLBSA-N	-1	0	294.307	2.216	10	5		CEBERM
CCN(c1ccc([N+](=O)[O-])cc1F)[C@@H](C)CC(=O)[O-]	ZINC000061182107	521493166	/nfs/dbraw/zinc/49/31/66/521493166.db2.gz	ZHHKRBPDVXNYSV-QMMMGPOBSA-N	-1	0	270.260	2.423	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1cccc([N+](=O)[O-])c1C	ZINC000062723595	521200320	/nfs/dbraw/zinc/20/03/20/521200320.db2.gz	SGJWSLSTDTYNCR-SECBINFHSA-N	-1	0	266.297	2.450	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000061216797	521243464	/nfs/dbraw/zinc/24/34/64/521243464.db2.gz	XEKVDFOOKAOZCP-VIFPVBQESA-N	-1	0	295.295	2.169	10	5		CEBERM
CCC1(C(=O)[O-])CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000062845801	521675308	/nfs/dbraw/zinc/67/53/08/521675308.db2.gz	VPIOYMOAAIUEHA-UHFFFAOYSA-N	-1	0	279.296	2.071	10	5		CEBERM
Cc1cccc(Oc2nccnc2C(=O)[O-])c1[N+](=O)[O-]	ZINC000054553566	524790505	/nfs/dbraw/zinc/79/05/05/524790505.db2.gz	YBNSOFJTSZKBHR-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
Cc1cc(NC(=O)CCC(=O)[O-])c([N+](=O)[O-])cc1C	ZINC000050439706	525123613	/nfs/dbraw/zinc/12/36/13/525123613.db2.gz	VFNUCQAFAKKWEV-UHFFFAOYSA-N	-1	0	266.253	2.015	10	5		CEBERM
C[C@@](Nc1ccncc1[N+](=O)[O-])(C(=O)[O-])c1ccccc1	ZINC000052879992	525756820	/nfs/dbraw/zinc/75/68/20/525756820.db2.gz	GJNPREFJQSHNOG-AWEZNQCLSA-N	-1	0	287.275	2.402	10	5		CEBERM
Cc1c(N(CC(=O)[O-])C(C)C)cccc1[N+](=O)[O-]	ZINC000062723464	525817262	/nfs/dbraw/zinc/81/72/62/525817262.db2.gz	ZIDDRIWZRRSKFH-UHFFFAOYSA-N	-1	0	252.270	2.203	10	5		CEBERM
C[C@@]1(C(=O)[O-])CCN(c2cc(F)ccc2[N+](=O)[O-])C1	ZINC000062933102	525819567	/nfs/dbraw/zinc/81/95/67/525819567.db2.gz	PTQCNBPHPPJLGV-GFCCVEGCSA-N	-1	0	268.244	2.035	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1-c1ncc(C(=O)[O-])c(C)n1	ZINC000050441299	526066123	/nfs/dbraw/zinc/06/61/23/526066123.db2.gz	YSEFWUSGXXGBLA-UHFFFAOYSA-N	-1	0	273.248	2.367	10	5		CEBERM
O=C([O-])c1ccc(NCc2cccc([N+](=O)[O-])c2)nc1	ZINC000052926083	526379406	/nfs/dbraw/zinc/37/94/06/526379406.db2.gz	HRQHIUOXZZDIQJ-UHFFFAOYSA-N	-1	0	273.248	2.300	10	5		CEBERM
O=C([O-])CC[C@@H]1CCCCN1c1ncccc1[N+](=O)[O-]	ZINC000050923512	527596539	/nfs/dbraw/zinc/59/65/39/527596539.db2.gz	BTVMREMLKNBUHU-JTQLQIEISA-N	-1	0	279.296	2.214	10	5		CEBERM
Cc1cc(Br)c([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000307277004	344721330	/nfs/dbraw/zinc/72/13/30/344721330.db2.gz	YVBTUUUBNRXBQX-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
O=C(N[C@@H]1CCC[C@H]2C[C@H]21)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000592896182	345412657	/nfs/dbraw/zinc/41/26/57/345412657.db2.gz	GXNQACZKJSIEKP-MKPLZMMCSA-N	-1	0	276.292	2.219	10	5		CEBERM
O=C([O-])CCOC1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000111802065	136564936	/nfs/dbraw/zinc/56/49/36/136564936.db2.gz	QWFRWRGFMIYYNO-UHFFFAOYSA-N	-1	0	294.307	2.055	10	5		CEBERM
C[C@@H](CC(=O)[O-])SCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000090097820	179913803	/nfs/dbraw/zinc/91/38/03/179913803.db2.gz	LEFKNDVCZFNUHN-QMMMGPOBSA-N	-1	0	298.320	2.130	10	5		CEBERM
CCC[C@H](CNc1ncc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000090691791	180024708	/nfs/dbraw/zinc/02/47/08/180024708.db2.gz	PBWUZGDKUVSAIA-SECBINFHSA-N	-1	0	267.285	2.211	10	5		CEBERM
CCC[C@@](C)(Nc1ncc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000090691646	180024894	/nfs/dbraw/zinc/02/48/94/180024894.db2.gz	YYERIJLPFVPHMI-GFCCVEGCSA-N	-1	0	267.285	2.354	10	5		CEBERM
CCC[C@@H](CNc1c([N+](=O)[O-])c(C)nn1CCC)C(=O)[O-]	ZINC000091555917	180190322	/nfs/dbraw/zinc/19/03/22/180190322.db2.gz	QHLKLZPOJDMIGG-JTQLQIEISA-N	-1	0	298.343	2.423	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1SC[C@@H](C)C(=O)[O-]	ZINC000091556426	180190472	/nfs/dbraw/zinc/19/04/72/180190472.db2.gz	ZTAVOBGWAKIWKO-SSDOTTSWSA-N	-1	0	287.341	2.323	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1NCC[C@H](C)CCC(=O)[O-]	ZINC000091558490	180190745	/nfs/dbraw/zinc/19/07/45/180190745.db2.gz	CBHYZSBVWVXHRE-SECBINFHSA-N	-1	0	298.343	2.423	10	5		CEBERM
O=C([O-])c1ccc(NN2CCCCC2)c([N+](=O)[O-])c1	ZINC000105790685	186072011	/nfs/dbraw/zinc/07/20/11/186072011.db2.gz	PPUNPTROYCFGLY-UHFFFAOYSA-N	-1	0	265.269	2.106	10	5		CEBERM
O=C([O-])CN(Cc1ccc([N+](=O)[O-])cc1)CC(F)(F)F	ZINC000092443074	180385641	/nfs/dbraw/zinc/38/56/41/180385641.db2.gz	LFPFRWCQLCMMNU-UHFFFAOYSA-N	-1	0	292.213	2.044	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])c1cc(F)ccc1[N+](=O)[O-]	ZINC000092448930	180386946	/nfs/dbraw/zinc/38/69/46/180386946.db2.gz	FXXXBCYRLKEXER-UHFFFAOYSA-N	-1	0	270.260	2.423	10	5		CEBERM
CCc1c(OC(F)F)ccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575657975	366318098	/nfs/dbraw/zinc/31/80/98/366318098.db2.gz	CXBIIXLURHCWDQ-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCOc1cc(OC(F)F)cc(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575658814	366318940	/nfs/dbraw/zinc/31/89/40/366318940.db2.gz	SKPONLPRNZCSLP-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1cc(OC(F)F)c([N+](=O)[O-])cc1CC(=O)[O-]	ZINC000575660813	366321391	/nfs/dbraw/zinc/32/13/91/366321391.db2.gz	ZGKBVCWDSIFJOK-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
Cc1cc(OC(F)F)c(CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000575665405	366322265	/nfs/dbraw/zinc/32/22/65/366322265.db2.gz	DCAZSNDVSQHEFH-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
COc1cc(OC(F)F)cc([S-])c1[N+](=O)[O-]	ZINC000575665645	366322358	/nfs/dbraw/zinc/32/23/58/366322358.db2.gz	SALTYMQGDZMRDM-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
O=C([O-])c1c([N+](=O)[O-])cc(F)cc1C(F)(F)F	ZINC000575710006	366338851	/nfs/dbraw/zinc/33/88/51/366338851.db2.gz	DSNGQJMLLGHQTE-UHFFFAOYSA-N	-1	0	253.107	2.451	10	5		CEBERM
O=C([O-])[C@H](O)c1c(Cl)cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575696605	366332859	/nfs/dbraw/zinc/33/28/59/366332859.db2.gz	XRSVVYALLUFOJV-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)Cc1c([S-])ccc([N+](=O)[O-])c1F	ZINC000575701472	366333868	/nfs/dbraw/zinc/33/38/68/366333868.db2.gz	PTAFYAOTLPWGEB-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
CCOC(=O)c1c(Br)cc([O-])cc1[N+](=O)[O-]	ZINC000575700773	366334547	/nfs/dbraw/zinc/33/45/47/366334547.db2.gz	XUCPFAKOFJAKCR-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
CCc1cc([C@H](O)C(=O)[O-])c(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575706859	366337465	/nfs/dbraw/zinc/33/74/65/366337465.db2.gz	YFICURIUAFUTNP-VIFPVBQESA-N	-1	0	293.197	2.294	10	5		CEBERM
O=C([O-])[C@H]1CCCCN1c1nc2cc([N+](=O)[O-])ccc2o1	ZINC000095077914	304181066	/nfs/dbraw/zinc/18/10/66/304181066.db2.gz	BEHDUBHNKIVYPK-SNVBAGLBSA-N	-1	0	291.263	2.180	10	5		CEBERM
O=C([O-])[C@H]1CCCO[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000092862449	184633225	/nfs/dbraw/zinc/63/32/25/184633225.db2.gz	AYOMKMSNCPWLRK-QWRGUYRKSA-N	-1	0	251.238	2.147	10	5		CEBERM
CC(C)OCCOc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000019274868	170768866	/nfs/dbraw/zinc/76/88/66/170768866.db2.gz	GMSFCJUKARTNRS-UHFFFAOYSA-N	-1	0	269.253	2.097	10	5		CEBERM
Cc1nn(-c2cccc([N+](=O)[O-])c2)c(Cl)c1C(=O)[O-]	ZINC000037326982	173128075	/nfs/dbraw/zinc/12/80/75/173128075.db2.gz	SSRDNFBOXPXKFJ-UHFFFAOYSA-N	-1	0	281.655	2.441	10	5		CEBERM
COc1ccc(OCc2ccoc2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000037329429	173130410	/nfs/dbraw/zinc/13/04/10/173130410.db2.gz	GTRXKGBTSJRGBN-UHFFFAOYSA-N	-1	0	293.231	2.474	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc([N+](=O)[O-])nc1)C1CCCCC1	ZINC000038037086	174036743	/nfs/dbraw/zinc/03/67/43/174036743.db2.gz	JSWPKCFWPFOMFV-LBPRGKRZSA-N	-1	0	279.296	2.435	10	5		CEBERM
CC(C)Nc1ncnc([N-]c2nccs2)c1[N+](=O)[O-]	ZINC000040597510	174349358	/nfs/dbraw/zinc/34/93/58/174349358.db2.gz	QBSWGWLPTUPYKQ-UHFFFAOYSA-N	-1	0	280.313	2.405	10	5		CEBERM
O=C([O-])c1cnn(-c2ccc3scnc3c2[N+](=O)[O-])c1	ZINC000043299419	175000086	/nfs/dbraw/zinc/00/00/86/175000086.db2.gz	FRYZSSBGDLNXAR-UHFFFAOYSA-N	-1	0	290.260	2.088	10	5		CEBERM
Cc1c(NC2CCOCC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043387013	175032421	/nfs/dbraw/zinc/03/24/21/175032421.db2.gz	MVQYCYGAXQHGED-UHFFFAOYSA-N	-1	0	280.280	2.192	10	5		CEBERM
CCc1ccc(OCc2cc(C(=O)[O-])no2)c([N+](=O)[O-])c1	ZINC000070497362	175957801	/nfs/dbraw/zinc/95/78/01/175957801.db2.gz	YACLKJVJCZXBLX-UHFFFAOYSA-N	-1	0	292.247	2.422	10	5		CEBERM
CC(C)Cc1nc(-c2ccc([O-])c([N+](=O)[O-])c2)n[nH]1	ZINC000072237700	176346510	/nfs/dbraw/zinc/34/65/10/176346510.db2.gz	GEGSSEKUPCIAHR-UHFFFAOYSA-N	-1	0	262.269	2.284	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)CC(=O)[O-]	ZINC000061180872	520090354	/nfs/dbraw/zinc/09/03/54/520090354.db2.gz	FCTFZMCETFEMBY-QMMMGPOBSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000061216817	521194587	/nfs/dbraw/zinc/19/45/87/521194587.db2.gz	MODOKNSGYMXLGU-SECBINFHSA-N	-1	0	295.295	2.169	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])C(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000061215076	521196895	/nfs/dbraw/zinc/19/68/95/521196895.db2.gz	QEDPUFMVQFEPQP-SNVBAGLBSA-N	-1	0	294.307	2.086	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])C(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000061216644	521197208	/nfs/dbraw/zinc/19/72/08/521197208.db2.gz	FDFGIKAVZGPNCM-SNVBAGLBSA-N	-1	0	294.307	2.086	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1cc(F)ccc1[N+](=O)[O-]	ZINC000061217592	521247014	/nfs/dbraw/zinc/24/70/14/521247014.db2.gz	OMXWBJYXAFPVQS-QMMMGPOBSA-N	-1	0	270.260	2.281	10	5		CEBERM
Cc1ccc(N(C)C[C@@H](C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000061700598	524886793	/nfs/dbraw/zinc/88/67/93/524886793.db2.gz	GTNYMQSACCLWQD-SECBINFHSA-N	-1	0	252.270	2.060	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc2ncccc2c1[N+](=O)[O-])C1CC1	ZINC000054505829	526315802	/nfs/dbraw/zinc/31/58/02/526315802.db2.gz	OOAMMYJAGQAHPW-GFCCVEGCSA-N	-1	0	287.275	2.418	10	5		CEBERM
O=C([O-])c1c(Cl)cccc1-n1cc([N+](=O)[O-])cn1	ZINC000054552458	526340331	/nfs/dbraw/zinc/34/03/31/526340331.db2.gz	WVTAFWBGAGIMIU-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NC(=O)C1CC=CC1	ZINC000069412754	526355092	/nfs/dbraw/zinc/35/50/92/526355092.db2.gz	RXTVYHOEBCNUBQ-UHFFFAOYSA-N	-1	0	276.248	2.198	10	5		CEBERM
O=C([O-])c1cnn(-c2cccc([N+](=O)[O-])c2)c1C(F)F	ZINC000061630042	526405241	/nfs/dbraw/zinc/40/52/41/526405241.db2.gz	RIFBFPXZLQWATG-UHFFFAOYSA-N	-1	0	283.190	2.416	10	5		CEBERM
Cc1occc1C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000060362172	526815327	/nfs/dbraw/zinc/81/53/27/526815327.db2.gz	UQMKKNCPLKWBEA-UHFFFAOYSA-N	-1	0	290.231	2.447	10	5		CEBERM
O=C([O-])/C=C/COc1cc([N+](=O)[O-])ccc1Cl	ZINC000070088935	527544011	/nfs/dbraw/zinc/54/40/11/527544011.db2.gz	HFVYFLRYGJVENU-OWOJBTEDSA-N	-1	0	257.629	2.268	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cnc1NC1CCCC1	ZINC000082555454	178090520	/nfs/dbraw/zinc/09/05/20/178090520.db2.gz	HIEFCYOKKJZRHW-UHFFFAOYSA-N	-1	0	251.242	2.043	10	5		CEBERM
CC(C)(C)OC(=O)[C@H](CC(=O)[O-])c1cccc([N+](=O)[O-])c1	ZINC000095932468	185032289	/nfs/dbraw/zinc/03/22/89/185032289.db2.gz	HKOJIZDDLITPPA-LLVKDONJSA-N	-1	0	295.291	2.495	10	5		CEBERM
Cc1cc(Br)c(CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000396137049	344846202	/nfs/dbraw/zinc/84/62/02/344846202.db2.gz	MQFOGQTXLQWCSG-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
Nc1cccc2c1ccc1c(=O)cc(C(=O)[O-])[nH]c12	ZINC000584597677	344961761	/nfs/dbraw/zinc/96/17/61/344961761.db2.gz	NUIJAPQTFPBMED-UHFFFAOYSA-N	-1	0	254.245	2.374	10	5		CEBERM
Cc1nn(C(C)C)c(N2CCCC[C@@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000097127904	185542864	/nfs/dbraw/zinc/54/28/64/185542864.db2.gz	NXKHRNCJTQPICF-SNVBAGLBSA-N	-1	0	296.327	2.124	10	5		CEBERM
CCN(CC(=O)[O-])c1cc(F)c(Cl)cc1[N+](=O)[O-]	ZINC000097355483	185587903	/nfs/dbraw/zinc/58/79/03/185587903.db2.gz	GHVLVWYNYBIEIV-UHFFFAOYSA-N	-1	0	276.651	2.298	10	5		CEBERM
COc1cc(N[C@H]2CCC[C@H]2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000085328486	179019278	/nfs/dbraw/zinc/01/92/78/179019278.db2.gz	QBRKHCKBPOKTRO-ZJUUUORDSA-N	-1	0	280.280	2.269	10	5		CEBERM
Cc1ccc(NC(=O)[C@@H]2[C@H](C(=O)[O-])C2(C)C)c([N+](=O)[O-])c1	ZINC000085411048	179056866	/nfs/dbraw/zinc/05/68/66/179056866.db2.gz	FAZVRWOQBOMSQN-WDEREUQCSA-N	-1	0	292.291	2.199	10	5		CEBERM
CCCCCNc1ncc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000098129083	185691470	/nfs/dbraw/zinc/69/14/70/185691470.db2.gz	ZSQNAXSMTLHQED-UHFFFAOYSA-N	-1	0	253.258	2.290	10	5		CEBERM
CCC[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000087489334	179433860	/nfs/dbraw/zinc/43/38/60/179433860.db2.gz	MSWXQDFXOXNHJM-VIFPVBQESA-N	-1	0	295.295	2.217	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1Cc1ccncc1Cl	ZINC000088782027	179671813	/nfs/dbraw/zinc/67/18/13/179671813.db2.gz	BCKRUARPNBNEJV-UHFFFAOYSA-N	-1	0	281.655	2.191	10	5		CEBERM
O=C([O-])c1ccc(NC[C@@H]2CCC[C@H]2CO)c([N+](=O)[O-])c1	ZINC000089502210	179805626	/nfs/dbraw/zinc/80/56/26/179805626.db2.gz	QZURTGVZOFMQGQ-QWRGUYRKSA-N	-1	0	294.307	2.114	10	5		CEBERM
CC(C)c1nn(C)c(N[C@H]2CCC[C@@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000091584422	180199438	/nfs/dbraw/zinc/19/94/38/180199438.db2.gz	ATCWXTZRSZQMDU-IUCAKERBSA-N	-1	0	296.327	2.117	10	5		CEBERM
Cc1cc(N[C@@H]2CCCC[C@@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000092026515	180308821	/nfs/dbraw/zinc/30/88/21/180308821.db2.gz	GFBSIVQJJIIYRP-VHSXEESVSA-N	-1	0	279.296	2.354	10	5		CEBERM
C[C@@H]1CN(c2ccc(C(=O)[O-])cc2[N+](=O)[O-])C[C@H]1C	ZINC000092085932	180320107	/nfs/dbraw/zinc/32/01/07/180320107.db2.gz	QQRDITCBZLKJQF-RKDXNWHRSA-N	-1	0	264.281	2.385	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N[C@H]1C=C[C@H](C(=O)[O-])C1	ZINC000092182991	180339341	/nfs/dbraw/zinc/33/93/41/180339341.db2.gz	AEPWRXRUMAQISZ-UWVGGRQHSA-N	-1	0	262.265	2.344	10	5		CEBERM
Cc1ccc(N[C@H]2C=C[C@@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000092183788	180340018	/nfs/dbraw/zinc/34/00/18/180340018.db2.gz	ACHWASQBZHTXSU-ZJUUUORDSA-N	-1	0	262.265	2.344	10	5		CEBERM
CCCc1c([O-])nc(-c2ccc([N+](=O)[O-])cc2)[nH]c1=O	ZINC000110619793	186305195	/nfs/dbraw/zinc/30/51/95/186305195.db2.gz	DPLHTHVJSDCVFK-UHFFFAOYSA-N	-1	0	275.264	2.003	10	5		CEBERM
COc1cc([S-])cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575666643	366323379	/nfs/dbraw/zinc/32/33/79/366323379.db2.gz	XRBRECLDZNPPCK-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
Cc1cc(CC(=O)[O-])c(OC(F)F)c([N+](=O)[O-])c1	ZINC000575668294	366323723	/nfs/dbraw/zinc/32/37/23/366323723.db2.gz	UIHNCSFYVVJJPE-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
COc1cc([N+](=O)[O-])cc(C(F)(F)F)c1CC(=O)[O-]	ZINC000575678640	366325883	/nfs/dbraw/zinc/32/58/83/366325883.db2.gz	JBKIOFSJABTAPL-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
CCOc1c(OC(F)F)ccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575657104	366316318	/nfs/dbraw/zinc/31/63/18/366316318.db2.gz	JFKKKVFZUFQWAT-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1c(OC(F)F)ccc(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000575659773	366319952	/nfs/dbraw/zinc/31/99/52/366319952.db2.gz	YTDFKYPPVXYXEY-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
O=C([O-])Cc1cc(OC(F)(F)F)cc([N+](=O)[O-])c1F	ZINC000575710537	366338720	/nfs/dbraw/zinc/33/87/20/366338720.db2.gz	JMJBGDHUPPSLQK-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
CC(=O)c1cc([N+](=O)[O-])c(Br)cc1[O-]	ZINC000575691599	366330548	/nfs/dbraw/zinc/33/05/48/366330548.db2.gz	OTHYGTIOLBPKAB-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CCC[C@H]1C[C@H]1NC(=O)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000233385249	370517819	/nfs/dbraw/zinc/51/78/19/370517819.db2.gz	LPVTZSQKAPNSPL-GZMMTYOYSA-N	-1	0	264.281	2.219	10	5		CEBERM
Nc1nc(Nc2ccc(C(=O)[O-])cc2F)ccc1[N+](=O)[O-]	ZINC000094260986	184770654	/nfs/dbraw/zinc/77/06/54/184770654.db2.gz	CEGHHDGZLPNJFQ-UHFFFAOYSA-N	-1	0	292.226	2.153	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1-n1nnc2ccccc21	ZINC000020303805	171140471	/nfs/dbraw/zinc/14/04/71/171140471.db2.gz	WVEZYRAJMBNZMJ-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](CC(C)C)C(=O)[O-]	ZINC000020362130	171160801	/nfs/dbraw/zinc/16/08/01/171160801.db2.gz	HCXKSCULFKGPIS-JTQLQIEISA-N	-1	0	294.307	2.132	10	5		CEBERM
O=C([O-])Cc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000020432905	171198021	/nfs/dbraw/zinc/19/80/21/171198021.db2.gz	JEHKDRYEHCWSCO-UHFFFAOYSA-N	-1	0	264.262	2.345	10	5		CEBERM
O=C([O-])CCCCOc1cc(F)ccc1[N+](=O)[O-]	ZINC000020474337	171218706	/nfs/dbraw/zinc/21/87/06/171218706.db2.gz	JDIBRFZGCJBZRX-UHFFFAOYSA-N	-1	0	257.217	2.368	10	5		CEBERM
O=C([O-])[C@H]1C[C@@H]2CCCC[C@@H]2N1c1ccc([N+](=O)[O-])cn1	ZINC000022162248	171364280	/nfs/dbraw/zinc/36/42/80/171364280.db2.gz	KSQYMMLYEFTJBP-ZMLRMANQSA-N	-1	0	291.307	2.212	10	5		CEBERM
Cc1nc2cc(NCCC(=O)[O-])c([N+](=O)[O-])cc2s1	ZINC000035342352	172134843	/nfs/dbraw/zinc/13/48/43/172134843.db2.gz	SENFUQZUIAHOAY-UHFFFAOYSA-N	-1	0	281.293	2.400	10	5		CEBERM
O=C([O-])CSc1ccc2scnc2c1[N+](=O)[O-]	ZINC000035344340	172136487	/nfs/dbraw/zinc/13/64/87/172136487.db2.gz	ZGNWQGZFFSFMTQ-UHFFFAOYSA-N	-1	0	270.291	2.381	10	5		CEBERM
C[C@@H](Nc1ccc([N+](=O)[O-])c2cccnc12)C(=O)[O-]	ZINC000035407102	172177686	/nfs/dbraw/zinc/17/76/86/172177686.db2.gz	CKFZEAPPIZFJDG-SSDOTTSWSA-N	-1	0	261.237	2.028	10	5		CEBERM
Cc1cc([N-]c2ncnc(OC(C)C)c2[N+](=O)[O-])no1	ZINC000040582320	174345203	/nfs/dbraw/zinc/34/52/03/174345203.db2.gz	VFBIQOWPHQHHPU-UHFFFAOYSA-N	-1	0	279.256	2.212	10	5		CEBERM
Cc1c(OC[C@H]2CCOC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386656	175032539	/nfs/dbraw/zinc/03/25/39/175032539.db2.gz	NISKGWRVTHTQJK-VIFPVBQESA-N	-1	0	281.264	2.017	10	5		CEBERM
CC[C@H](COC)Nc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000079768725	177552972	/nfs/dbraw/zinc/55/29/72/177552972.db2.gz	XBGDMIWSJDCCSR-MRVPVSSYSA-N	-1	0	268.269	2.130	10	5		CEBERM
COc1cc2c(C)c(C(=O)[O-])[nH]c2c([N+](=O)[O-])c1	ZINC000095835628	295029171	/nfs/dbraw/zinc/02/91/71/295029171.db2.gz	VBFVTVGTTAAFNW-UHFFFAOYSA-N	-1	0	250.210	2.091	10	5		CEBERM
CCO[C@H](CCOc1cccc(C)c1[N+](=O)[O-])C(=O)[O-]	ZINC000062763792	520514646	/nfs/dbraw/zinc/51/46/46/520514646.db2.gz	WWYSIZAYAIGZJJ-LLVKDONJSA-N	-1	0	283.280	2.162	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NCC(F)(F)F	ZINC000019845348	518201564	/nfs/dbraw/zinc/20/15/64/518201564.db2.gz	NUXPVKBNPAFWGA-UHFFFAOYSA-N	-1	0	264.159	2.267	10	5		CEBERM
CCN(C(=O)c1cccc(C)c1[N+](=O)[O-])[C@@H](C)CC(=O)[O-]	ZINC000061178275	520097342	/nfs/dbraw/zinc/09/73/42/520097342.db2.gz	AZWPYPUGJRKGEP-JTQLQIEISA-N	-1	0	294.307	2.229	10	5		CEBERM
COc1cc(C=O)c([N+](=O)[O-])cc1O[C@@H](C)CCC(=O)[O-]	ZINC000050955348	522310577	/nfs/dbraw/zinc/31/05/77/522310577.db2.gz	OQIIDXNXSDXTPJ-QMMMGPOBSA-N	-1	0	297.263	2.048	10	5		CEBERM
CN(CC1CC1)c1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070232418	522632755	/nfs/dbraw/zinc/63/27/55/522632755.db2.gz	JMFLGNXNVDWDCT-UHFFFAOYSA-N	-1	0	250.254	2.139	10	5		CEBERM
Cc1c(N[C@H]2C[C@@H]2C)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000052293923	525879137	/nfs/dbraw/zinc/87/91/37/525879137.db2.gz	FRTMIZGSBBSJSL-RCOVLWMOSA-N	-1	0	250.254	2.422	10	5		CEBERM
Cc1c([N+](=O)[O-])cccc1N1CCCC[C@H]1C(=O)[O-]	ZINC000062723445	525931221	/nfs/dbraw/zinc/93/12/21/525931221.db2.gz	SBMHRGUUMUKIJM-LBPRGKRZSA-N	-1	0	264.281	2.347	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1-c1noc([C@H]2C[C@@H]2C(=O)[O-])n1	ZINC000050441233	526070291	/nfs/dbraw/zinc/07/02/91/526070291.db2.gz	QBTIXLPTDDRBBB-UWVGGRQHSA-N	-1	0	289.247	2.141	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N(CCC(=O)[O-])C1CC1	ZINC000053734287	526076723	/nfs/dbraw/zinc/07/67/23/526076723.db2.gz	SRLSIZBOJAYWMS-UHFFFAOYSA-N	-1	0	264.281	2.347	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1-n1nnc2ccccc21	ZINC000070231953	526384220	/nfs/dbraw/zinc/38/42/20/526384220.db2.gz	LQDUSBGXKZTZMG-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
O=C([O-])c1ccc([S@](=O)Cc2ccccc2[N+](=O)[O-])o1	ZINC000069364038	526385246	/nfs/dbraw/zinc/38/52/46/526385246.db2.gz	VEHVIYQIJFKULS-FQEVSTJZSA-N	-1	0	295.272	2.194	10	5		CEBERM
Cc1nn(-c2ccc(C)c([N+](=O)[O-])c2)c(C)c1C(=O)[O-]	ZINC000061701507	527521667	/nfs/dbraw/zinc/52/16/67/527521667.db2.gz	RPRBFOAKYUALCE-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
CS(=O)(=O)c1cccc(-c2ccc([O-])c([N+](=O)[O-])c2)c1	ZINC000095494978	184997947	/nfs/dbraw/zinc/99/79/47/184997947.db2.gz	DIQDOAYMPMGPBF-UHFFFAOYSA-N	-1	0	293.300	2.371	10	5		CEBERM
O=C([O-])c1scc([N+](=O)[O-])c1Br	ZINC000096960074	185142390	/nfs/dbraw/zinc/14/23/90/185142390.db2.gz	HVQAUAVFQXTTEJ-UHFFFAOYSA-N	-1	0	252.045	2.117	10	5		CEBERM
O=[N+]([O-])c1cc(Cl)c([S@@](=O)[O-])c(Cl)c1	ZINC000199824951	539172707	/nfs/dbraw/zinc/17/27/07/539172707.db2.gz	OCDDDQQLHWWFLP-UHFFFAOYSA-N	-1	0	256.066	2.482	10	5		CEBERM
O=C([O-])COc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000034213091	343418652	/nfs/dbraw/zinc/41/86/52/343418652.db2.gz	FMMDNTXLWDHKSS-UHFFFAOYSA-N	-1	0	265.143	2.077	10	5		CEBERM
Cc1c(Br)c([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000306935119	344718923	/nfs/dbraw/zinc/71/89/23/344718923.db2.gz	HUPJCCWIWUBOKY-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
C[C@@](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])(C(=O)[O-])C1CC1	ZINC000084095898	178787447	/nfs/dbraw/zinc/78/74/47/178787447.db2.gz	RRCNGNWCFLTBDH-LBPRGKRZSA-N	-1	0	295.251	2.168	10	5		CEBERM
CCOC(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c([O-])c2)C1	ZINC000584653906	344974132	/nfs/dbraw/zinc/97/41/32/344974132.db2.gz	MMVKACFQJBPRGJ-SNVBAGLBSA-N	-1	0	294.307	2.080	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H]1Nc1ccc(F)cc1[N+](=O)[O-]	ZINC000085328775	179019764	/nfs/dbraw/zinc/01/97/64/179019764.db2.gz	IYLZSKMHRCJNLK-DTWKUNHWSA-N	-1	0	268.244	2.399	10	5		CEBERM
CC1(C)[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@@H]1C(=O)[O-]	ZINC000085407985	179055421	/nfs/dbraw/zinc/05/54/21/179055421.db2.gz	BRNLXLIBKTYZCH-VHSXEESVSA-N	-1	0	296.254	2.029	10	5		CEBERM
CC(C)[C@@H](Sc1ccc([N+](=O)[O-])c2nonc21)C(=O)[O-]	ZINC000097824626	185672065	/nfs/dbraw/zinc/67/20/65/185672065.db2.gz	YXBPEUOELFXJCN-SNVBAGLBSA-N	-1	0	297.292	2.332	10	5		CEBERM
Cc1cc(OCc2n[n-]c(=S)o2)ccc1[N+](=O)[O-]	ZINC000064872459	362797286	/nfs/dbraw/zinc/79/72/86/362797286.db2.gz	UNJDIMWBJCYBKM-UHFFFAOYSA-N	-1	0	267.266	2.154	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NC[C@H]1CCCC[C@H]1O	ZINC000086016923	179216667	/nfs/dbraw/zinc/21/66/67/179216667.db2.gz	STTXLGDYXIENMN-NOZJJQNGSA-N	-1	0	294.307	2.256	10	5		CEBERM
COc1ccc(SC[C@@H](C)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000086111091	179232968	/nfs/dbraw/zinc/23/29/68/179232968.db2.gz	KQVXWRLQOSLNRB-SSDOTTSWSA-N	-1	0	271.294	2.416	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@@H]1CNc1cc([N+](=O)[O-])ccn1	ZINC000089382561	179776132	/nfs/dbraw/zinc/77/61/32/179776132.db2.gz	OSKZSCKJARDPNY-KOLCDFICSA-N	-1	0	279.296	2.293	10	5		CEBERM
Cc1cnc(N2CCCCC[C@@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691767	180024745	/nfs/dbraw/zinc/02/47/45/180024745.db2.gz	CUOASCXCJQJOCK-SNVBAGLBSA-N	-1	0	279.296	2.132	10	5		CEBERM
Cc1cn([C@@H](C)c2ccc(C(=O)[O-])o2)nc1[N+](=O)[O-]	ZINC000091779968	180252857	/nfs/dbraw/zinc/25/28/57/180252857.db2.gz	KXVCQGNCHYUMNT-ZETCQYMHSA-N	-1	0	265.225	2.000	10	5		CEBERM
Cc1nn([C@H](C)c2ccc(C(=O)[O-])o2)c(C)c1[N+](=O)[O-]	ZINC000091779706	180252933	/nfs/dbraw/zinc/25/29/33/180252933.db2.gz	VZRMUKLIQUSZKT-SSDOTTSWSA-N	-1	0	279.252	2.309	10	5		CEBERM
O=C([O-])c1ccn(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1	ZINC000091839834	180267861	/nfs/dbraw/zinc/26/78/61/180267861.db2.gz	VOWLCTFAMOXBOW-UHFFFAOYSA-N	-1	0	291.219	2.051	10	5		CEBERM
Cc1cc(Oc2cccnc2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000092048172	180312283	/nfs/dbraw/zinc/31/22/83/180312283.db2.gz	ONBUOCXJOISPAK-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1C[C@@H]1COc2ccccc21	ZINC000092303015	180359401	/nfs/dbraw/zinc/35/94/01/180359401.db2.gz	FNZOAPRSBZNJFO-SECBINFHSA-N	-1	0	288.259	2.271	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@@H](Nc2cc(F)cc([N+](=O)[O-])c2)C1	ZINC000092183579	180339264	/nfs/dbraw/zinc/33/92/64/180339264.db2.gz	NXIQVNLWFKMKRQ-IONNQARKSA-N	-1	0	266.228	2.175	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@@H](Nc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000092182804	180339567	/nfs/dbraw/zinc/33/95/67/180339567.db2.gz	GYBAYRKGGVXWLH-IONNQARKSA-N	-1	0	266.228	2.175	10	5		CEBERM
COc1cc(N[C@@H](C(=O)[O-])C(C)C)c([N+](=O)[O-])cc1F	ZINC000110624903	186306303	/nfs/dbraw/zinc/30/63/03/186306303.db2.gz	FWYHUTJJZDOOJI-LLVKDONJSA-N	-1	0	286.259	2.264	10	5		CEBERM
CN(C[C@H]1CCCOC1)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000111164814	186364367	/nfs/dbraw/zinc/36/43/67/186364367.db2.gz	HYTZDMMGUZNJAH-SNVBAGLBSA-N	-1	0	294.307	2.156	10	5		CEBERM
Cc1c(CC(=O)[O-])ccc(OC(F)F)c1[N+](=O)[O-]	ZINC000575667462	366323766	/nfs/dbraw/zinc/32/37/66/366323766.db2.gz	NKDYVPFZALLCMH-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
CCOc1cc(CC)c([N+](=O)[O-])c(CC(=O)[O-])c1	ZINC000575697570	366332817	/nfs/dbraw/zinc/33/28/17/366332817.db2.gz	ZFQJABYYENMILJ-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
O=C([O-])/C=C/c1ccc([N+](=O)[O-])cc1Br	ZINC000382632555	375190651	/nfs/dbraw/zinc/19/06/51/375190651.db2.gz	GKISBRWAXUIPOD-DUXPYHPUSA-N	-1	0	272.054	2.455	10	5		CEBERM
O=C([O-])CC1CN(c2ccc([N+](=O)[O-])cc2C(F)F)C1	ZINC000081742191	177848729	/nfs/dbraw/zinc/84/87/29/177848729.db2.gz	HDVDTSSDSQHKRK-UHFFFAOYSA-N	-1	0	286.234	2.443	10	5		CEBERM
CCC[C@@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000263566043	154129438	/nfs/dbraw/zinc/12/94/38/154129438.db2.gz	WDVCNENUJUUHKH-LLVKDONJSA-N	-1	0	280.280	2.463	10	5		CEBERM
Cc1nn(-c2ccc(C(=O)[O-])cc2)c(C)c1[N+](=O)[O-]	ZINC000005881551	170149829	/nfs/dbraw/zinc/14/98/29/170149829.db2.gz	ZGCUISSOHCLIPT-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000006336839	170193511	/nfs/dbraw/zinc/19/35/11/170193511.db2.gz	GBKMCOBNNVQTKB-UWVGGRQHSA-N	-1	0	290.275	2.200	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1O[C@H](C(=O)[O-])C(C)C	ZINC000019412399	170790043	/nfs/dbraw/zinc/79/00/43/170790043.db2.gz	MJRHPOALJDJLTP-NSHDSACASA-N	-1	0	269.253	2.091	10	5		CEBERM
Cc1noc(C)c1COc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000021954027	171341169	/nfs/dbraw/zinc/34/11/69/171341169.db2.gz	NPZGRSSCHURHIU-UHFFFAOYSA-N	-1	0	292.247	2.477	10	5		CEBERM
CN(Cc1cccnc1)c1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000035134965	172001473	/nfs/dbraw/zinc/00/14/73/172001473.db2.gz	IJBFPWVQJJLUJR-UHFFFAOYSA-N	-1	0	287.275	2.324	10	5		CEBERM
CCC[C@](C)(Nc1ccc([N+](=O)[O-])nc1)C(=O)[O-]	ZINC000036807720	172722506	/nfs/dbraw/zinc/72/25/06/172722506.db2.gz	UQHJOXSZLQCWGM-NSHDSACASA-N	-1	0	253.258	2.045	10	5		CEBERM
O=C([O-])c1ccc(Sc2ccccc2[N+](=O)[O-])nn1	ZINC000037527355	173251081	/nfs/dbraw/zinc/25/10/81/173251081.db2.gz	HTUMHXAFOBPENY-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
Cc1ccnc(NC(C)(C)CCC(=O)[O-])c1[N+](=O)[O-]	ZINC000070495599	175956903	/nfs/dbraw/zinc/95/69/03/175956903.db2.gz	XXRRWPAJHBMWIV-UHFFFAOYSA-N	-1	0	267.285	2.354	10	5		CEBERM
CC1CC(C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000536195970	298194949	/nfs/dbraw/zinc/19/49/49/298194949.db2.gz	DCKIHXDKIYTEGN-UHFFFAOYSA-N	-1	0	250.254	2.285	10	5		CEBERM
O=[N+]([O-])c1nc(Cl)c(Br)cc1[O-]	ZINC000095643088	304812774	/nfs/dbraw/zinc/81/27/74/304812774.db2.gz	MKBVBKWNRVJEHT-UHFFFAOYSA-N	-1	0	253.439	2.111	10	5		CEBERM
CC(C)CN(CC(=O)[O-])c1cccc(F)c1[N+](=O)[O-]	ZINC000062742574	519712226	/nfs/dbraw/zinc/71/22/26/519712226.db2.gz	ZORZCKGIXYGQRQ-UHFFFAOYSA-N	-1	0	270.260	2.281	10	5		CEBERM
CCO[C@@H](CCOc1cc([N+](=O)[O-])ccc1C)C(=O)[O-]	ZINC000062763766	520305093	/nfs/dbraw/zinc/30/50/93/520305093.db2.gz	TUZABCNUFNBTHU-NSHDSACASA-N	-1	0	283.280	2.162	10	5		CEBERM
CCC[C@@]1(C(=O)[O-])CCN(c2ncc([N+](=O)[O-])cc2C)C1	ZINC000062934340	520947294	/nfs/dbraw/zinc/94/72/94/520947294.db2.gz	QHRHNLMCTPIWAT-CQSZACIVSA-N	-1	0	293.323	2.379	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])C(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000061214861	521244024	/nfs/dbraw/zinc/24/40/24/521244024.db2.gz	RIVDEPBJNXUJTE-JTQLQIEISA-N	-1	0	294.307	2.086	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])C(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000061216645	521244606	/nfs/dbraw/zinc/24/46/06/521244606.db2.gz	FDFGIKAVZGPNCM-JTQLQIEISA-N	-1	0	294.307	2.086	10	5		CEBERM
Cc1cc(C)c(Oc2nccnc2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000054553500	524311490	/nfs/dbraw/zinc/31/14/90/524311490.db2.gz	GNWLGHJDLIMOMN-UHFFFAOYSA-N	-1	0	289.247	2.492	10	5		CEBERM
C[C@@H](Nc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F)[C@@H]1CCCO1	ZINC000050030086	525697502	/nfs/dbraw/zinc/69/75/02/525697502.db2.gz	UACQIWWJYLVRTF-KRTXAFLBSA-N	-1	0	298.270	2.412	10	5		CEBERM
Cc1c([N+](=O)[O-])cccc1N1CCC[C@H](C(=O)[O-])C1	ZINC000062723396	525930123	/nfs/dbraw/zinc/93/01/23/525930123.db2.gz	CJESLUZFGQTVHI-JTQLQIEISA-N	-1	0	264.281	2.204	10	5		CEBERM
O=C([O-])[C@H](NCc1ccc([N+](=O)[O-])o1)c1ccccc1	ZINC000050509697	526313010	/nfs/dbraw/zinc/31/30/10/526313010.db2.gz	JGCXDDWCDCIDAR-GFCCVEGCSA-N	-1	0	276.248	2.103	10	5		CEBERM
O=C([O-])[C@H]1CCCN(c2c(F)c(F)ccc2[N+](=O)[O-])C1	ZINC000053162326	526323819	/nfs/dbraw/zinc/32/38/19/526323819.db2.gz	JJPFGALRCMVSQP-ZETCQYMHSA-N	-1	0	286.234	2.174	10	5		CEBERM
O=C([O-])c1cnn(-c2ccccc2[N+](=O)[O-])c1C(F)F	ZINC000061630037	526405263	/nfs/dbraw/zinc/40/52/63/526405263.db2.gz	KXRWDTLTTGKDFM-UHFFFAOYSA-N	-1	0	283.190	2.416	10	5		CEBERM
CCC[C@@H]1C[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000155588962	527864834	/nfs/dbraw/zinc/86/48/34/527864834.db2.gz	BTFNDGKBLSHBSK-PSASIEDQSA-N	-1	0	264.281	2.219	10	5		CEBERM
Cc1ccc(Br)c([N+](=O)[O-])c1C(=O)[O-]	ZINC000307033442	344719521	/nfs/dbraw/zinc/71/95/21/344719521.db2.gz	SYALJYXPSDISHZ-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(Cl)c(Cl)cc1[N+](=O)[O-]	ZINC000396121547	344845627	/nfs/dbraw/zinc/84/56/27/344845627.db2.gz	VLAYDXUDYRGCRA-ZETCQYMHSA-N	-1	0	266.036	2.020	10	5		CEBERM
CS(=O)(=O)Nc1ccc2c(c1)[nH]c1ccccc1c2=O	ZINC000584605528	344963668	/nfs/dbraw/zinc/96/36/68/344963668.db2.gz	WSRSHNPRIGFZSX-UHFFFAOYSA-N	-1	0	288.328	2.053	10	5		CEBERM
O=c1c2cccc([N+](=O)[O-])c2[n-]c2c1cccc2[N+](=O)[O-]	ZINC000584634430	344970362	/nfs/dbraw/zinc/97/03/62/344970362.db2.gz	FOVQONKYUGDIQQ-UHFFFAOYSA-N	-1	0	285.215	2.498	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H]1Nc1cccc([N+](=O)[O-])c1	ZINC000085328847	179019925	/nfs/dbraw/zinc/01/99/25/179019925.db2.gz	MZRDYSKWAMRDMZ-WDEREUQCSA-N	-1	0	250.254	2.260	10	5		CEBERM
Cc1ccc(NC(=O)[C@H]2[C@@H](C(=O)[O-])C2(C)C)cc1[N+](=O)[O-]	ZINC000085406967	179054942	/nfs/dbraw/zinc/05/49/42/179054942.db2.gz	IASPRRKWUAIQTF-MNOVXSKESA-N	-1	0	292.291	2.199	10	5		CEBERM
O=C([O-])c1cc(N2CCCC[C@@H]2CCO)ccc1[N+](=O)[O-]	ZINC000019845263	136578934	/nfs/dbraw/zinc/57/89/34/136578934.db2.gz	ZIIMFUZLOBUIHP-SNVBAGLBSA-N	-1	0	294.307	2.034	10	5		CEBERM
O=C([O-])C1=Cc2cc([N+](=O)[O-])ccc2O[C@@H]1C(F)(F)F	ZINC000090685511	180023428	/nfs/dbraw/zinc/02/34/28/180023428.db2.gz	GZVGBJIOQBOCCF-VIFPVBQESA-N	-1	0	289.165	2.386	10	5		CEBERM
C[C@H](CCO)Sc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000091261707	180115888	/nfs/dbraw/zinc/11/58/88/180115888.db2.gz	DFZNAVZWUUVRJA-SSDOTTSWSA-N	-1	0	271.294	2.156	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CC[C@@H](C(=O)[O-])C1	ZINC000091555939	180190491	/nfs/dbraw/zinc/19/04/91/180190491.db2.gz	MNUQLUSXQXYTIO-ZJUUUORDSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCC[C@@](C)(Nc1c([N+](=O)[O-])c(C)nn1CC)C(=O)[O-]	ZINC000091558006	180191016	/nfs/dbraw/zinc/19/10/16/180191016.db2.gz	GIQUFRULYSEABO-GFCCVEGCSA-N	-1	0	284.316	2.175	10	5		CEBERM
COc1ccc(Cn2ccc(C(=O)[O-])c2)cc1[N+](=O)[O-]	ZINC000091840152	180267899	/nfs/dbraw/zinc/26/78/99/180267899.db2.gz	GBPHVQBQMHHNLF-UHFFFAOYSA-N	-1	0	276.248	2.151	10	5		CEBERM
CCCC[C@@H](Nc1cc(C)c([N+](=O)[O-])cn1)C(=O)[O-]	ZINC000092026345	180308693	/nfs/dbraw/zinc/30/86/93/180308693.db2.gz	ODEDCJLLRWBXQM-SECBINFHSA-N	-1	0	267.285	2.354	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N[C@H]1C=C[C@H](C(=O)[O-])C1	ZINC000092182707	180339632	/nfs/dbraw/zinc/33/96/32/180339632.db2.gz	YIUNPALMFNDIHH-UWVGGRQHSA-N	-1	0	262.265	2.344	10	5		CEBERM
O=C([O-])CN(CC(F)(F)F)c1cccc(F)c1[N+](=O)[O-]	ZINC000092436855	180384951	/nfs/dbraw/zinc/38/49/51/180384951.db2.gz	UURIAGYARUMCLX-UHFFFAOYSA-N	-1	0	296.176	2.187	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])c1cccc([N+](=O)[O-])c1	ZINC000092448856	180386930	/nfs/dbraw/zinc/38/69/30/180386930.db2.gz	JLLPLEHPTRWVMS-UHFFFAOYSA-N	-1	0	252.270	2.284	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000092448643	180387019	/nfs/dbraw/zinc/38/70/19/180387019.db2.gz	MZEFSFOMSJPEOB-UHFFFAOYSA-N	-1	0	297.267	2.193	10	5		CEBERM
O=C([O-])c1cn(-c2cc(Cl)ccc2[N+](=O)[O-])cn1	ZINC000110401686	186295171	/nfs/dbraw/zinc/29/51/71/186295171.db2.gz	OCHUBQPDVVBSIA-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
C[C@H](Nc1ccc([N+](=O)[O-])cc1C(F)F)c1nnn[n-]1	ZINC000111290774	186390788	/nfs/dbraw/zinc/39/07/88/186390788.db2.gz	HCDWDCZYDQQJNF-YFKPBYRVSA-N	-1	0	284.226	2.219	10	5		CEBERM
Cc1cc(C(F)(F)F)cc([N+](=O)[O-])c1[C@H](O)C(=O)[O-]	ZINC000575673800	366325049	/nfs/dbraw/zinc/32/50/49/366325049.db2.gz	NTOFXYXILUZNGF-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCOc1c(OC(F)F)ccc([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575657895	366317435	/nfs/dbraw/zinc/31/74/35/366317435.db2.gz	MYHHBPCMXDYCSD-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
O=C([O-])c1c(F)ccc(OC(F)F)c1[N+](=O)[O-]	ZINC000575661725	366321354	/nfs/dbraw/zinc/32/13/54/366321354.db2.gz	VVJMHPZZUSWSKB-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])c(OC(F)(F)F)cc1F	ZINC000575711396	366340020	/nfs/dbraw/zinc/34/00/20/366340020.db2.gz	SLGQDUMLYGKFDG-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
CC(=O)c1c(Br)ccc([N+](=O)[O-])c1[O-]	ZINC000575690831	366330431	/nfs/dbraw/zinc/33/04/31/366330431.db2.gz	CNVSTVDSYBNCGI-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
C[C@@H](C(=O)c1csc([N+](=O)[O-])c1)[C@H](C)C(=O)[O-]	ZINC000093041112	184644784	/nfs/dbraw/zinc/64/47/84/184644784.db2.gz	FTVQPWPIMAHKOH-RITPCOANSA-N	-1	0	257.267	2.196	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1OCC(C)(C)C(=O)[O-]	ZINC000093703362	184707766	/nfs/dbraw/zinc/70/77/66/184707766.db2.gz	GAPHHCWDKHSEOV-UHFFFAOYSA-N	-1	0	269.253	2.093	10	5		CEBERM
O=C([O-])Cc1ccc(OC(F)(F)F)c([N+](=O)[O-])c1	ZINC000575338341	395659830	/nfs/dbraw/zinc/65/98/30/395659830.db2.gz	BQCAGLNJEDGEDF-UHFFFAOYSA-N	-1	0	265.143	2.121	10	5		CEBERM
C[C@H]1OCCC[C@@H]1C(=O)Nc1ccc([O-])c([N+](=O)[O-])c1	ZINC000191275134	153165715	/nfs/dbraw/zinc/16/57/15/153165715.db2.gz	CRULMSXPKHHXSJ-SCZZXKLOSA-N	-1	0	280.280	2.054	10	5		CEBERM
C/C=C/C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1C)C(=O)[O-]	ZINC000263231768	154039530	/nfs/dbraw/zinc/03/95/30/154039530.db2.gz	BSMKKWJKGYIYAJ-PCAWENJQSA-N	-1	0	292.291	2.052	10	5		CEBERM
CCCN(CC(=O)[O-])c1cc(OC)cc(F)c1[N+](=O)[O-]	ZINC000263428238	154085097	/nfs/dbraw/zinc/08/50/97/154085097.db2.gz	RWNBKVDUUOIKPC-UHFFFAOYSA-N	-1	0	286.259	2.044	10	5		CEBERM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000006336826	170193829	/nfs/dbraw/zinc/19/38/29/170193829.db2.gz	GBKMCOBNNVQTKB-NXEZZACHSA-N	-1	0	290.275	2.200	10	5		CEBERM
O=C1[N-]C(=O)/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)N1	ZINC000006526878	170210561	/nfs/dbraw/zinc/21/05/61/170210561.db2.gz	GLIRFDYXFLTJEG-XFFZJAGNSA-N	-1	0	299.242	2.035	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1Oc1ncccc1C(=O)[O-]	ZINC000013091671	170530939	/nfs/dbraw/zinc/53/09/39/170530939.db2.gz	HPCOGLCKKJCRRJ-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
O=C([O-])c1ccn(-c2ccc([N+](=O)[O-])cc2Cl)n1	ZINC000020353657	171156787	/nfs/dbraw/zinc/15/67/87/171156787.db2.gz	YTWFYJSOHWGZMJ-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
O=C([O-])CCC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000037330612	173131942	/nfs/dbraw/zinc/13/19/42/173131942.db2.gz	WSCORHRDUWULRB-UHFFFAOYSA-N	-1	0	262.221	2.124	10	5		CEBERM
O=C([O-])c1cnn(-c2ccc3cc([N+](=O)[O-])ccc3n2)c1	ZINC000043299411	175000077	/nfs/dbraw/zinc/00/00/77/175000077.db2.gz	AJZPYUPWJRCDKO-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
COCc1c(C)nc2ccc([N+](=O)[O-])cc2c1C(=O)[O-]	ZINC000045018180	175291593	/nfs/dbraw/zinc/29/15/93/175291593.db2.gz	WCNFJXLCRRKONW-UHFFFAOYSA-N	-1	0	276.248	2.296	10	5		CEBERM
Cc1ccc(OCCCCCC(=O)[O-])c([N+](=O)[O-])n1	ZINC000071285942	176109692	/nfs/dbraw/zinc/10/96/92/176109692.db2.gz	GXWKTYULUHFCGZ-UHFFFAOYSA-N	-1	0	268.269	2.322	10	5		CEBERM
CC[C@@H](COC)Nc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000079768734	177553104	/nfs/dbraw/zinc/55/31/04/177553104.db2.gz	OLMCXEOXNOMECN-JTQLQIEISA-N	-1	0	282.296	2.438	10	5		CEBERM
CCOc1cc(-n2cc(C(=O)[O-])c(C)n2)ccc1[N+](=O)[O-]	ZINC000080046454	177602043	/nfs/dbraw/zinc/60/20/43/177602043.db2.gz	SMKLDYATYDAXHK-UHFFFAOYSA-N	-1	0	291.263	2.186	10	5		CEBERM
CC(C)[C@@H](Nc1cccc(F)c1[N+](=O)[O-])C(=O)[O-]	ZINC000043441533	279914759	/nfs/dbraw/zinc/91/47/59/279914759.db2.gz	GFPDEUNDRKRMAX-SECBINFHSA-N	-1	0	256.233	2.255	10	5		CEBERM
Cc1cc(=O)[n-]n1-c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000021988834	301377006	/nfs/dbraw/zinc/37/70/06/301377006.db2.gz	PDWYKDKEIUYUJP-UHFFFAOYSA-N	-1	0	253.645	2.448	10	5		CEBERM
O=[N+]([O-])c1ccc([O-])c(F)c1I	ZINC000299888980	304803748	/nfs/dbraw/zinc/80/37/48/304803748.db2.gz	BLHNIOIQWZZBTL-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
O=C([O-])c1nc(C2CCC2)n(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000536958269	330383758	/nfs/dbraw/zinc/38/37/58/330383758.db2.gz	IEGQICVAQPJNTA-UHFFFAOYSA-N	-1	0	288.263	2.141	10	5		CEBERM
CCCN(CC(=O)[O-])c1cc([N+](=O)[O-])ccc1C	ZINC000053734298	521562528	/nfs/dbraw/zinc/56/25/28/521562528.db2.gz	SVXFVFFESVLMEP-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
CCO[C@H](CCOc1cc(C)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000062763660	520513255	/nfs/dbraw/zinc/51/32/55/520513255.db2.gz	KQXNNEHMSQAQLT-LLVKDONJSA-N	-1	0	283.280	2.162	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000061217499	521246987	/nfs/dbraw/zinc/24/69/87/521246987.db2.gz	HODLXEQLBCDPHD-QMMMGPOBSA-N	-1	0	297.267	2.050	10	5		CEBERM
CCn1cc(COc2ccc(C(=O)[O-])cc2[N+](=O)[O-])cn1	ZINC000050539993	523391670	/nfs/dbraw/zinc/39/16/70/523391670.db2.gz	ONWSYGBLHXXCCB-UHFFFAOYSA-N	-1	0	291.263	2.088	10	5		CEBERM
Cc1cc(C(=O)[O-])nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000054832762	524194207	/nfs/dbraw/zinc/19/42/07/524194207.db2.gz	VDIQLOTWZDNOBF-UHFFFAOYSA-N	-1	0	259.221	2.058	10	5		CEBERM
Cc1cc(C(=O)[O-])nc(-c2cc([N+](=O)[O-])ccc2C)n1	ZINC000054832809	524194581	/nfs/dbraw/zinc/19/45/81/524194581.db2.gz	CFLQIXXJVHJURM-UHFFFAOYSA-N	-1	0	273.248	2.367	10	5		CEBERM
Cc1ccc(Cn2cc([N+](=O)[O-])cc2C(=O)[O-])o1	ZINC000069287794	524772728	/nfs/dbraw/zinc/77/27/28/524772728.db2.gz	DBVKUXUHJULCCK-UHFFFAOYSA-N	-1	0	250.210	2.044	10	5		CEBERM
Cc1ccc(N(CC(=O)[O-])CC2CC2)cc1[N+](=O)[O-]	ZINC000061700564	524895642	/nfs/dbraw/zinc/89/56/42/524895642.db2.gz	HTASTGAEEGCMFJ-UHFFFAOYSA-N	-1	0	264.281	2.204	10	5		CEBERM
C[C@@H]1CN(c2cc(C(=O)[O-])c([N+](=O)[O-])cc2F)C[C@H](C)O1	ZINC000050019588	525060913	/nfs/dbraw/zinc/06/09/13/525060913.db2.gz	CBNXKQFPARKXAI-OCAPTIKFSA-N	-1	0	298.270	2.046	10	5		CEBERM
Cc1ccc(N[C@@H](C(=O)[O-])C2CC2)c([N+](=O)[O-])c1	ZINC000054522065	525307704	/nfs/dbraw/zinc/30/77/04/525307704.db2.gz	RBOYCTUXUBEFET-LLVKDONJSA-N	-1	0	250.254	2.178	10	5		CEBERM
Cc1c(N[C@@H]2C[C@@H]2C)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000052293921	525874196	/nfs/dbraw/zinc/87/41/96/525874196.db2.gz	FRTMIZGSBBSJSL-IMTBSYHQSA-N	-1	0	250.254	2.422	10	5		CEBERM
O=C([O-])C[C@@H]1CCCN(c2cccc([N+](=O)[O-])c2)C1	ZINC000054297742	527628373	/nfs/dbraw/zinc/62/83/73/527628373.db2.gz	ROJWBDPGJCTKSP-JTQLQIEISA-N	-1	0	264.281	2.286	10	5		CEBERM
O=C([O-])[C@@H](Nc1c(F)c(F)ccc1[N+](=O)[O-])C1CC1	ZINC000054505924	527655736	/nfs/dbraw/zinc/65/57/36/527655736.db2.gz	FEGUQDWPPBZGMJ-VIFPVBQESA-N	-1	0	272.207	2.148	10	5		CEBERM
CC(C)(CC(=O)[O-])Nc1cccc(F)c1[N+](=O)[O-]	ZINC000084148025	178803755	/nfs/dbraw/zinc/80/37/55/178803755.db2.gz	QBQTWOOHTWGGOG-UHFFFAOYSA-N	-1	0	256.233	2.399	10	5		CEBERM
CC(C)(CC(=O)[O-])Nc1ccc([N+](=O)[O-])cc1F	ZINC000084147993	178804185	/nfs/dbraw/zinc/80/41/85/178804185.db2.gz	GFTCJLKQGRTPDA-UHFFFAOYSA-N	-1	0	256.233	2.399	10	5		CEBERM
COc1cc(N[C@@H]2CC[C@@H](C(=O)[O-])C2)c([N+](=O)[O-])cc1F	ZINC000097065103	185520262	/nfs/dbraw/zinc/52/02/62/185520262.db2.gz	AWHQIJOPOINXBO-HTQZYQBOSA-N	-1	0	298.270	2.408	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@H]1Nc1cccc(F)c1[N+](=O)[O-]	ZINC000085329092	179019680	/nfs/dbraw/zinc/01/96/80/179019680.db2.gz	HHYSFSBUUXAOHC-VXNVDRBHSA-N	-1	0	268.244	2.399	10	5		CEBERM
Cc1ccnc(NC[C@H]2CCC[C@@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000089429842	179786520	/nfs/dbraw/zinc/78/65/20/179786520.db2.gz	SNUUAOLUBNMSQO-ZJUUUORDSA-N	-1	0	279.296	2.211	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cn1C[C@H]1Cc2ccccc21	ZINC000090977809	180079099	/nfs/dbraw/zinc/07/90/99/180079099.db2.gz	LGULKTUTLCCOGT-SNVBAGLBSA-N	-1	0	272.260	2.434	10	5		CEBERM
CC(C)c1nn(C)c(NC[C@H](C(=O)[O-])C(C)C)c1[N+](=O)[O-]	ZINC000091576844	180197769	/nfs/dbraw/zinc/19/77/69/180197769.db2.gz	MLFBEFZDQGDKSG-VIFPVBQESA-N	-1	0	298.343	2.220	10	5		CEBERM
Cn1cnc([N+](=O)[O-])c1Sc1csc(C(=O)[O-])c1	ZINC000091948042	180290681	/nfs/dbraw/zinc/29/06/81/180290681.db2.gz	PKJNRFGPCZVPNX-UHFFFAOYSA-N	-1	0	285.306	2.239	10	5		CEBERM
COc1cc(N[C@@H]2C=C[C@@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092183405	180339443	/nfs/dbraw/zinc/33/94/43/180339443.db2.gz	LDKCZDKWPYVTKH-RKDXNWHRSA-N	-1	0	278.264	2.045	10	5		CEBERM
Cc1c(N[C@H]2C=C[C@@H](C(=O)[O-])C2)cccc1[N+](=O)[O-]	ZINC000092183077	180339469	/nfs/dbraw/zinc/33/94/69/180339469.db2.gz	DICIMPINTCCGSG-ZJUUUORDSA-N	-1	0	262.265	2.344	10	5		CEBERM
O=C([O-])c1cn(-c2ccc([N+](=O)[O-])c3ncccc23)cn1	ZINC000109476400	186254617	/nfs/dbraw/zinc/25/46/17/186254617.db2.gz	ATYGFVPIQLIGPU-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
Cc1c(=O)n(-c2ccccc2[N+](=O)[O-])[n-]c1C(F)(F)F	ZINC000111308799	186394550	/nfs/dbraw/zinc/39/45/50/186394550.db2.gz	CKKUHLXTXRBVSB-LURJTMIESA-N	-1	0	287.197	2.496	10	5		CEBERM
Cc1cc(OC(F)F)c(CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000575669092	366323309	/nfs/dbraw/zinc/32/33/09/366323309.db2.gz	YHXPXQFEQAENKG-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
COc1c(C(F)(F)F)ccc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575673624	366323341	/nfs/dbraw/zinc/32/33/41/366323341.db2.gz	LIJGCYIXYUSCHJ-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
Cc1cc(CC(=O)[O-])c([N+](=O)[O-])c(OC(F)F)c1	ZINC000575668213	366323348	/nfs/dbraw/zinc/32/33/48/366323348.db2.gz	SFOILCIMMNLZCT-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
Cc1cc([C@@H](O)C(=O)[O-])cc([N+](=O)[O-])c1C(F)(F)F	ZINC000575675777	366325114	/nfs/dbraw/zinc/32/51/14/366325114.db2.gz	YILNYWXLEBWIPL-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCOc1cc(OC(F)F)c([N+](=O)[O-])cc1C(=O)[O-]	ZINC000575658877	366318873	/nfs/dbraw/zinc/31/88/73/366318873.db2.gz	SWEZTRJWAKOZPK-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCc1cc(CC(=O)[O-])c([N+](=O)[O-])c(OC(F)F)c1	ZINC000575659497	366319055	/nfs/dbraw/zinc/31/90/55/366319055.db2.gz	HQKDUGFSUCQPHE-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CCc1cc(OC(F)F)c(CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000575660137	366319747	/nfs/dbraw/zinc/31/97/47/366319747.db2.gz	NGSXSKTYZINUHZ-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
COc1cc([S-])c([N+](=O)[O-])c(OC(F)F)c1	ZINC000575664492	366322420	/nfs/dbraw/zinc/32/24/20/366322420.db2.gz	GUMLYAOTZCLPGV-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
CCCC[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000159427092	366912361	/nfs/dbraw/zinc/91/23/61/366912361.db2.gz	KYMMFSOTYXJTPY-JTQLQIEISA-N	-1	0	298.270	2.107	10	5		CEBERM
O=C([O-])c1cc(-c2cccc([N+](=O)[O-])c2)c[nH]c1=O	ZINC000059750773	304219475	/nfs/dbraw/zinc/21/94/75/304219475.db2.gz	ZCQBMPYKKVZNSX-UHFFFAOYSA-N	-1	0	260.205	2.061	10	5		CEBERM
CCC1(C(=O)[O-])CCN(c2ncc(C)cc2[N+](=O)[O-])CC1	ZINC000090691734	135064194	/nfs/dbraw/zinc/06/41/94/135064194.db2.gz	GFDUFZOAIKICBK-UHFFFAOYSA-N	-1	0	293.323	2.379	10	5		CEBERM
Cc1ccc(N2CCSC[C@H]2CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000091130493	135067265	/nfs/dbraw/zinc/06/72/65/135067265.db2.gz	SQBBUOGIHMPRBN-SNVBAGLBSA-N	-1	0	296.348	2.300	10	5		CEBERM
CCCC[C@@H](Nc1ncc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000263548984	154123049	/nfs/dbraw/zinc/12/30/49/154123049.db2.gz	JGNUCEJDUAHBQV-SECBINFHSA-N	-1	0	271.248	2.184	10	5		CEBERM
O=C([O-])c1ccn(-c2ccc(Cl)cc2[N+](=O)[O-])n1	ZINC000020353686	171157122	/nfs/dbraw/zinc/15/71/22/171157122.db2.gz	ROQJYLJIPQLXOG-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
O=C([O-])c1cc2ccccc2c(-n2ccc([N+](=O)[O-])n2)n1	ZINC000040517170	174307617	/nfs/dbraw/zinc/30/76/17/174307617.db2.gz	SXKVLQJQKMIJMA-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
Cc1cc([N-]c2ncnc(N3CCCC3)c2[N+](=O)[O-])no1	ZINC000040582049	174345219	/nfs/dbraw/zinc/34/52/19/174345219.db2.gz	PWRXUQBEEFYVPO-UHFFFAOYSA-N	-1	0	290.283	2.025	10	5		CEBERM
CCNc1ncnc([N-]c2cc(C)ccn2)c1[N+](=O)[O-]	ZINC000040588163	174346017	/nfs/dbraw/zinc/34/60/17/174346017.db2.gz	VJIHOCQKRSJKEQ-UHFFFAOYSA-N	-1	0	274.284	2.264	10	5		CEBERM
O=[N+]([O-])c1c([N-]c2ccccn2)ncnc1N1CCCC1	ZINC000040609052	174353720	/nfs/dbraw/zinc/35/37/20/174353720.db2.gz	JJGNAQWEWFRANK-UHFFFAOYSA-N	-1	0	286.295	2.124	10	5		CEBERM
O=C([O-])C1(Nc2cccc([N+](=O)[O-])c2)CCCC1	ZINC000041032905	174456046	/nfs/dbraw/zinc/45/60/46/174456046.db2.gz	NKCVVCWVAWVLMF-UHFFFAOYSA-N	-1	0	250.254	2.404	10	5		CEBERM
O=C([O-])C1(Nc2nc3sccn3c2[N+](=O)[O-])CCCC1	ZINC000041032906	174456233	/nfs/dbraw/zinc/45/62/33/174456233.db2.gz	WTVCRIHFFPNZKP-UHFFFAOYSA-N	-1	0	296.308	2.113	10	5		CEBERM
Cc1ccc(Oc2ccc(C(=O)[O-])nn2)c([N+](=O)[O-])c1	ZINC000041078621	174472530	/nfs/dbraw/zinc/47/25/30/174472530.db2.gz	CZJVHCLWXVGZAV-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
Cc1nc(-c2ccccc2[N+](=O)[O-])ncc1C(=O)[O-]	ZINC000044732107	175240991	/nfs/dbraw/zinc/24/09/91/175240991.db2.gz	OPPSBUBIHVZLPN-UHFFFAOYSA-N	-1	0	259.221	2.058	10	5		CEBERM
Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)c1C(=O)[O-]	ZINC000071164058	176046917	/nfs/dbraw/zinc/04/69/17/176046917.db2.gz	XTWHEQVVDLQYQP-UHFFFAOYSA-N	-1	0	289.247	2.182	10	5		CEBERM
O=C([O-])c1cnc(Oc2cc(F)c([N+](=O)[O-])cc2F)cn1	ZINC000071182486	176057686	/nfs/dbraw/zinc/05/76/86/176057686.db2.gz	QBOLPOSMYFZRLE-UHFFFAOYSA-N	-1	0	297.173	2.154	10	5		CEBERM
Cc1ccnc(N[C@@H]2[C@@H]3CC[C@@H](C3)[C@@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000079561924	177520824	/nfs/dbraw/zinc/52/08/24/177520824.db2.gz	XPGMHYUJAQRUID-ZRUFSTJUSA-N	-1	0	291.307	2.209	10	5		CEBERM
CCN(C(=O)c1c(C)cccc1[N+](=O)[O-])[C@H](C)CC(=O)[O-]	ZINC000061177874	520056470	/nfs/dbraw/zinc/05/64/70/520056470.db2.gz	IXPNOBVOROVGNX-SNVBAGLBSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(C(=O)c1cc([N+](=O)[O-])ccc1F)[C@H](C)CC(=O)[O-]	ZINC000061180819	520072772	/nfs/dbraw/zinc/07/27/72/520072772.db2.gz	RQDWMDXAYZIQHW-MRVPVSSYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCC[C@@](C)(NC(=O)c1ccc([N+](=O)[O-])c(F)c1)C(=O)[O-]	ZINC000054415454	520925222	/nfs/dbraw/zinc/92/52/22/520925222.db2.gz	SEMHFOJDEUQOSL-CYBMUJFWSA-N	-1	0	298.270	2.107	10	5		CEBERM
CC[C@H](C(=O)[O-])N(C)c1ccc(C)c([N+](=O)[O-])c1	ZINC000061700613	523808892	/nfs/dbraw/zinc/80/88/92/523808892.db2.gz	DSJSNTBYIVUKCS-SNVBAGLBSA-N	-1	0	252.270	2.203	10	5		CEBERM
C[C@H](CCC(=O)[O-])Oc1ccc([N+](=O)[O-])c(F)c1	ZINC000050955541	524121178	/nfs/dbraw/zinc/12/11/78/524121178.db2.gz	JSSCODKIBPLUSS-SSDOTTSWSA-N	-1	0	257.217	2.366	10	5		CEBERM
Cc1ccc(NC(=O)N(C)C(C)(C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000061173135	525108866	/nfs/dbraw/zinc/10/88/66/525108866.db2.gz	GIPYKAUMEPSBNX-UHFFFAOYSA-N	-1	0	295.295	2.230	10	5		CEBERM
C[C@](Nc1ccncc1[N+](=O)[O-])(C(=O)[O-])c1ccccc1	ZINC000052879990	525156558	/nfs/dbraw/zinc/15/65/58/525156558.db2.gz	GJNPREFJQSHNOG-CQSZACIVSA-N	-1	0	287.275	2.402	10	5		CEBERM
Cc1c(N[C@H](C(=O)[O-])C2CC2)cccc1[N+](=O)[O-]	ZINC000062723580	525874801	/nfs/dbraw/zinc/87/48/01/525874801.db2.gz	XKDMVCNUJBDKLY-NSHDSACASA-N	-1	0	250.254	2.178	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc2cc([N+](=O)[O-])ccc2n1)C1CC1	ZINC000054521899	526315719	/nfs/dbraw/zinc/31/57/19/526315719.db2.gz	YOXRRLIBVUSAAR-CYBMUJFWSA-N	-1	0	287.275	2.418	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1N1CCC[C@@H]1CCCO	ZINC000052763841	526355437	/nfs/dbraw/zinc/35/54/37/526355437.db2.gz	IDVTUERXEAQOQI-SNVBAGLBSA-N	-1	0	294.307	2.034	10	5		CEBERM
O=C([O-])c1ncccc1COc1ccc(F)cc1[N+](=O)[O-]	ZINC000062763336	526408008	/nfs/dbraw/zinc/40/80/08/526408008.db2.gz	JICZIRUQLYLRJZ-UHFFFAOYSA-N	-1	0	292.222	2.406	10	5		CEBERM
O=C([O-])CC[C@H]1CCCCN1c1cc([N+](=O)[O-])ccn1	ZINC000050923682	527599614	/nfs/dbraw/zinc/59/96/14/527599614.db2.gz	IXAGQHLIBDWRCS-SNVBAGLBSA-N	-1	0	279.296	2.214	10	5		CEBERM
O=C([O-])c1cc(-c2ccccc2CO)cc([N+](=O)[O-])c1	ZINC000095495066	184998541	/nfs/dbraw/zinc/99/85/41/184998541.db2.gz	JLXBAFNQILFOIV-UHFFFAOYSA-N	-1	0	273.244	2.452	10	5		CEBERM
O=C([O-])c1ccc([S@](=O)Cc2cccc([N+](=O)[O-])c2)o1	ZINC000083388054	178394633	/nfs/dbraw/zinc/39/46/33/178394633.db2.gz	BBHZOQCUXFEFRC-FQEVSTJZSA-N	-1	0	295.272	2.194	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(CC(=O)[O-])c1Br	ZINC000396138774	344845912	/nfs/dbraw/zinc/84/59/12/344845912.db2.gz	SEFNNQSOPGJIKW-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
Cc1ccc(NC(=O)NC(C)(C)CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000084154847	178805340	/nfs/dbraw/zinc/80/53/40/178805340.db2.gz	NKQUSIZHDHZGNH-UHFFFAOYSA-N	-1	0	295.295	2.278	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1F	ZINC000085329549	179019769	/nfs/dbraw/zinc/01/97/69/179019769.db2.gz	NSVIQKJECBVHJZ-PSASIEDQSA-N	-1	0	268.244	2.399	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@H]1Nc1ccncc1[N+](=O)[O-]	ZINC000085330314	179020182	/nfs/dbraw/zinc/02/01/82/179020182.db2.gz	BUEJAQBQQOEJDI-RKDXNWHRSA-N	-1	0	265.269	2.045	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@@H]1Nc1ncccc1[N+](=O)[O-]	ZINC000085330299	179020406	/nfs/dbraw/zinc/02/04/06/179020406.db2.gz	YFXBALKIJJTQON-IUCAKERBSA-N	-1	0	265.269	2.045	10	5		CEBERM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000085407995	179055307	/nfs/dbraw/zinc/05/53/07/179055307.db2.gz	UFADSKTZLYPSQN-UWVGGRQHSA-N	-1	0	296.254	2.029	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1[C@H](C(=O)[O-])C1(C)C	ZINC000085411059	179057023	/nfs/dbraw/zinc/05/70/23/179057023.db2.gz	ZHSBZEZLVPHJHU-GHMZBOCLSA-N	-1	0	292.291	2.199	10	5		CEBERM
C[C@@H](CC(=O)[O-])Sc1ccc([N+](=O)[O-])c2nonc21	ZINC000090098881	179914357	/nfs/dbraw/zinc/91/43/57/179914357.db2.gz	MBGINENORHWQAN-YFKPBYRVSA-N	-1	0	283.265	2.086	10	5		CEBERM
Nc1c(C(=O)[O-])cc(Cl)c(Br)c1[N+](=O)[O-]	ZINC000669382848	539765290	/nfs/dbraw/zinc/76/52/90/539765290.db2.gz	FHBNXVLMTBDTAC-UHFFFAOYSA-N	-1	0	295.476	2.291	10	5		CEBERM
CCc1nn(C)c(Oc2csc(C(=O)[O-])c2)c1[N+](=O)[O-]	ZINC000091352427	180138211	/nfs/dbraw/zinc/13/82/11/180138211.db2.gz	JWSYLEJEPLFVQG-UHFFFAOYSA-N	-1	0	297.292	2.443	10	5		CEBERM
O=C([O-])c1cncc(Sc2ccccc2[N+](=O)[O-])n1	ZINC000091433419	180154265	/nfs/dbraw/zinc/15/42/65/180154265.db2.gz	ZEPOBIMQSBOOMW-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
CCC[C@@H](Nc1c([N+](=O)[O-])c(C(C)C)nn1C)C(=O)[O-]	ZINC000091576842	180197718	/nfs/dbraw/zinc/19/77/18/180197718.db2.gz	FJSSHHJUHAPOAJ-MRVPVSSYSA-N	-1	0	284.316	2.117	10	5		CEBERM
CC(C)C[C@H](Nc1c([N+](=O)[O-])c(C(C)C)nn1C)C(=O)[O-]	ZINC000091579767	180198488	/nfs/dbraw/zinc/19/84/88/180198488.db2.gz	UNXJSMBCAHFCCP-VIFPVBQESA-N	-1	0	298.343	2.363	10	5		CEBERM
CC(C)c1nn(C)c(SC[C@@H](C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091578794	180198520	/nfs/dbraw/zinc/19/85/20/180198520.db2.gz	KXINRGHNVNTRNA-SSDOTTSWSA-N	-1	0	287.341	2.265	10	5		CEBERM
CCC[C@@](C)(Nc1cc(C)c([N+](=O)[O-])cn1)C(=O)[O-]	ZINC000092026351	180308681	/nfs/dbraw/zinc/30/86/81/180308681.db2.gz	DYQRTIKNMARGGT-GFCCVEGCSA-N	-1	0	267.285	2.354	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N[C@@H]1C=C[C@@H](C(=O)[O-])C1	ZINC000092182990	180339560	/nfs/dbraw/zinc/33/95/60/180339560.db2.gz	AEPWRXRUMAQISZ-NXEZZACHSA-N	-1	0	262.265	2.344	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@@H](Nc2ccc([N+](=O)[O-])cc2F)C1	ZINC000092182874	180339593	/nfs/dbraw/zinc/33/95/93/180339593.db2.gz	SQEKGFOQJLYGOC-HTQZYQBOSA-N	-1	0	266.228	2.175	10	5		CEBERM
O=C([O-])c1nccnc1Oc1cc(F)c([N+](=O)[O-])cc1F	ZINC000110624739	186307003	/nfs/dbraw/zinc/30/70/03/186307003.db2.gz	ARXMPXZDTBYHHY-UHFFFAOYSA-N	-1	0	297.173	2.154	10	5		CEBERM
CC(C)[C@@H](Oc1cc(F)c([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000110622854	186307043	/nfs/dbraw/zinc/30/70/43/186307043.db2.gz	YCSQFIVLKWSOAM-SNVBAGLBSA-N	-1	0	275.207	2.361	10	5		CEBERM
CCOCCN(CC)c1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000112173127	186472282	/nfs/dbraw/zinc/47/22/82/186472282.db2.gz	WVZLBOBDTNJHQR-UHFFFAOYSA-N	-1	0	282.296	2.156	10	5		CEBERM
O=[N+]([O-])c1cc([S@@](=O)[O-])c(Br)cc1F	ZINC000125990176	540125376	/nfs/dbraw/zinc/12/53/76/540125376.db2.gz	JTBIDZACZGMDSJ-UHFFFAOYSA-N	-1	0	284.062	2.077	10	5		CEBERM
COc1cc(C(=O)[O-])c([N+](=O)[O-])cc1C(F)(F)F	ZINC000575679216	366326389	/nfs/dbraw/zinc/32/63/89/366326389.db2.gz	OZUSSFGOMXZREC-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
O=C([O-])Cc1ccc([N+](=O)[O-])c(OC(F)(F)F)c1F	ZINC000575711445	366339917	/nfs/dbraw/zinc/33/99/17/366339917.db2.gz	URHRRWMXNKURIV-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
O=C([O-])CNc1cc(Cl)c(Cl)cc1[N+](=O)[O-]	ZINC000005783830	170140107	/nfs/dbraw/zinc/14/01/07/170140107.db2.gz	NYKSQKPORPOPKP-UHFFFAOYSA-N	-1	0	265.052	2.398	10	5		CEBERM
O=C([O-])[C@@H](Oc1cccnc1[N+](=O)[O-])c1ccccc1	ZINC000020483524	171223487	/nfs/dbraw/zinc/22/34/87/171223487.db2.gz	JPUJQJQFMABBKP-NSHDSACASA-N	-1	0	274.232	2.195	10	5		CEBERM
CCCOc1cc([N+](=O)[O-])c(C(=O)[O-])cc1OC	ZINC000037226503	173046297	/nfs/dbraw/zinc/04/62/97/173046297.db2.gz	DWOHOXQIYBJNJS-UHFFFAOYSA-N	-1	0	255.226	2.090	10	5		CEBERM
Cc1ccc(-c2nn(C)cc2C(=O)[O-])cc1[N+](=O)[O-]	ZINC000037311572	173113495	/nfs/dbraw/zinc/11/34/95/173113495.db2.gz	UDWGWBXTYMVZID-UHFFFAOYSA-N	-1	0	261.237	2.002	10	5		CEBERM
Cc1cc([N-]c2ncnc(NC(C)C)c2[N+](=O)[O-])no1	ZINC000040582033	174345362	/nfs/dbraw/zinc/34/53/62/174345362.db2.gz	YJIKNHPZPKJHKG-UHFFFAOYSA-N	-1	0	278.272	2.245	10	5		CEBERM
Cc1c([N+](=O)[O-])cc(C(=O)[O-])cc1-n1cc(Cl)cn1	ZINC000043386522	175031982	/nfs/dbraw/zinc/03/19/82/175031982.db2.gz	XDURHJIQLCCFHI-UHFFFAOYSA-N	-1	0	281.655	2.441	10	5		CEBERM
O=C([O-])c1cnc(Sc2ccccc2[N+](=O)[O-])cn1	ZINC000071182538	176057625	/nfs/dbraw/zinc/05/76/25/176057625.db2.gz	FXHCGENTLYOCHF-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
O=C([O-])c1ccn(-c2ccc([N+](=O)[O-])c3ncccc23)n1	ZINC000080051333	177603127	/nfs/dbraw/zinc/60/31/27/177603127.db2.gz	DHWGAVLMRFSDPH-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
O=C(c1cccc([N+](=O)[O-])c1[O-])N1CC[C@@H]2CCC[C@H]21	ZINC000393452608	262364856	/nfs/dbraw/zinc/36/48/56/262364856.db2.gz	YAOMDULZYSBMLU-GXSJLCMTSA-N	-1	0	276.292	2.315	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(N[C@@H](C(=O)[O-])C(C)C)c1	ZINC000094659045	301856184	/nfs/dbraw/zinc/85/61/84/301856184.db2.gz	LPJIGOQUSAFIOG-LLVKDONJSA-N	-1	0	252.270	2.424	10	5		CEBERM
CCN(C(=O)c1cc([N+](=O)[O-])ccc1F)C(C)(C)C(=O)[O-]	ZINC000061149710	520073044	/nfs/dbraw/zinc/07/30/44/520073044.db2.gz	POQABQLAUMDAKY-UHFFFAOYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCN(c1cc(F)ccc1[N+](=O)[O-])[C@@H](C)CC(=O)[O-]	ZINC000061181855	521479436	/nfs/dbraw/zinc/47/94/36/521479436.db2.gz	HRMJHVPWJNIADF-QMMMGPOBSA-N	-1	0	270.260	2.423	10	5		CEBERM
CC[C@H](C)N(CC(=O)[O-])c1cc(F)ccc1[N+](=O)[O-]	ZINC000052099763	523931386	/nfs/dbraw/zinc/93/13/86/523931386.db2.gz	ZLEGBLDSHQEIIG-QMMMGPOBSA-N	-1	0	270.260	2.423	10	5		CEBERM
C[C@@H](CCC(=O)[O-])n1ncc2ccc([N+](=O)[O-])cc21	ZINC000050956159	524443488	/nfs/dbraw/zinc/44/34/88/524443488.db2.gz	IYZHYKHYLPSCLJ-QMMMGPOBSA-N	-1	0	263.253	2.370	10	5		CEBERM
Cc1ccc(N(CC(=O)[O-])CC(C)C)cc1[N+](=O)[O-]	ZINC000062742608	524895466	/nfs/dbraw/zinc/89/54/66/524895466.db2.gz	MJVKIRUQZAOFAW-UHFFFAOYSA-N	-1	0	266.297	2.450	10	5		CEBERM
Cc1c(N[C@@H]2C[C@H]2C)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000052293926	525874793	/nfs/dbraw/zinc/87/47/93/525874793.db2.gz	FRTMIZGSBBSJSL-HZGVNTEJSA-N	-1	0	250.254	2.422	10	5		CEBERM
Cc1ccc(C(=O)[O-])c(Oc2c([N+](=O)[O-])ncn2C)c1	ZINC000048803495	526234510	/nfs/dbraw/zinc/23/45/10/526234510.db2.gz	KXARGUKPXHTDSG-UHFFFAOYSA-N	-1	0	277.236	2.127	10	5		CEBERM
O=C([O-])[C@H]1CCCCN1c1c(F)c(F)ccc1[N+](=O)[O-]	ZINC000053162340	526319868	/nfs/dbraw/zinc/31/98/68/526319868.db2.gz	VYMQERNDVWIZHO-SECBINFHSA-N	-1	0	286.234	2.317	10	5		CEBERM
O=C([O-])c1coc(C[S@@](=O)c2ccccc2[N+](=O)[O-])c1	ZINC000051330106	526407047	/nfs/dbraw/zinc/40/70/47/526407047.db2.gz	LBVHQSPKNGBMBO-FQEVSTJZSA-N	-1	0	295.272	2.194	10	5		CEBERM
O=C([O-])c1nccnc1Oc1ccc(F)cc1[N+](=O)[O-]	ZINC000054553514	526410473	/nfs/dbraw/zinc/41/04/73/526410473.db2.gz	DOFFAHGTZIUVHZ-UHFFFAOYSA-N	-1	0	279.183	2.014	10	5		CEBERM
CC(C)(C)OC(=O)c1cccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000039320500	361989148	/nfs/dbraw/zinc/98/91/48/361989148.db2.gz	DZJRTKAXEQGLNY-UHFFFAOYSA-N	-1	0	267.237	2.248	10	5		CEBERM
Cc1ccc(C(=O)[O-])c(Br)c1[N+](=O)[O-]	ZINC000138347047	344389906	/nfs/dbraw/zinc/38/99/06/344389906.db2.gz	NAEVYPUNWDHGPF-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1	ZINC000085328637	179019147	/nfs/dbraw/zinc/01/91/47/179019147.db2.gz	CVQZOJKHRFYTHG-WDEREUQCSA-N	-1	0	250.254	2.260	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@H]1Nc1cccc([N+](=O)[O-])c1	ZINC000085328850	179019866	/nfs/dbraw/zinc/01/98/66/179019866.db2.gz	MZRDYSKWAMRDMZ-GHMZBOCLSA-N	-1	0	250.254	2.260	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@@H]1Nc1ccc(F)cc1[N+](=O)[O-]	ZINC000085328777	179019880	/nfs/dbraw/zinc/01/98/80/179019880.db2.gz	IYLZSKMHRCJNLK-IUCAKERBSA-N	-1	0	268.244	2.399	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@H]1Nc1cc([N+](=O)[O-])ccn1	ZINC000085329772	179020380	/nfs/dbraw/zinc/02/03/80/179020380.db2.gz	OWHRNNASXYRDRL-NXEZZACHSA-N	-1	0	265.269	2.045	10	5		CEBERM
Cc1ccc(NC(=O)[C@H]2[C@H](C(=O)[O-])C2(C)C)cc1[N+](=O)[O-]	ZINC000085406963	179054765	/nfs/dbraw/zinc/05/47/65/179054765.db2.gz	IASPRRKWUAIQTF-GHMZBOCLSA-N	-1	0	292.291	2.199	10	5		CEBERM
CCOc1cc(N2CCCC[C@@H]2C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000113323941	136567523	/nfs/dbraw/zinc/56/75/23/136567523.db2.gz	HEQZGUZSNOTVNE-GFCCVEGCSA-N	-1	0	294.307	2.437	10	5		CEBERM
C[C@@H](CSc1ncnc2ccc([N+](=O)[O-])cc21)C(=O)[O-]	ZINC000086111088	179232849	/nfs/dbraw/zinc/23/28/49/179232849.db2.gz	FJNQENRUDOIPCO-ZETCQYMHSA-N	-1	0	293.304	2.351	10	5		CEBERM
O=C([O-])C[C@H]1CCN(c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000089713023	179852153	/nfs/dbraw/zinc/85/21/53/179852153.db2.gz	LOOVDSCHIFHHLG-MRVPVSSYSA-N	-1	0	268.244	2.035	10	5		CEBERM
Cc1cnc(NC[C@H]2CCC[C@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691810	180024856	/nfs/dbraw/zinc/02/48/56/180024856.db2.gz	LTNVPTGHYNBFKP-NXEZZACHSA-N	-1	0	279.296	2.211	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NN1CCCCC1	ZINC000105790688	186070896	/nfs/dbraw/zinc/07/08/96/186070896.db2.gz	WPVITUXTIYOOOK-UHFFFAOYSA-N	-1	0	265.269	2.106	10	5		CEBERM
CCOc1cc(N[C@@H]2C=C[C@@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092182942	180339581	/nfs/dbraw/zinc/33/95/81/180339581.db2.gz	RTQMLHXVXZYJRS-NXEZZACHSA-N	-1	0	292.291	2.435	10	5		CEBERM
Cc1nn(C(C)C)c(N(CC(=O)[O-])C(C)(C)C)c1[N+](=O)[O-]	ZINC000092448835	180387211	/nfs/dbraw/zinc/38/72/11/180387211.db2.gz	CBOGOOCYQRPXSD-UHFFFAOYSA-N	-1	0	298.343	2.370	10	5		CEBERM
CN(C[C@@H]1CCCOC1)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000111164811	186363597	/nfs/dbraw/zinc/36/35/97/186363597.db2.gz	HYTZDMMGUZNJAH-JTQLQIEISA-N	-1	0	294.307	2.156	10	5		CEBERM
O=C([O-])C1=C(c2ccc([N+](=O)[O-])cc2)SCCO1	ZINC000040542025	304035458	/nfs/dbraw/zinc/03/54/58/304035458.db2.gz	GVWQUKLIXMIHRS-UHFFFAOYSA-N	-1	0	267.262	2.111	10	5		CEBERM
Cc1cc([N+](=O)[O-])c([C@H](O)C(=O)[O-])c(C(F)(F)F)c1	ZINC000575675480	366325169	/nfs/dbraw/zinc/32/51/69/366325169.db2.gz	UYYFEFKKXMWJOO-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCc1cc([N+](=O)[O-])c(C(=O)[O-])cc1OC(F)F	ZINC000575659520	366318706	/nfs/dbraw/zinc/31/87/06/366318706.db2.gz	NJBFTQFTIOVGOA-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])Cc1c(OC(F)(F)F)ccc(F)c1[N+](=O)[O-]	ZINC000575710904	366338867	/nfs/dbraw/zinc/33/88/67/366338867.db2.gz	LTRGJPIIHAUQCH-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
O=C([O-])C[C@H]1CCCCN1C(=O)c1ccccc1[N+](=O)[O-]	ZINC000038026163	304082782	/nfs/dbraw/zinc/08/27/82/304082782.db2.gz	QRVNKNNVMDDFPJ-SNVBAGLBSA-N	-1	0	292.291	2.064	10	5		CEBERM
COC[C@H](C)C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000186037138	368910776	/nfs/dbraw/zinc/91/07/76/368910776.db2.gz	ZWKDFJMCACHNCJ-LURJTMIESA-N	-1	0	288.687	2.175	10	5		CEBERM
O=[N+]([O-])c1ccc(Cl)c([S@@](=O)[O-])c1Cl	ZINC000168351548	542223573	/nfs/dbraw/zinc/22/35/73/542223573.db2.gz	ZPTMHPAYWCNZBD-UHFFFAOYSA-N	-1	0	256.066	2.482	10	5		CEBERM
Cc1c(SC2COC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000092711145	184622193	/nfs/dbraw/zinc/62/21/93/184622193.db2.gz	BZTLOPYAHSEYJY-UHFFFAOYSA-N	-1	0	269.278	2.092	10	5		CEBERM
Cc1nc(-c2c(F)ccc([N+](=O)[O-])c2F)[n-]c(=O)c1F	ZINC000094187219	184760914	/nfs/dbraw/zinc/76/09/14/184760914.db2.gz	HLYYEYQAZRUOPY-UHFFFAOYSA-N	-1	0	285.181	2.483	10	5		CEBERM
O=C([O-])c1ccc(OCCc2ccc([N+](=O)[O-])cc2)cn1	ZINC000094213720	184763549	/nfs/dbraw/zinc/76/35/49/184763549.db2.gz	KUWJLJBJUFXHFF-UHFFFAOYSA-N	-1	0	288.259	2.310	10	5		CEBERM
Cc1ccnc(N[C@@](C)(C(=O)[O-])C(F)(F)F)c1[N+](=O)[O-]	ZINC000094222148	184765472	/nfs/dbraw/zinc/76/54/72/184765472.db2.gz	VCYXKDYRFLUJDE-VIFPVBQESA-N	-1	0	293.201	2.116	10	5		CEBERM
CC1CCC(Nc2ccc([N+](=O)[O-])c(N)n2)(C(=O)[O-])CC1	ZINC000094260915	184771160	/nfs/dbraw/zinc/77/11/60/184771160.db2.gz	ZEVUOKGKYOTJMT-UHFFFAOYSA-N	-1	0	294.311	2.017	10	5		CEBERM
O=C([O-])[C@@H]1CCCCC[C@@H]1Nc1ccc([N+](=O)[O-])cn1	ZINC000094745052	184851735	/nfs/dbraw/zinc/85/17/35/184851735.db2.gz	LXBMDBHSMTZMIX-MNOVXSKESA-N	-1	0	279.296	2.435	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N1CCCC[C@@H]1C(=O)[O-]	ZINC000037371643	134840840	/nfs/dbraw/zinc/84/08/40/134840840.db2.gz	FDBDLBMTNXUXAD-GFCCVEGCSA-N	-1	0	264.281	2.347	10	5		CEBERM
O=C([O-])c1cnn(-c2c(Cl)cccc2[N+](=O)[O-])c1	ZINC000020353683	171157115	/nfs/dbraw/zinc/15/71/15/171157115.db2.gz	MDOJWFQFOOFABB-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
CN(CCCC(=O)[O-])c1ccc([N+](=O)[O-])cc1F	ZINC000037330193	173131318	/nfs/dbraw/zinc/13/13/18/173131318.db2.gz	KRAHOPFOIQPFAB-UHFFFAOYSA-N	-1	0	256.233	2.035	10	5		CEBERM
CNc1ncnc([N-]c2ccc(Cl)cn2)c1[N+](=O)[O-]	ZINC000040595731	174348393	/nfs/dbraw/zinc/34/83/93/174348393.db2.gz	KHLFBVGNHSPVJW-UHFFFAOYSA-N	-1	0	280.675	2.219	10	5		CEBERM
O=C([O-])c1cccnc1NCCc1ccc([N+](=O)[O-])cc1	ZINC000040676300	174373917	/nfs/dbraw/zinc/37/39/17/174373917.db2.gz	FGQGUAOVVOHWSK-UHFFFAOYSA-N	-1	0	287.275	2.343	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])c(C)c2)c(C)c1C(=O)[O-]	ZINC000043299319	175000153	/nfs/dbraw/zinc/00/01/53/175000153.db2.gz	KOZXONQKXXMKDE-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
Cc1c(OC[C@@H]2CCOC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386654	175032556	/nfs/dbraw/zinc/03/25/56/175032556.db2.gz	NISKGWRVTHTQJK-SECBINFHSA-N	-1	0	281.264	2.017	10	5		CEBERM
O=[N+]([O-])c1ccc([O-])c(-c2n[nH]c(-c3cccc(O)c3)n2)c1	ZINC000072237752	176346645	/nfs/dbraw/zinc/34/66/45/176346645.db2.gz	LCAYNHICVJQGMK-UHFFFAOYSA-N	-1	0	298.258	2.458	10	5		CEBERM
O=[N+]([O-])c1ccc([O-])c(-c2n[nH]c(-c3ccco3)n2)c1	ZINC000072237745	176346809	/nfs/dbraw/zinc/34/68/09/176346809.db2.gz	ZFDMYIHQBVJIMD-UHFFFAOYSA-N	-1	0	272.220	2.346	10	5		CEBERM
COc1cc(N2CCC[C@@]2(C)C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000079485737	177501712	/nfs/dbraw/zinc/50/17/12/177501712.db2.gz	USJJQNRXOWLQSP-ZDUSSCGKSA-N	-1	0	298.270	2.186	10	5		CEBERM
Cc1cc(=O)[n-]n1-c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000021988840	301376922	/nfs/dbraw/zinc/37/69/22/301376922.db2.gz	CZQSNMZZIRASKT-UHFFFAOYSA-N	-1	0	253.645	2.448	10	5		CEBERM
O=C([O-])c1cc(-c2cccc([N+](=O)[O-])c2)cn2ncnc12	ZINC000536957848	330383626	/nfs/dbraw/zinc/38/36/26/330383626.db2.gz	HRABBOHFJARCMQ-UHFFFAOYSA-N	-1	0	284.231	2.003	10	5		CEBERM
CCN(C(=O)c1c(C)cccc1[N+](=O)[O-])[C@@H](C)CC(=O)[O-]	ZINC000061177873	520056194	/nfs/dbraw/zinc/05/61/94/520056194.db2.gz	IXPNOBVOROVGNX-JTQLQIEISA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(C(=O)c1cc([N+](=O)[O-])ccc1F)[C@@H](C)CC(=O)[O-]	ZINC000061180817	520071946	/nfs/dbraw/zinc/07/19/46/520071946.db2.gz	RQDWMDXAYZIQHW-QMMMGPOBSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCN(CCC(=O)[O-])c1ccc(C)c([N+](=O)[O-])c1	ZINC000061700579	520988486	/nfs/dbraw/zinc/98/84/86/520988486.db2.gz	PEQLJYLYYAPQHT-UHFFFAOYSA-N	-1	0	252.270	2.204	10	5		CEBERM
CCc1c(C(=O)[O-])nnn1-c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000050439769	523706727	/nfs/dbraw/zinc/70/67/27/523706727.db2.gz	CGZXTBDTVOSZDQ-UHFFFAOYSA-N	-1	0	290.279	2.053	10	5		CEBERM
Cc1c(N(C)C[C@H](C)C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000062723526	525816861	/nfs/dbraw/zinc/81/68/61/525816861.db2.gz	CPRGUSWBGUYNBS-QMMMGPOBSA-N	-1	0	252.270	2.060	10	5		CEBERM
Cc1nnc(Oc2cccc([N+](=O)[O-])c2)c(C(=O)[O-])c1C	ZINC000054553540	526376477	/nfs/dbraw/zinc/37/64/77/526376477.db2.gz	KFAGCDSPSCQKRU-UHFFFAOYSA-N	-1	0	289.247	2.492	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])C1CC1	ZINC000054522028	527656030	/nfs/dbraw/zinc/65/60/30/527656030.db2.gz	PNAGJMWXCNMIQT-JTQLQIEISA-N	-1	0	254.217	2.009	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N1C[C@H](C)[C@@H](C(=O)[O-])C1	ZINC000223797472	639435953	/nfs/dbraw/zinc/43/59/53/639435953.db2.gz	RLMHLZHWXQNWPR-ONGXEEELSA-N	-1	0	264.281	2.060	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])cc2C)cc1C(=O)[O-]	ZINC000083790696	178747328	/nfs/dbraw/zinc/74/73/28/178747328.db2.gz	QHFIZYAHTXFGTC-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(Br)c1CC(=O)[O-]	ZINC000396136224	344845959	/nfs/dbraw/zinc/84/59/59/344845959.db2.gz	LDIUSQBYYIGKKK-UHFFFAOYSA-N	-1	0	274.070	2.293	10	5		CEBERM
CCOC(=O)[C@H]1CCCN(c2ccc([N+](=O)[O-])c([O-])c2)C1	ZINC000584653905	344974393	/nfs/dbraw/zinc/97/43/93/344974393.db2.gz	MMVKACFQJBPRGJ-JTQLQIEISA-N	-1	0	294.307	2.080	10	5		CEBERM
O=C([O-])CC1(Nc2ncccc2[N+](=O)[O-])CCCC1	ZINC000084147726	178804083	/nfs/dbraw/zinc/80/40/83/178804083.db2.gz	BAEQPKVZWQMACZ-UHFFFAOYSA-N	-1	0	265.269	2.189	10	5		CEBERM
O=C([O-])[C@H]1CC[C@H](Nc2ccccc2[N+](=O)[O-])C1	ZINC000097065566	185520276	/nfs/dbraw/zinc/52/02/76/185520276.db2.gz	IZROVTUCLZWKPT-IUCAKERBSA-N	-1	0	250.254	2.260	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CCCC[C@H]1C(=O)[O-]	ZINC000085330575	179020964	/nfs/dbraw/zinc/02/09/64/179020964.db2.gz	MOWYRPZCAIZAIN-GHMZBOCLSA-N	-1	0	279.296	2.354	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(OCCOC(F)(F)F)c1	ZINC000089052054	179694475	/nfs/dbraw/zinc/69/44/75/179694475.db2.gz	XFQJTZBMGFVZNP-UHFFFAOYSA-N	-1	0	295.169	2.208	10	5		CEBERM
CC/C(=C\Cn1ncc2ccc([N+](=O)[O-])cc21)C(=O)[O-]	ZINC000089075340	179696987	/nfs/dbraw/zinc/69/69/87/179696987.db2.gz	XHSNVRMFMVDIAW-WEVVVXLNSA-N	-1	0	275.264	2.366	10	5		CEBERM
CC(C)[C@H](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)[O-]	ZINC000090360191	179977303	/nfs/dbraw/zinc/97/73/03/179977303.db2.gz	UETWOADWHQZCQX-JTQLQIEISA-N	-1	0	282.252	2.402	10	5		CEBERM
C[C@@H](Nc1ccc([N+](=O)[O-])cn1)c1nc(C(=O)[O-])cs1	ZINC000090943072	180068744	/nfs/dbraw/zinc/06/87/44/180068744.db2.gz	LVONJEWXKGKTNO-ZCFIWIBFSA-N	-1	0	294.292	2.318	10	5		CEBERM
O=C([O-])c1cncc(Oc2ccc([N+](=O)[O-])c(F)c2)n1	ZINC000091417466	180149981	/nfs/dbraw/zinc/14/99/81/180149981.db2.gz	RGVXOVHIGCGESN-UHFFFAOYSA-N	-1	0	279.183	2.014	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CC[C@@H](C(=O)[O-])C1	ZINC000091555936	180190233	/nfs/dbraw/zinc/19/02/33/180190233.db2.gz	MNUQLUSXQXYTIO-NXEZZACHSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCc1nn(C)c(NC2(C(=O)[O-])CCCCC2)c1[N+](=O)[O-]	ZINC000091559802	180191500	/nfs/dbraw/zinc/19/15/00/180191500.db2.gz	YAKWCXDTPRBVDA-UHFFFAOYSA-N	-1	0	296.327	2.090	10	5		CEBERM
CCc1nn(C)c(Nc2cccc(C(=O)[O-])c2)c1[N+](=O)[O-]	ZINC000091561422	180191843	/nfs/dbraw/zinc/19/18/43/180191843.db2.gz	ZLUHTRFWXGJZKV-UHFFFAOYSA-N	-1	0	290.279	2.333	10	5		CEBERM
CC(C)c1nn(C)c(SCCC(=O)[O-])c1[N+](=O)[O-]	ZINC000091577867	180197892	/nfs/dbraw/zinc/19/78/92/180197892.db2.gz	XIUIAFGKAZTEMB-UHFFFAOYSA-N	-1	0	273.314	2.019	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1Cn1ccc(C(=O)[O-])c1	ZINC000091839802	180268156	/nfs/dbraw/zinc/26/81/56/180268156.db2.gz	JJUWMXMFPQZIHA-UHFFFAOYSA-N	-1	0	276.248	2.151	10	5		CEBERM
CCN(CC)C(=O)Nc1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000091961406	180293284	/nfs/dbraw/zinc/29/32/84/180293284.db2.gz	BEAZNNUVKDKRBC-UHFFFAOYSA-N	-1	0	281.268	2.167	10	5		CEBERM
Cc1cc(N(CCCC(=O)[O-])C(C)C)ncc1[N+](=O)[O-]	ZINC000092026359	180308688	/nfs/dbraw/zinc/30/86/88/180308688.db2.gz	JLOPUQRTRGPZFH-UHFFFAOYSA-N	-1	0	281.312	2.378	10	5		CEBERM
Cc1nn(C(C)C)c(N[C@H]2C=C[C@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000092183546	180339348	/nfs/dbraw/zinc/33/93/48/180339348.db2.gz	AYTQBCYIRDBFJG-UWVGGRQHSA-N	-1	0	294.311	2.122	10	5		CEBERM
CCC[C@H](Nc1cc(OC)c(F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000110624830	186307049	/nfs/dbraw/zinc/30/70/49/186307049.db2.gz	JXGMIQUMBSRYLM-QMMMGPOBSA-N	-1	0	286.259	2.408	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1Sc1ccncn1	ZINC000111113077	186353947	/nfs/dbraw/zinc/35/39/47/186353947.db2.gz	GIWKIKJBEWXMGP-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
O=C([O-])c1cc(NCC2CCOCC2)c(F)cc1[N+](=O)[O-]	ZINC000111179073	186366400	/nfs/dbraw/zinc/36/64/00/186366400.db2.gz	UBHCEXMSJQZXHZ-UHFFFAOYSA-N	-1	0	298.270	2.271	10	5		CEBERM
CC[C@H](Oc1cc(F)c([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000113201118	186559072	/nfs/dbraw/zinc/55/90/72/186559072.db2.gz	UNBAXKVJNDNBHI-QMMMGPOBSA-N	-1	0	261.180	2.115	10	5		CEBERM
CCc1ccc(OC(F)F)c([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575658471	366318039	/nfs/dbraw/zinc/31/80/39/366318039.db2.gz	BPEQJTVGCDVTBJ-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CCOc1ccc([N+](=O)[O-])c(OC(F)F)c1CC(=O)[O-]	ZINC000575657863	366318085	/nfs/dbraw/zinc/31/80/85/366318085.db2.gz	MQHUBBHNGBUSDY-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCOc1cc(CC)c(CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000575697510	366332754	/nfs/dbraw/zinc/33/27/54/366332754.db2.gz	XLFSBMONWWRTDC-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
CCOc1cc(CC)c(CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000575697026	366332847	/nfs/dbraw/zinc/33/28/47/366332847.db2.gz	QWUSGFZOSWUTBV-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
O=C([O-])[C@H]1CS[C@@H](c2cc([N+](=O)[O-])ccc2Cl)N1	ZINC000017724494	304202491	/nfs/dbraw/zinc/20/24/91/304202491.db2.gz	OGIOOLRVHUYVLO-BDAKNGLRSA-N	-1	0	288.712	2.036	10	5		CEBERM
CC[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000006048933	170172172	/nfs/dbraw/zinc/17/21/72/170172172.db2.gz	ZXLOQIZXAJSMPU-QMMMGPOBSA-N	-1	0	259.645	2.490	10	5		CEBERM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000006336842	170193585	/nfs/dbraw/zinc/19/35/85/170193585.db2.gz	GBKMCOBNNVQTKB-VHSXEESVSA-N	-1	0	290.275	2.200	10	5		CEBERM
O=C([O-])c1cccc(Oc2cc([N+](=O)[O-])ccn2)c1	ZINC000043568657	175067533	/nfs/dbraw/zinc/06/75/33/175067533.db2.gz	ZGPOHBZNWIWZST-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
Cc1nc(Cl)c([N+](=O)[O-])c(Cl)c1C(=O)[O-]	ZINC000059949166	302594219	/nfs/dbraw/zinc/59/42/19/302594219.db2.gz	NKDHMPWNRGPUSS-UHFFFAOYSA-N	-1	0	251.025	2.303	10	5		CEBERM
NC(=O)c1cccc(-c2cc([N+](=O)[O-])ccc2C(=O)[O-])c1	ZINC000095495158	303345487	/nfs/dbraw/zinc/34/54/87/303345487.db2.gz	KRZHZTHUCRQECN-UHFFFAOYSA-N	-1	0	286.243	2.059	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1ccc(C)c([N+](=O)[O-])c1	ZINC000061700640	521247939	/nfs/dbraw/zinc/24/79/39/521247939.db2.gz	SICFAVCKZHIJBP-JTQLQIEISA-N	-1	0	266.297	2.450	10	5		CEBERM
CCN(C(=O)c1cc(F)ccc1[N+](=O)[O-])[C@@H](C)CC(=O)[O-]	ZINC000061180824	520068650	/nfs/dbraw/zinc/06/86/50/520068650.db2.gz	SPQVXJBHUJXPRS-QMMMGPOBSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])c(F)c1)C(C)(C)C(=O)[O-]	ZINC000061149726	520089890	/nfs/dbraw/zinc/08/98/90/520089890.db2.gz	NEMJQELVWVQTSU-UHFFFAOYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCN(c1ccc([N+](=O)[O-])cc1)C(C)(C)C(=O)[O-]	ZINC000061171400	521492976	/nfs/dbraw/zinc/49/29/76/521492976.db2.gz	DUZQHVZGVONIQZ-UHFFFAOYSA-N	-1	0	252.270	2.284	10	5		CEBERM
COc1ccc(C(=O)[O-])c(Oc2ncccc2[N+](=O)[O-])c1	ZINC000048803184	523765716	/nfs/dbraw/zinc/76/57/16/523765716.db2.gz	XXSIHBWUTSKGMW-UHFFFAOYSA-N	-1	0	290.231	2.489	10	5		CEBERM
C[C@](Nc1ccc([N+](=O)[O-])cn1)(C(=O)[O-])c1ccccc1	ZINC000052879869	525155508	/nfs/dbraw/zinc/15/55/08/525155508.db2.gz	HBCPUIFDWGDAGD-CQSZACIVSA-N	-1	0	287.275	2.402	10	5		CEBERM
Cc1cc(NC(=O)[C@@H]2[C@@H](C(=O)[O-])C2(C)C)ccc1[N+](=O)[O-]	ZINC000068688774	525224410	/nfs/dbraw/zinc/22/44/10/525224410.db2.gz	FBHYIMCYWVMQLJ-QWRGUYRKSA-N	-1	0	292.291	2.199	10	5		CEBERM
Cc1cc([N+](=O)[O-])c(-n2ccc(C(=O)[O-])n2)cc1C	ZINC000050439776	525553836	/nfs/dbraw/zinc/55/38/36/525553836.db2.gz	NGXKDOVXIZTNJM-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1NC(=O)N(C)C(C)(C)C(=O)[O-]	ZINC000061176679	525567916	/nfs/dbraw/zinc/56/79/16/525567916.db2.gz	UMBMCROJUWHJAR-UHFFFAOYSA-N	-1	0	295.295	2.230	10	5		CEBERM
O=C([O-])c1ccc(-n2cnc([N+](=O)[O-])c2)c(Cl)c1	ZINC000062796357	526359990	/nfs/dbraw/zinc/35/99/90/526359990.db2.gz	MXAMHUJLQJUPON-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
O=C([O-])CCSc1c(F)c(F)ccc1[N+](=O)[O-]	ZINC000053162553	527593684	/nfs/dbraw/zinc/59/36/84/527593684.db2.gz	HKWAJQCYLMDJKE-UHFFFAOYSA-N	-1	0	263.221	2.440	10	5		CEBERM
O=C([O-])[C@@H](CNc1cc([N+](=O)[O-])ccn1)c1ccccc1	ZINC000061609732	527647033	/nfs/dbraw/zinc/64/70/33/527647033.db2.gz	PHOMBTULSRLVSW-LBPRGKRZSA-N	-1	0	287.275	2.270	10	5		CEBERM
O=C([O-])[C@@H](NCc1ccc([N+](=O)[O-])o1)c1ccccc1	ZINC000050509694	527654835	/nfs/dbraw/zinc/65/48/35/527654835.db2.gz	JGCXDDWCDCIDAR-LBPRGKRZSA-N	-1	0	276.248	2.103	10	5		CEBERM
O=[N+]([O-])c1cc(Cl)cc(Cl)c1[S@](=O)[O-]	ZINC000675059563	570365499	/nfs/dbraw/zinc/36/54/99/570365499.db2.gz	IWYSBGUUOKQZQH-UHFFFAOYSA-N	-1	0	256.066	2.482	10	5		CEBERM
CC(C)Cc1nc2ccc([N+](=O)[O-])cc2c(C(=O)[O-])n1	ZINC000757124407	631822223	/nfs/dbraw/zinc/82/22/23/631822223.db2.gz	YMQHPJDBNFTREQ-UHFFFAOYSA-N	-1	0	275.264	2.435	10	5		CEBERM
CC(C)(C)OC(=O)[C@@H](CC(=O)[O-])c1cccc([N+](=O)[O-])c1	ZINC000095932467	185032716	/nfs/dbraw/zinc/03/27/16/185032716.db2.gz	HKOJIZDDLITPPA-NSHDSACASA-N	-1	0	295.291	2.495	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H]1Nc1cccc(F)c1[N+](=O)[O-]	ZINC000085329085	179019814	/nfs/dbraw/zinc/01/98/14/179019814.db2.gz	HHYSFSBUUXAOHC-IONNQARKSA-N	-1	0	268.244	2.399	10	5		CEBERM
CCOC(=O)c1csc([N-]c2ccccc2[N+](=O)[O-])n1	ZINC000604941566	347435876	/nfs/dbraw/zinc/43/58/76/347435876.db2.gz	FMPPDZGOUSTRMT-UHFFFAOYSA-N	-1	0	293.304	2.394	10	5		CEBERM
COC[C@@H](Nc1cc([N+](=O)[O-])ccc1C(=O)[O-])C(C)C	ZINC000086703058	179321334	/nfs/dbraw/zinc/32/13/34/179321334.db2.gz	UMZBWRIHQNIOTE-GFCCVEGCSA-N	-1	0	282.296	2.376	10	5		CEBERM
O=C([O-])c1cc(-c2cc([N+](=O)[O-])ccc2F)on1	ZINC000675053481	539653107	/nfs/dbraw/zinc/65/31/07/539653107.db2.gz	KXSBVRMMUMUBGD-UHFFFAOYSA-N	-1	0	252.157	2.087	10	5		CEBERM
C[C@H](Nc1ccc([N+](=O)[O-])cc1C(F)F)C(=O)[O-]	ZINC000104418973	185994750	/nfs/dbraw/zinc/99/47/50/185994750.db2.gz	VZFFHRNRDHFJME-YFKPBYRVSA-N	-1	0	260.196	2.417	10	5		CEBERM
O=C([O-])C1=Cc2cc([N+](=O)[O-])ccc2O[C@H]1C(F)(F)F	ZINC000090685506	180024083	/nfs/dbraw/zinc/02/40/83/180024083.db2.gz	GZVGBJIOQBOCCF-SECBINFHSA-N	-1	0	289.165	2.386	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1S[C@H](C)C(=O)[O-]	ZINC000091556420	180190410	/nfs/dbraw/zinc/19/04/10/180190410.db2.gz	SCILEONSHSDQMC-SSDOTTSWSA-N	-1	0	273.314	2.075	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N(CC)C[C@H](C)C(=O)[O-]	ZINC000091555377	180190518	/nfs/dbraw/zinc/19/05/18/180190518.db2.gz	LPCPAWBMELIBPE-VIFPVBQESA-N	-1	0	298.343	2.057	10	5		CEBERM
CC(C)c1nn(C)c(N[C@H](C)CCC(=O)[O-])c1[N+](=O)[O-]	ZINC000091583388	180199059	/nfs/dbraw/zinc/19/90/59/180199059.db2.gz	DYGPTJGFDSCLKB-MRVPVSSYSA-N	-1	0	284.316	2.117	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1N[C@@H](CC(C)C)C(=O)[O-]	ZINC000091554014	180189622	/nfs/dbraw/zinc/18/96/22/180189622.db2.gz	GCHYYAUGYYEZCC-VIFPVBQESA-N	-1	0	284.316	2.031	10	5		CEBERM
Cc1cc(N[C@@H]2CCCC[C@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000092026517	180308295	/nfs/dbraw/zinc/30/82/95/180308295.db2.gz	GFBSIVQJJIIYRP-NXEZZACHSA-N	-1	0	279.296	2.354	10	5		CEBERM
Cc1c(N[C@H]2C=C[C@H](C(=O)[O-])C2)cccc1[N+](=O)[O-]	ZINC000092183079	180339364	/nfs/dbraw/zinc/33/93/64/180339364.db2.gz	DICIMPINTCCGSG-UWVGGRQHSA-N	-1	0	262.265	2.344	10	5		CEBERM
O=C([O-])c1cc(-n2cnc([N+](=O)[O-])c2)c2ccccc2n1	ZINC000109586649	186264295	/nfs/dbraw/zinc/26/42/95/186264295.db2.gz	NFLVHJBAPNMGCT-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
O=C([O-])c1cccc(NC(=O)c2ccc([N+](=O)[O-])s2)n1	ZINC000110933883	186334610	/nfs/dbraw/zinc/33/46/10/186334610.db2.gz	YDSAAPIANFOAHQ-UHFFFAOYSA-N	-1	0	293.260	2.002	10	5		CEBERM
CCCOc1cc(-n2cnc(C(=O)[O-])c2)ccc1[N+](=O)[O-]	ZINC000111053953	186348001	/nfs/dbraw/zinc/34/80/01/186348001.db2.gz	ZWJRSVPHWZKUCY-UHFFFAOYSA-N	-1	0	291.263	2.268	10	5		CEBERM
CCOc1cc(OC(F)F)cc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575656166	366314912	/nfs/dbraw/zinc/31/49/12/366314912.db2.gz	CXYVXESENIVUMO-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1cc(CC(=O)[O-])cc([N+](=O)[O-])c1OC(F)F	ZINC000575657632	366316658	/nfs/dbraw/zinc/31/66/58/366316658.db2.gz	KUQSXIFCBDCXBN-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCc1c(OC(F)F)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575659423	366318711	/nfs/dbraw/zinc/31/87/11/366318711.db2.gz	MDKAAVNQYBTZIZ-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCOc1c(CC(=O)[O-])c(OC(F)F)ccc1[N+](=O)[O-]	ZINC000575659710	366320083	/nfs/dbraw/zinc/32/00/83/366320083.db2.gz	XKLJFAQERNWGHZ-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
O=C([O-])c1cc(OC(F)F)c(F)c([N+](=O)[O-])c1	ZINC000575660937	366321607	/nfs/dbraw/zinc/32/16/07/366321607.db2.gz	DIOFUJXOCRTGID-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575694758	366331516	/nfs/dbraw/zinc/33/15/16/366331516.db2.gz	MWANTOZDAYNIJL-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)c1cc([N+](=O)[O-])cc([O-])c1Br	ZINC000575699070	366332637	/nfs/dbraw/zinc/33/26/37/366332637.db2.gz	CKVRNCSDDGIHEO-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
C[C@@H](C(=O)[O-])[C@H](C)C(=O)c1csc([N+](=O)[O-])c1	ZINC000093041098	184644888	/nfs/dbraw/zinc/64/48/88/184644888.db2.gz	FTVQPWPIMAHKOH-NTSWFWBYSA-N	-1	0	257.267	2.196	10	5		CEBERM
CCCN(CC(=O)[O-])c1nccc2c1cccc2[N+](=O)[O-]	ZINC000263390067	154073557	/nfs/dbraw/zinc/07/35/57/154073557.db2.gz	GAJDUPFGJWOFPU-UHFFFAOYSA-N	-1	0	289.291	2.444	10	5		CEBERM
CCC[C@@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(=O)[O-]	ZINC000263564183	154124356	/nfs/dbraw/zinc/12/43/56/154124356.db2.gz	UROMQAJLISLHHL-SECBINFHSA-N	-1	0	278.268	2.136	10	5		CEBERM
O=C([O-])CCCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000006329946	170191901	/nfs/dbraw/zinc/19/19/01/170191901.db2.gz	DOTPTPKUZQVOMI-UHFFFAOYSA-N	-1	0	286.671	2.442	10	5		CEBERM
O=C([O-])CCCCCCNc1ccc([N+](=O)[O-])cn1	ZINC000019502437	170815127	/nfs/dbraw/zinc/81/51/27/170815127.db2.gz	OEALNSXGTWBTBC-UHFFFAOYSA-N	-1	0	267.285	2.437	10	5		CEBERM
CCCC[C@@H](Nc1ccc([N+](=O)[O-])cn1)C(=O)[O-]	ZINC000020278745	171132780	/nfs/dbraw/zinc/13/27/80/171132780.db2.gz	JWKOPUSOAVTPDK-SECBINFHSA-N	-1	0	253.258	2.045	10	5		CEBERM
O=C([O-])C1=Cc2cc(Cl)cc([N+](=O)[O-])c2OC1	ZINC000021952607	171340087	/nfs/dbraw/zinc/34/00/87/171340087.db2.gz	AAHZITRBLIXJHY-UHFFFAOYSA-N	-1	0	255.613	2.109	10	5		CEBERM
CN(Cc1ccncc1)c1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000035207375	172052085	/nfs/dbraw/zinc/05/20/85/172052085.db2.gz	LANGKQNYYBRNFI-UHFFFAOYSA-N	-1	0	287.275	2.324	10	5		CEBERM
CCCC[C@H](NC(=O)c1csc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000037563229	173510412	/nfs/dbraw/zinc/51/04/12/173510412.db2.gz	HXKLEGWXSGEMTP-QMMMGPOBSA-N	-1	0	286.309	2.030	10	5		CEBERM
Cc1cc([N-]c2ncnc(Cl)c2[N+](=O)[O-])no1	ZINC000040571109	174338426	/nfs/dbraw/zinc/33/84/26/174338426.db2.gz	VHEXXCJYTFDZCG-UHFFFAOYSA-N	-1	0	255.621	2.078	10	5		CEBERM
CCCNc1ncnc([N-]c2cc(C)on2)c1[N+](=O)[O-]	ZINC000040582031	174345314	/nfs/dbraw/zinc/34/53/14/174345314.db2.gz	DMBMIXSATPBNOZ-UHFFFAOYSA-N	-1	0	278.272	2.247	10	5		CEBERM
CCCCNc1nc[n-]c(=NNC(C)(C)C)c1[N+](=O)[O-]	ZINC000040595364	174348624	/nfs/dbraw/zinc/34/86/24/174348624.db2.gz	QNWNJGGWHMQLIW-UHFFFAOYSA-N	-1	0	282.348	2.312	10	5		CEBERM
Cc1c(Sc2cnn(C)c2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043387311	175032633	/nfs/dbraw/zinc/03/26/33/175032633.db2.gz	VNIZFILYEWFNTC-UHFFFAOYSA-N	-1	0	293.304	2.486	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])s1	ZINC000070525209	175970051	/nfs/dbraw/zinc/97/00/51/175970051.db2.gz	AAYZIGQWODOPAH-YUMQZZPRSA-N	-1	0	298.320	2.030	10	5		CEBERM
O=C([O-])CCCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000071286110	176109512	/nfs/dbraw/zinc/10/95/12/176109512.db2.gz	DYDHPHKQQRRDOI-UHFFFAOYSA-N	-1	0	294.263	2.148	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1ccc([N+](=O)[O-])c(C)c1	ZINC000061217684	521248023	/nfs/dbraw/zinc/24/80/23/521248023.db2.gz	OWLKUPHIQOYXBN-JTQLQIEISA-N	-1	0	266.297	2.450	10	5		CEBERM
CCN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)[C@H](C)CC(=O)[O-]	ZINC000061178259	520081409	/nfs/dbraw/zinc/08/14/09/520081409.db2.gz	VAQOVFRSDYXMTI-SNVBAGLBSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1ccc([N+](=O)[O-])cc1C	ZINC000061217914	521199797	/nfs/dbraw/zinc/19/97/97/521199797.db2.gz	UBQWITYUQCGAQB-SNVBAGLBSA-N	-1	0	266.297	2.450	10	5		CEBERM
CSCCNc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000069456088	525512315	/nfs/dbraw/zinc/51/23/15/525512315.db2.gz	QFPHHEOPNCNKHJ-UHFFFAOYSA-N	-1	0	274.273	2.207	10	5		CEBERM
Cc1nn(-c2ccc(C(=O)[O-])cc2F)c(C)c1[N+](=O)[O-]	ZINC000054552523	527521320	/nfs/dbraw/zinc/52/13/20/527521320.db2.gz	SPCVMKNDJCCQPG-UHFFFAOYSA-N	-1	0	279.227	2.235	10	5		CEBERM
O=C([O-])C[C@@H]1CCCN1c1c(F)c(F)ccc1[N+](=O)[O-]	ZINC000053162441	527628932	/nfs/dbraw/zinc/62/89/32/527628932.db2.gz	YSNIDPBKEYIALR-ZETCQYMHSA-N	-1	0	286.234	2.317	10	5		CEBERM
O=C([O-])C[C@H](Oc1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000062763496	527634574	/nfs/dbraw/zinc/63/45/74/527634574.db2.gz	MUYIFAKWXLSVCY-QMMMGPOBSA-N	-1	0	279.170	2.379	10	5		CEBERM
O=C([O-])c1cc(Br)c([N+](=O)[O-])s1	ZINC000096960076	185142930	/nfs/dbraw/zinc/14/29/30/185142930.db2.gz	MNPRLEUUNMJYRW-UHFFFAOYSA-N	-1	0	252.045	2.117	10	5		CEBERM
CCOc1cccc(N2C[C@@H](C)[C@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000134885927	344378591	/nfs/dbraw/zinc/37/85/91/344378591.db2.gz	QDDPLEXGIWGGRN-NXEZZACHSA-N	-1	0	294.307	2.150	10	5		CEBERM
O=[N+]([O-])c1cc(I)c(F)cc1[O-]	ZINC000158675042	344451934	/nfs/dbraw/zinc/45/19/34/344451934.db2.gz	NTMLWWAGIHZWQT-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
Cn1c2ccc(F)cc2c2ccccc2/c(=N\[O-])c1=O	ZINC000584638253	344971799	/nfs/dbraw/zinc/97/17/99/344971799.db2.gz	YOYKCEPXURFMHX-SAPNQHFASA-N	-1	0	270.263	2.121	10	5		CEBERM
CC[C@@H](C)N(CC(=O)[O-])c1c([N+](=O)[O-])c(C)nn1C(C)C	ZINC000097127926	185542010	/nfs/dbraw/zinc/54/20/10/185542010.db2.gz	ZIPFBLIUPDCKCL-SECBINFHSA-N	-1	0	298.343	2.370	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])nc1	ZINC000085330476	179020186	/nfs/dbraw/zinc/02/01/86/179020186.db2.gz	RHXKPYYELAJBIM-NXEZZACHSA-N	-1	0	265.269	2.045	10	5		CEBERM
COC[C@H](Nc1ccc([N+](=O)[O-])cc1C(=O)[O-])C(C)C	ZINC000086702753	179321481	/nfs/dbraw/zinc/32/14/81/179321481.db2.gz	NPUDBPKUYDDHQN-LBPRGKRZSA-N	-1	0	282.296	2.376	10	5		CEBERM
CC(C)(Nc1ncccc1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000087624279	179457779	/nfs/dbraw/zinc/45/77/79/179457779.db2.gz	KYPMKHBNVFKFEP-UHFFFAOYSA-N	-1	0	267.285	2.291	10	5		CEBERM
O=C([O-])c1cc(-c2ccc([N+](=O)[O-])c(F)c2)on1	ZINC000675053442	539653925	/nfs/dbraw/zinc/65/39/25/539653925.db2.gz	KKUVQVARHFUOAZ-UHFFFAOYSA-N	-1	0	252.157	2.087	10	5		CEBERM
CCC[C@@H](CNc1ncc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000090691790	180024432	/nfs/dbraw/zinc/02/44/32/180024432.db2.gz	PBWUZGDKUVSAIA-VIFPVBQESA-N	-1	0	267.285	2.211	10	5		CEBERM
Cc1cnc(NC2(C(=O)[O-])CCCCC2)c([N+](=O)[O-])c1	ZINC000090691672	180024831	/nfs/dbraw/zinc/02/48/31/180024831.db2.gz	ODNPSHQLPGCTPT-UHFFFAOYSA-N	-1	0	279.296	2.498	10	5		CEBERM
Cc1cnc(Oc2cncc(C(=O)[O-])c2)c([N+](=O)[O-])c1	ZINC000090692806	180025099	/nfs/dbraw/zinc/02/50/99/180025099.db2.gz	DRSIIMBFJHWWSG-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1NC[C@H](C(=O)[O-])C(C)C	ZINC000091555908	180190217	/nfs/dbraw/zinc/19/02/17/180190217.db2.gz	VIYQLJKPJRCAFR-JTQLQIEISA-N	-1	0	298.343	2.278	10	5		CEBERM
CCCc1nn(C)c(N[C@](C)(CCC)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091562212	180192520	/nfs/dbraw/zinc/19/25/20/180192520.db2.gz	JWGSGXIFTBKJSO-CYBMUJFWSA-N	-1	0	298.343	2.336	10	5		CEBERM
O=c1c2c([n-]n1-c1ccccc1[N+](=O)[O-])CCCC2	ZINC000104931023	186032935	/nfs/dbraw/zinc/03/29/35/186032935.db2.gz	JMQWDOPXCKSNRL-SECBINFHSA-N	-1	0	259.265	2.488	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1Oc1cncc(C(=O)[O-])c1	ZINC000091554230	180189404	/nfs/dbraw/zinc/18/94/04/180189404.db2.gz	QISXKYQOQMCCIE-UHFFFAOYSA-N	-1	0	292.251	2.005	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1NC(C)(C)CCC(=O)[O-]	ZINC000091555025	180189906	/nfs/dbraw/zinc/18/99/06/180189906.db2.gz	YOAQIJPYEJGYGU-UHFFFAOYSA-N	-1	0	284.316	2.175	10	5		CEBERM
Cc1cc(NC[C@H]2CCC[C@@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000092026553	180308723	/nfs/dbraw/zinc/30/87/23/180308723.db2.gz	RRWLYNCOJPIUHO-ZJUUUORDSA-N	-1	0	279.296	2.211	10	5		CEBERM
Cc1cc(N[C@@H]2C=C[C@@H](C(=O)[O-])C2)ccc1[N+](=O)[O-]	ZINC000092182562	180338763	/nfs/dbraw/zinc/33/87/63/180338763.db2.gz	YXESLKMGINPUIY-MWLCHTKSSA-N	-1	0	262.265	2.344	10	5		CEBERM
Cc1c(N[C@@H]2C=C[C@H](C(=O)[O-])C2)cccc1[N+](=O)[O-]	ZINC000092183080	180339298	/nfs/dbraw/zinc/33/92/98/180339298.db2.gz	DICIMPINTCCGSG-VHSXEESVSA-N	-1	0	262.265	2.344	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@H](Nc2c(F)c(F)ccc2[N+](=O)[O-])C1	ZINC000092182863	180339462	/nfs/dbraw/zinc/33/94/62/180339462.db2.gz	BPGJHLLWORTMHY-BQBZGAKWSA-N	-1	0	284.218	2.314	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N[C@@H]1C=C[C@H](C(=O)[O-])C1	ZINC000092182708	180339474	/nfs/dbraw/zinc/33/94/74/180339474.db2.gz	YIUNPALMFNDIHH-VHSXEESVSA-N	-1	0	262.265	2.344	10	5		CEBERM
Cc1ccc(N[C@@H]2C=C[C@H](C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000092183839	180340174	/nfs/dbraw/zinc/34/01/74/180340174.db2.gz	MYKPGAJPQGFQKC-VHSXEESVSA-N	-1	0	262.265	2.344	10	5		CEBERM
Cc1c(N[C@H]2CCCOC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000109550382	186262352	/nfs/dbraw/zinc/26/23/52/186262352.db2.gz	UYALVBVDIHHWQJ-JTQLQIEISA-N	-1	0	280.280	2.192	10	5		CEBERM
CCC[C@@H]1C[C@H]1NC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000075559980	363473870	/nfs/dbraw/zinc/47/38/70/363473870.db2.gz	UADOBWAXYUIPGQ-PSASIEDQSA-N	-1	0	264.281	2.219	10	5		CEBERM
CCOc1cc(C(=O)[O-])cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575655575	366313548	/nfs/dbraw/zinc/31/35/48/366313548.db2.gz	AKGUASXWJDOFIQ-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCc1ccc(C(=O)[O-])c([N+](=O)[O-])c1OC(F)F	ZINC000575659447	366318728	/nfs/dbraw/zinc/31/87/28/366318728.db2.gz	MSHSMTRASFVNHA-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
CCOc1ccc(C(=O)[O-])c(OC(F)F)c1[N+](=O)[O-]	ZINC000575658878	366319046	/nfs/dbraw/zinc/31/90/46/366319046.db2.gz	WPDGVIZWMCYYFG-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
O=C([O-])c1c(OC(F)F)ccc(F)c1[N+](=O)[O-]	ZINC000575660831	366320837	/nfs/dbraw/zinc/32/08/37/366320837.db2.gz	ADCZRNLWUIVPKQ-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
Cc1ccc(CC(=O)[O-])c([N+](=O)[O-])c1OC(F)F	ZINC000575665048	366322301	/nfs/dbraw/zinc/32/23/01/366322301.db2.gz	AVMANFPNMLFQTR-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
CC(=O)c1cc(Br)c([N+](=O)[O-])cc1[O-]	ZINC000575691092	366329734	/nfs/dbraw/zinc/32/97/34/366329734.db2.gz	HGULKQAOUAVCOY-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CCOC(=O)c1cc([O-])cc([N+](=O)[O-])c1Br	ZINC000575700259	366333643	/nfs/dbraw/zinc/33/36/43/366333643.db2.gz	RTSMSQIERGDRAL-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
O=C([O-])[C@H]1Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@H]12	ZINC000005347436	361331951	/nfs/dbraw/zinc/33/19/51/361331951.db2.gz	RIKMSJBWDDECKT-WCQYABFASA-N	-1	0	276.292	2.211	10	5		CEBERM
COC[C@@H](C)C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000186037158	368910692	/nfs/dbraw/zinc/91/06/92/368910692.db2.gz	ZWKDFJMCACHNCJ-ZCFIWIBFSA-N	-1	0	288.687	2.175	10	5		CEBERM
O=C([O-])[C@H]1CCCCCN1c1ccccc1[N+](=O)[O-]	ZINC000080991536	177747897	/nfs/dbraw/zinc/74/78/97/177747897.db2.gz	XOWLWWICHZBUFO-GFCCVEGCSA-N	-1	0	264.281	2.428	10	5		CEBERM
O=C([O-])c1ccc(OCc2cc(F)ccc2[N+](=O)[O-])cn1	ZINC000094214030	184763741	/nfs/dbraw/zinc/76/37/41/184763741.db2.gz	QKYJTWQZTBHJGK-UHFFFAOYSA-N	-1	0	292.222	2.406	10	5		CEBERM
CCC(CC)(NC(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)[O-]	ZINC000094240166	184768584	/nfs/dbraw/zinc/76/85/84/184768584.db2.gz	OPXFYGHXSUQOQB-UHFFFAOYSA-N	-1	0	294.307	2.276	10	5		CEBERM
Nc1nc(Nc2ccc(C(=O)[O-])cc2)ccc1[N+](=O)[O-]	ZINC000094260875	184771169	/nfs/dbraw/zinc/77/11/69/184771169.db2.gz	CFJXFHHYHLWILV-UHFFFAOYSA-N	-1	0	274.236	2.014	10	5		CEBERM
O=C([O-])CC1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000093680060	135082141	/nfs/dbraw/zinc/08/21/41/135082141.db2.gz	VUQQQFAVBXILOC-UHFFFAOYSA-N	-1	0	264.281	2.286	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000005584079	170116274	/nfs/dbraw/zinc/11/62/74/170116274.db2.gz	LKPLYMRJMSBEIO-ZJUUUORDSA-N	-1	0	292.291	2.424	10	5		CEBERM
COc1cccc2c(=O)c3ccccc3n(CC(=O)[O-])c12	ZINC000006571496	170214278	/nfs/dbraw/zinc/21/42/78/170214278.db2.gz	HFLSWFIHTZAFGC-UHFFFAOYSA-N	-1	0	283.283	2.248	10	5		CEBERM
COc1ccc(O[C@H](C(=O)[O-])C(C)C)c([N+](=O)[O-])c1	ZINC000019411454	170789367	/nfs/dbraw/zinc/78/93/67/170789367.db2.gz	KIMMGDMBHRBVEQ-NSHDSACASA-N	-1	0	269.253	2.091	10	5		CEBERM
CC[C@H](C)[C@@H](NC(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)[O-]	ZINC000020362124	171160687	/nfs/dbraw/zinc/16/06/87/171160687.db2.gz	YLNPMBIUFXJKCY-QPUJVOFHSA-N	-1	0	294.307	2.132	10	5		CEBERM
O=C([O-])[C@H](Oc1cccnc1[N+](=O)[O-])c1ccccc1	ZINC000020483526	171223817	/nfs/dbraw/zinc/22/38/17/171223817.db2.gz	JPUJQJQFMABBKP-LLVKDONJSA-N	-1	0	274.232	2.195	10	5		CEBERM
CC[C@@H](Nc1ccc2scnc2c1[N+](=O)[O-])C(=O)[O-]	ZINC000035411041	172182059	/nfs/dbraw/zinc/18/20/59/172182059.db2.gz	XXWVTVSGZSDCFZ-ZCFIWIBFSA-N	-1	0	281.293	2.480	10	5		CEBERM
CCC[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000036838431	172742109	/nfs/dbraw/zinc/74/21/09/172742109.db2.gz	SPGBYWVRWVZJIF-SECBINFHSA-N	-1	0	256.233	2.399	10	5		CEBERM
CCN(CC(=O)[O-])c1cc2nc(C)sc2cc1[N+](=O)[O-]	ZINC000038017271	173991435	/nfs/dbraw/zinc/99/14/35/173991435.db2.gz	IQZVSVINABLXNN-UHFFFAOYSA-N	-1	0	295.320	2.424	10	5		CEBERM
CCN(CCC(=O)[O-])c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000038023837	174005988	/nfs/dbraw/zinc/00/59/88/174005988.db2.gz	GPXIGGPUUQWUDZ-UHFFFAOYSA-N	-1	0	289.291	2.444	10	5		CEBERM
CC(C)OC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000039233132	174166642	/nfs/dbraw/zinc/16/66/42/174166642.db2.gz	RORGXGYEDQWPRR-UHFFFAOYSA-N	-1	0	268.225	2.250	10	5		CEBERM
C[C@H]1CCC[C@](Nc2ccc([N+](=O)[O-])cn2)(C(=O)[O-])C1	ZINC000041035079	174458106	/nfs/dbraw/zinc/45/81/06/174458106.db2.gz	KTRGYQNKOPEPBB-TVQRCGJNSA-N	-1	0	279.296	2.435	10	5		CEBERM
Cc1nn(C)c(N[C@@]2(C(=O)[O-])CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000041035169	174458417	/nfs/dbraw/zinc/45/84/17/174458417.db2.gz	AQMBFSLATGHGOF-OQPBUACISA-N	-1	0	296.327	2.082	10	5		CEBERM
O=C([O-])c1cnc(Oc2cc(F)ccc2[N+](=O)[O-])cn1	ZINC000071182452	176057573	/nfs/dbraw/zinc/05/75/73/176057573.db2.gz	YFRVWLPHBXRJQH-UHFFFAOYSA-N	-1	0	279.183	2.014	10	5		CEBERM
O=[N+]([O-])c1ccc([O-])c(-c2n[nH]c(-c3cccnc3)n2)c1	ZINC000072237754	176346502	/nfs/dbraw/zinc/34/65/02/176346502.db2.gz	DALIODVCLIYKAQ-UHFFFAOYSA-N	-1	0	283.247	2.148	10	5		CEBERM
Cc1cc(C(=O)[O-])nn1-c1cc([N+](=O)[O-])ccc1C	ZINC000075419515	176700579	/nfs/dbraw/zinc/70/05/79/176700579.db2.gz	HDPQOHQUOHMJAP-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
CC(C)(C)n1cc(C(=O)[O-])c2cc([N+](=O)[O-])cnc21	ZINC000095937232	278580889	/nfs/dbraw/zinc/58/08/89/278580889.db2.gz	INCBHWYHRLMFBS-UHFFFAOYSA-N	-1	0	263.253	2.398	10	5		CEBERM
CCO[C@H](COc1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000062761222	520520602	/nfs/dbraw/zinc/52/06/02/520520602.db2.gz	RTXHUPLTSKQURK-SNVBAGLBSA-N	-1	0	289.671	2.117	10	5		CEBERM
CCN(C(=O)c1cc(F)ccc1[N+](=O)[O-])[C@H](C)CC(=O)[O-]	ZINC000061180826	520068298	/nfs/dbraw/zinc/06/82/98/520068298.db2.gz	SPQVXJBHUJXPRS-MRVPVSSYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCO[C@@H](COc1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000062763632	520315817	/nfs/dbraw/zinc/31/58/17/520315817.db2.gz	YUIVNQZSISOSBV-JTQLQIEISA-N	-1	0	289.671	2.117	10	5		CEBERM
CCC[C@]1(C(=O)[O-])CCCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000062875386	521302644	/nfs/dbraw/zinc/30/26/44/521302644.db2.gz	QXTOXQYVMMYMCP-AWEZNQCLSA-N	-1	0	293.323	2.461	10	5		CEBERM
CN(c1cc(F)cc([N+](=O)[O-])c1)C(C)(C)C(=O)[O-]	ZINC000061171096	523631111	/nfs/dbraw/zinc/63/11/11/523631111.db2.gz	JSGCDGJKYXOZFW-UHFFFAOYSA-N	-1	0	256.233	2.033	10	5		CEBERM
Cc1cccc([N+](=O)[O-])c1C(=O)N(CC(=O)[O-])CC(C)C	ZINC000062742021	524901216	/nfs/dbraw/zinc/90/12/16/524901216.db2.gz	GYCKSBJGIANJIZ-UHFFFAOYSA-N	-1	0	294.307	2.086	10	5		CEBERM
Cc1ccc(N2CCCC[C@H]2C(=O)[O-])cc1[N+](=O)[O-]	ZINC000061700557	524944605	/nfs/dbraw/zinc/94/46/05/524944605.db2.gz	XDMVTEZVUBJZIE-NSHDSACASA-N	-1	0	264.281	2.347	10	5		CEBERM
Cc1ccc(N2CCC[C@@H](C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000061700531	524951959	/nfs/dbraw/zinc/95/19/59/524951959.db2.gz	FOMLUJTWWFHQIU-SNVBAGLBSA-N	-1	0	264.281	2.204	10	5		CEBERM
C[C@](Nc1cc([N+](=O)[O-])ccn1)(C(=O)[O-])c1ccccc1	ZINC000052879910	525155631	/nfs/dbraw/zinc/15/56/31/525155631.db2.gz	MCRVXFMAZMFCPS-CQSZACIVSA-N	-1	0	287.275	2.402	10	5		CEBERM
Cc1ccc(N[C@@H](C(=O)[O-])C(C)C)cc1[N+](=O)[O-]	ZINC000061700603	525308394	/nfs/dbraw/zinc/30/83/94/525308394.db2.gz	WGECEAISWWQECP-LLVKDONJSA-N	-1	0	252.270	2.424	10	5		CEBERM
C[C@@H]1C[C@@H]1Nc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000052293903	525330392	/nfs/dbraw/zinc/33/03/92/525330392.db2.gz	XQRUQTCRUFSIJX-XRGYYRRGSA-N	-1	0	254.217	2.252	10	5		CEBERM
Cc1c(N(CCC(=O)[O-])C2CC2)cccc1[N+](=O)[O-]	ZINC000062723463	525817050	/nfs/dbraw/zinc/81/70/50/525817050.db2.gz	BMNRAMRDCHQOBX-UHFFFAOYSA-N	-1	0	264.281	2.347	10	5		CEBERM
O=C([O-])c1cccc(-n2ncc3ccc([N+](=O)[O-])cc32)n1	ZINC000051041477	526387596	/nfs/dbraw/zinc/38/75/96/526387596.db2.gz	WGOORISDFWXHOU-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
O=C([O-])[C@@H](Nc1cccc(F)c1[N+](=O)[O-])C1CC1	ZINC000054505821	527655996	/nfs/dbraw/zinc/65/59/96/527655996.db2.gz	GJJOXEKSLCRKBT-VIFPVBQESA-N	-1	0	254.217	2.009	10	5		CEBERM
O=C([O-])c1cnc(Nc2ccccc2)c([N+](=O)[O-])c1	ZINC000082568458	178101063	/nfs/dbraw/zinc/10/10/63/178101063.db2.gz	BWBZRAJGJPBNRK-UHFFFAOYSA-N	-1	0	259.221	2.432	10	5		CEBERM
O=C([O-])c1ccc(Oc2ccc([N+](=O)[O-])cc2)cn1	ZINC000033852855	361785727	/nfs/dbraw/zinc/78/57/27/361785727.db2.gz	UJKWKNWJDWPCFW-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N1CCCCC[C@H]1C(=O)[O-]	ZINC000083896179	178760088	/nfs/dbraw/zinc/76/00/88/178760088.db2.gz	VJNRRYDMRBBIIT-NSHDSACASA-N	-1	0	279.296	2.132	10	5		CEBERM
COc1cc(N[C@H]2CC[C@H](C(=O)[O-])C2)c([N+](=O)[O-])cc1F	ZINC000097065100	185520625	/nfs/dbraw/zinc/52/06/25/185520625.db2.gz	AWHQIJOPOINXBO-YUMQZZPRSA-N	-1	0	298.270	2.408	10	5		CEBERM
C[C@@H](C(=O)[O-])N(C)c1cc(F)c(Cl)cc1[N+](=O)[O-]	ZINC000097355512	185588230	/nfs/dbraw/zinc/58/82/30/185588230.db2.gz	KOOOPKWCEPKJNE-YFKPBYRVSA-N	-1	0	276.651	2.297	10	5		CEBERM
CC(C)(CCNc1ncc([N+](=O)[O-])cn1)CCC(=O)[O-]	ZINC000087673796	179467397	/nfs/dbraw/zinc/46/73/97/179467397.db2.gz	GGZHRPYJIIEJEB-UHFFFAOYSA-N	-1	0	282.300	2.078	10	5		CEBERM
CC/C(=C\COc1ccc(C)nc1[N+](=O)[O-])C(=O)[O-]	ZINC000089075034	179696954	/nfs/dbraw/zinc/69/69/54/179696954.db2.gz	VKMBXFNHCFURBG-RMKNXTFCSA-N	-1	0	266.253	2.098	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1S[C@H](C)CC(=O)[O-]	ZINC000090098750	179914091	/nfs/dbraw/zinc/91/40/91/179914091.db2.gz	OREZPODSPTWNAC-ZCFIWIBFSA-N	-1	0	273.314	2.075	10	5		CEBERM
CCCC[C@@H](Nc1c([N+](=O)[O-])c(CCC)nn1C)C(=O)[O-]	ZINC000091562007	180192318	/nfs/dbraw/zinc/19/23/18/180192318.db2.gz	CWOABJMQRIIBLO-SNVBAGLBSA-N	-1	0	298.343	2.336	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@@H](Nc2cc(F)ccc2[N+](=O)[O-])C1	ZINC000092183857	180339724	/nfs/dbraw/zinc/33/97/24/180339724.db2.gz	FZPNCEMPAFPQGW-VXNVDRBHSA-N	-1	0	266.228	2.175	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])c1cc(F)cc([N+](=O)[O-])c1	ZINC000092448850	180387219	/nfs/dbraw/zinc/38/72/19/180387219.db2.gz	FHCPPOCOWPLVDG-UHFFFAOYSA-N	-1	0	270.260	2.423	10	5		CEBERM
COc1cc(N2CCC[C@@H]2CC(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000110624876	186306302	/nfs/dbraw/zinc/30/63/02/186306302.db2.gz	ITJQRBCRNCMAAX-MRVPVSSYSA-N	-1	0	298.270	2.186	10	5		CEBERM
COc1cc(N[C@H](C(=O)[O-])C2CC2)c([N+](=O)[O-])cc1F	ZINC000110624940	186306755	/nfs/dbraw/zinc/30/67/55/186306755.db2.gz	HJXCMEBCRMYAHZ-NSHDSACASA-N	-1	0	284.243	2.018	10	5		CEBERM
CCC[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000148356260	187917748	/nfs/dbraw/zinc/91/77/48/187917748.db2.gz	XCMDCHMKCYBJPJ-ZETCQYMHSA-N	-1	0	273.676	2.308	10	5		CEBERM
Cc1c(C(F)(F)F)ccc([N+](=O)[O-])c1[C@@H](O)C(=O)[O-]	ZINC000575673420	366323729	/nfs/dbraw/zinc/32/37/29/366323729.db2.gz	JOIIVOYPDDMDAT-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
COc1cc([N+](=O)[O-])c(C(F)(F)F)cc1CC(=O)[O-]	ZINC000575679182	366325855	/nfs/dbraw/zinc/32/58/55/366325855.db2.gz	NSZCNGPEMFPUNG-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
CCOc1cc(OC(F)F)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575656124	366315467	/nfs/dbraw/zinc/31/54/67/366315467.db2.gz	CKDCCFHEDXSRNP-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1cc([N+](=O)[O-])cc(CC(=O)[O-])c1OC(F)F	ZINC000575659739	366320558	/nfs/dbraw/zinc/32/05/58/366320558.db2.gz	XROCOCUPEYIBSM-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
O=C([O-])c1ccc(F)c(OC(F)F)c1[N+](=O)[O-]	ZINC000575661399	366320961	/nfs/dbraw/zinc/32/09/61/366320961.db2.gz	OQFHIUWINCDSTD-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
CCc1c(CC(=O)[O-])c(OC(F)F)ccc1[N+](=O)[O-]	ZINC000575660735	366320984	/nfs/dbraw/zinc/32/09/84/366320984.db2.gz	VEIVTKROAAVIGZ-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=C([O-])c1c(F)ccc([N+](=O)[O-])c1OC(F)F	ZINC000575661120	366321031	/nfs/dbraw/zinc/32/10/31/366321031.db2.gz	JLLNQMFSODGROV-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])c1cc(OC(F)F)c([N+](=O)[O-])cc1F	ZINC000575660862	366321425	/nfs/dbraw/zinc/32/14/25/366321425.db2.gz	BDAKXLHMXXIFBR-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=[N+]([O-])c1cc([O-])c(I)cc1F	ZINC000575707346	366339411	/nfs/dbraw/zinc/33/94/11/366339411.db2.gz	WNJMZIKMJLPXAD-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
O=C([O-])Cc1cc(F)cc([N+](=O)[O-])c1C(F)(F)F	ZINC000575711296	366340159	/nfs/dbraw/zinc/34/01/59/366340159.db2.gz	QLYWODDCIGUFCQ-UHFFFAOYSA-N	-1	0	267.134	2.380	10	5		CEBERM
O=C([O-])Cc1c(F)ccc([N+](=O)[O-])c1OC(F)(F)F	ZINC000575711693	366340211	/nfs/dbraw/zinc/34/02/11/366340211.db2.gz	VNTLTOMTGGAQQJ-UHFFFAOYSA-N	-1	0	283.133	2.260	10	5		CEBERM
CC(=O)c1cc(Br)cc([O-])c1[N+](=O)[O-]	ZINC000575690772	366330009	/nfs/dbraw/zinc/33/00/09/366330009.db2.gz	ASECQYJOXRTMSQ-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CC(=O)c1cc([O-])cc(Br)c1[N+](=O)[O-]	ZINC000575691152	366330147	/nfs/dbraw/zinc/33/01/47/366330147.db2.gz	JDDILWARFVSZRW-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CCC[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)C(=O)[O-]	ZINC000081588733	363732703	/nfs/dbraw/zinc/73/27/03/363732703.db2.gz	QFIHUJUVGAGBOV-LLVKDONJSA-N	-1	0	290.279	2.203	10	5		CEBERM
O=C([O-])c1csc([N+](=O)[O-])c1Br	ZINC000000967212	169683451	/nfs/dbraw/zinc/68/34/51/169683451.db2.gz	GDPTZGOFQIFHSK-UHFFFAOYSA-N	-1	0	252.045	2.117	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1OCc1ccco1	ZINC000022216718	171375681	/nfs/dbraw/zinc/37/56/81/171375681.db2.gz	DPENXAYTNMZWGK-UHFFFAOYSA-N	-1	0	263.205	2.465	10	5		CEBERM
CCCC[C@H](Nc1ccc([N+](=O)[O-])c2nonc21)C(=O)[O-]	ZINC000034722757	171864776	/nfs/dbraw/zinc/86/47/76/171864776.db2.gz	WINFFMDQPXEANN-QMMMGPOBSA-N	-1	0	294.267	2.186	10	5		CEBERM
O=C([O-])CCCNc1ccc2scnc2c1[N+](=O)[O-]	ZINC000035344169	172135909	/nfs/dbraw/zinc/13/59/09/172135909.db2.gz	MMSCRINKRMTVMX-UHFFFAOYSA-N	-1	0	281.293	2.481	10	5		CEBERM
CCN(CC(=O)[O-])c1ccc2scnc2c1[N+](=O)[O-]	ZINC000038017297	173991601	/nfs/dbraw/zinc/99/16/01/173991601.db2.gz	RJADJQIYZIINIQ-UHFFFAOYSA-N	-1	0	281.293	2.115	10	5		CEBERM
O=[N+]([O-])c1c(-n2ccnc2)nc[n-]c1=NNc1ccccc1	ZINC000040624804	174356189	/nfs/dbraw/zinc/35/61/89/174356189.db2.gz	GMSPWABCOSEYAA-UHFFFAOYSA-N	-1	0	297.278	2.010	10	5		CEBERM
Cc1ccc(Sc2nc[n-]c(=NN)c2[N+](=O)[O-])cc1	ZINC000040650296	174365018	/nfs/dbraw/zinc/36/50/18/174365018.db2.gz	BWRNVMLDMAIPJD-UHFFFAOYSA-N	-1	0	277.309	2.130	10	5		CEBERM
O=C([O-])c1cnn(-c2ccc([N+](=O)[O-])c3cccnc32)c1	ZINC000043299415	174999988	/nfs/dbraw/zinc/99/99/88/174999988.db2.gz	ZWIGDILFRQMOET-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
CCOCCCNc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043386801	175032406	/nfs/dbraw/zinc/03/24/06/175032406.db2.gz	DDORIIRBPMGUBR-UHFFFAOYSA-N	-1	0	282.296	2.440	10	5		CEBERM
CCN(c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C)[C@@H](C)COC	ZINC000043387233	175032781	/nfs/dbraw/zinc/03/27/81/175032781.db2.gz	WYSURHSMNYVBND-VIFPVBQESA-N	-1	0	296.323	2.463	10	5		CEBERM
Cc1cc(Nc2ncc([N+](=O)[O-])cn2)ccc1C(=O)[O-]	ZINC000044750206	175245016	/nfs/dbraw/zinc/24/50/16/175245016.db2.gz	POZKZFKMUGVZFC-UHFFFAOYSA-N	-1	0	274.236	2.135	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@H](Nc2ncccc2[N+](=O)[O-])C1	ZINC000070556392	175984359	/nfs/dbraw/zinc/98/43/59/175984359.db2.gz	OLGWWNDHTFRGEG-IUCAKERBSA-N	-1	0	265.269	2.045	10	5		CEBERM
Cc1c(C(=O)[O-])cnn1Cc1cccc([N+](=O)[O-])c1C	ZINC000080046004	177601451	/nfs/dbraw/zinc/60/14/51/177601451.db2.gz	ANPMXSGJNMPEIU-UHFFFAOYSA-N	-1	0	275.264	2.155	10	5		CEBERM
CCN(C(=O)Nc1cccc([N+](=O)[O-])c1)[C@H](C)CC(=O)[O-]	ZINC000061181098	520003031	/nfs/dbraw/zinc/00/30/31/520003031.db2.gz	AKLVXVXFIDEMIO-SECBINFHSA-N	-1	0	295.295	2.312	10	5		CEBERM
CCN(C(=O)c1ccc(F)c([N+](=O)[O-])c1)C(C)(C)C(=O)[O-]	ZINC000061149581	520084382	/nfs/dbraw/zinc/08/43/82/520084382.db2.gz	LOPOFSKTQBEJIH-UHFFFAOYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCO[C@@H](CCOc1ccc([N+](=O)[O-])c(C)c1)C(=O)[O-]	ZINC000062763684	520305728	/nfs/dbraw/zinc/30/57/28/520305728.db2.gz	RXMPURQLHZVGNI-LBPRGKRZSA-N	-1	0	283.280	2.162	10	5		CEBERM
CCO[C@H](CCOc1cc([N+](=O)[O-])ccc1C)C(=O)[O-]	ZINC000062763767	520512833	/nfs/dbraw/zinc/51/28/33/520512833.db2.gz	TUZABCNUFNBTHU-LLVKDONJSA-N	-1	0	283.280	2.162	10	5		CEBERM
CCN(c1cc(F)ccc1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061171417	521478933	/nfs/dbraw/zinc/47/89/33/521478933.db2.gz	RVXIPJMZKFIZHE-UHFFFAOYSA-N	-1	0	270.260	2.423	10	5		CEBERM
CC[C@@H](C(=O)[O-])N(C)c1cc(F)ccc1[N+](=O)[O-]	ZINC000052099802	521881442	/nfs/dbraw/zinc/88/14/42/521881442.db2.gz	RXJNCFGSZVLEEW-QMMMGPOBSA-N	-1	0	256.233	2.033	10	5		CEBERM
C[C@H]1CN(c2ccc([N+](=O)[O-])cc2C(=O)[O-])CC(C)(C)O1	ZINC000045696343	524670902	/nfs/dbraw/zinc/67/09/02/524670902.db2.gz	OKVOQQQUGJONGR-VIFPVBQESA-N	-1	0	294.307	2.297	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1N1CCCC[C@@H]1CC(=O)[O-]	ZINC000052812070	525574923	/nfs/dbraw/zinc/57/49/23/525574923.db2.gz	UMPGHBVOESECKS-SNVBAGLBSA-N	-1	0	279.296	2.132	10	5		CEBERM
Cc1c(Cl)c(C(=O)[O-])nn1-c1ccccc1[N+](=O)[O-]	ZINC000049899295	525743812	/nfs/dbraw/zinc/74/38/12/525743812.db2.gz	RYGICBIWZJBQTH-UHFFFAOYSA-N	-1	0	281.655	2.441	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc2cc([N+](=O)[O-])ccc2n1)C1CC1	ZINC000054521898	527655568	/nfs/dbraw/zinc/65/55/68/527655568.db2.gz	YOXRRLIBVUSAAR-ZDUSSCGKSA-N	-1	0	287.275	2.418	10	5		CEBERM
Cc1cc([N+](=O)[O-])cc(C(=O)[O-])c1Br	ZINC000090367264	344138850	/nfs/dbraw/zinc/13/88/50/344138850.db2.gz	WQSNSIDIZKPPSS-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
O=C([O-])c1c(F)ccc(Br)c1[N+](=O)[O-]	ZINC000306670656	344716282	/nfs/dbraw/zinc/71/62/82/344716282.db2.gz	DBJBNKLMPBLRPM-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
CCOC(=O)[C@@H]1CCCCN1c1ccc([N+](=O)[O-])c([O-])c1	ZINC000584653835	344974071	/nfs/dbraw/zinc/97/40/71/344974071.db2.gz	HJXOELHDWOPTHT-LBPRGKRZSA-N	-1	0	294.307	2.222	10	5		CEBERM
C[C@@H](CSCc1nc2ccccn2c1[N+](=O)[O-])C(=O)[O-]	ZINC000086108208	179231349	/nfs/dbraw/zinc/23/13/49/179231349.db2.gz	AOSXCHQGQYWSTH-QMMMGPOBSA-N	-1	0	295.320	2.196	10	5		CEBERM
O=C([O-])c1ccc(O[C@H]2CCCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000088762757	179668339	/nfs/dbraw/zinc/66/83/39/179668339.db2.gz	JGQWCKZEIVEIGA-YPMHNXCESA-N	-1	0	295.291	2.365	10	5		CEBERM
C[C@@H](CC(=O)[O-])Sc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000090098761	179914373	/nfs/dbraw/zinc/91/43/73/179914373.db2.gz	LTGDFNKJCHYFGQ-ZETCQYMHSA-N	-1	0	299.304	2.321	10	5		CEBERM
O=C([O-])c1cncc(Oc2cc(F)c([N+](=O)[O-])cc2F)n1	ZINC000091417556	180150213	/nfs/dbraw/zinc/15/02/13/180150213.db2.gz	FPLDUZPZLZLOLP-UHFFFAOYSA-N	-1	0	297.173	2.154	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCC[C@@H]1C(=O)[O-]	ZINC000091555894	180190262	/nfs/dbraw/zinc/19/02/62/180190262.db2.gz	OXGRQCNOHNIGBN-VHSXEESVSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCC[C@@H](CNc1c([N+](=O)[O-])c(C)nn1CC)C(=O)[O-]	ZINC000091549775	180188674	/nfs/dbraw/zinc/18/86/74/180188674.db2.gz	HNMDYWPCDWYLHT-VIFPVBQESA-N	-1	0	284.316	2.032	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1Oc1cccnc1C(=O)[O-]	ZINC000091550096	180189110	/nfs/dbraw/zinc/18/91/10/180189110.db2.gz	PRBYWEFPSFARDD-UHFFFAOYSA-N	-1	0	292.251	2.005	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])C(=O)c1cc(F)ccc1[N+](=O)[O-]	ZINC000092447590	180386982	/nfs/dbraw/zinc/38/69/82/180386982.db2.gz	YEEQLPSHAALEBF-UHFFFAOYSA-N	-1	0	298.270	2.059	10	5		CEBERM
Cc1nn(C)c(Nc2ccc(C)c(C(=O)[O-])c2)c1[N+](=O)[O-]	ZINC000110989311	186340469	/nfs/dbraw/zinc/34/04/69/186340469.db2.gz	RDYFUAREPUEWPY-UHFFFAOYSA-N	-1	0	290.279	2.387	10	5		CEBERM
CCCOc1cc(-n2cc(C(=O)[O-])cn2)ccc1[N+](=O)[O-]	ZINC000111053925	186348472	/nfs/dbraw/zinc/34/84/72/186348472.db2.gz	VLZWEVFNDZELJZ-UHFFFAOYSA-N	-1	0	291.263	2.268	10	5		CEBERM
Cc1c(I)ccc([O-])c1[N+](=O)[O-]	ZINC000575447884	366289674	/nfs/dbraw/zinc/28/96/74/366289674.db2.gz	ZBWYCBJBOZGHQE-UHFFFAOYSA-N	-1	0	279.033	2.213	10	5		CEBERM
Cc1cc(OC(F)(F)F)cc([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575673641	366325230	/nfs/dbraw/zinc/32/52/30/366325230.db2.gz	LURAFMZAKIUMSC-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
CCc1ccc(OC(F)F)c(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575658795	366318852	/nfs/dbraw/zinc/31/88/52/366318852.db2.gz	INSIMIYYFKIIMY-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1cc(F)c([N+](=O)[O-])c(OC(F)F)c1	ZINC000575661038	366321361	/nfs/dbraw/zinc/32/13/61/366321361.db2.gz	GMWXNAQEIFACGB-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])c1ccc(OC(F)F)c(F)c1[N+](=O)[O-]	ZINC000575660897	366321642	/nfs/dbraw/zinc/32/16/42/366321642.db2.gz	CLPDVZWSFKBLMR-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
COc1cc([S-])cc([N+](=O)[O-])c1OC(F)F	ZINC000575665216	366322406	/nfs/dbraw/zinc/32/24/06/366322406.db2.gz	PFLGCHJEDLITBO-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
O=[N+]([O-])c1c([O-])c(I)ccc1F	ZINC000575707403	366339217	/nfs/dbraw/zinc/33/92/17/366339217.db2.gz	YWEGJIBPSKTUIZ-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(C(F)(F)F)cc([N+](=O)[O-])c1Cl	ZINC000575696706	366332306	/nfs/dbraw/zinc/33/23/06/366332306.db2.gz	ZAOVAJCTYBDFDZ-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)Cc1cc([O-])c([N+](=O)[O-])c(Cl)c1	ZINC000575701437	366333436	/nfs/dbraw/zinc/33/34/36/366333436.db2.gz	ZIQPQNDRXDHKCG-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
CCOC(=O)Cc1cc([N+](=O)[O-])c([O-])cc1Cl	ZINC000575699950	366333603	/nfs/dbraw/zinc/33/36/03/366333603.db2.gz	FMYQXEVAWUNBOS-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
CCOC(=O)Cc1cc([O-])c([N+](=O)[O-])cc1Cl	ZINC000575699966	366334159	/nfs/dbraw/zinc/33/41/59/366334159.db2.gz	FRWHXWYJUJELED-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
O=[N+]([O-])c1ccc(I)c([O-])c1F	ZINC000575706958	366337622	/nfs/dbraw/zinc/33/76/22/366337622.db2.gz	COTMZWSJIOBCAV-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
O=C([O-])C1CCN(c2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000095078020	295983887	/nfs/dbraw/zinc/98/38/87/295983887.db2.gz	XXOBXJSYEYSCHH-UHFFFAOYSA-N	-1	0	291.263	2.037	10	5		CEBERM
O=C([O-])c1ccc(COc2ccc([N+](=O)[O-])c(F)c2)nc1	ZINC000094756528	184854074	/nfs/dbraw/zinc/85/40/74/184854074.db2.gz	HZQWPPOHAXHDGD-UHFFFAOYSA-N	-1	0	292.222	2.406	10	5		CEBERM
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)NCCCC(=O)[O-]	ZINC000263064899	154010866	/nfs/dbraw/zinc/01/08/66/154010866.db2.gz	PBKNORLEFCKPBH-UHFFFAOYSA-N	-1	0	299.258	2.029	10	5		CEBERM
CCOc1ccc(NC(=O)CCCC(=O)[O-])c([N+](=O)[O-])c1	ZINC000006047878	170171669	/nfs/dbraw/zinc/17/16/69/170171669.db2.gz	LYLYLEYGKDPXQO-UHFFFAOYSA-N	-1	0	296.279	2.187	10	5		CEBERM
CC[C@H](C)[C@H](NC(=O)c1cccc(C)c1[N+](=O)[O-])C(=O)[O-]	ZINC000019269174	170766200	/nfs/dbraw/zinc/76/62/00/170766200.db2.gz	KUZOELBXGKDIAD-KWQFWETISA-N	-1	0	294.307	2.132	10	5		CEBERM
Cc1cc(O[C@H](C(=O)[O-])C(C)C)ccc1[N+](=O)[O-]	ZINC000019409432	170788628	/nfs/dbraw/zinc/78/86/28/170788628.db2.gz	CSADNCHXYNQUTI-NSHDSACASA-N	-1	0	253.254	2.391	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1NCCCCC(=O)[O-]	ZINC000020474562	171218626	/nfs/dbraw/zinc/21/86/26/171218626.db2.gz	JXWVYLHFUVRNTP-UHFFFAOYSA-N	-1	0	268.269	2.270	10	5		CEBERM
O=C([O-])CCSCc1cc(F)ccc1[N+](=O)[O-]	ZINC000035307907	172120717	/nfs/dbraw/zinc/12/07/17/172120717.db2.gz	FZPVWFQKBAYQKD-UHFFFAOYSA-N	-1	0	259.258	2.442	10	5		CEBERM
O=C([O-])c1ccn(-c2cc(Cl)ccc2[N+](=O)[O-])n1	ZINC000037291140	173096850	/nfs/dbraw/zinc/09/68/50/173096850.db2.gz	QAUDZJHNZAXFLB-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
O=C([O-])c1ccc(Sc2ccc([N+](=O)[O-])cc2)nn1	ZINC000037527354	173251176	/nfs/dbraw/zinc/25/11/76/173251176.db2.gz	GLPUSSIGVZWNRR-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
O=C([O-])c1ccnc(Oc2ccc([N+](=O)[O-])cc2)c1	ZINC000037979859	173938898	/nfs/dbraw/zinc/93/88/98/173938898.db2.gz	RAKWEGXVPGEEDW-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccncc1[N+](=O)[O-])C1CCCCC1	ZINC000038037096	174036848	/nfs/dbraw/zinc/03/68/48/174036848.db2.gz	SGFXWAOLNYOAKT-LBPRGKRZSA-N	-1	0	279.296	2.435	10	5		CEBERM
CCN(CC)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043386678	175032480	/nfs/dbraw/zinc/03/24/80/175032480.db2.gz	OXGXRAXUVXLGLL-UHFFFAOYSA-N	-1	0	252.270	2.448	10	5		CEBERM
CCN(c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C)[C@H](C)COC	ZINC000043387235	175032715	/nfs/dbraw/zinc/03/27/15/175032715.db2.gz	WYSURHSMNYVBND-SECBINFHSA-N	-1	0	296.323	2.463	10	5		CEBERM
Cc1cc(CNc2ccc([N+](=O)[O-])c(C(=O)[O-])c2)on1	ZINC000045010880	175290078	/nfs/dbraw/zinc/29/00/78/175290078.db2.gz	WYPYDKHOEKBFQQ-UHFFFAOYSA-N	-1	0	277.236	2.202	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000070555474	175983877	/nfs/dbraw/zinc/98/38/77/175983877.db2.gz	LYQCVISFTZBDIF-VXNVDRBHSA-N	-1	0	298.320	2.030	10	5		CEBERM
CC(C)(C)c1nc(C(=O)[O-])nn1-c1ccc([N+](=O)[O-])cc1	ZINC000536959628	330383994	/nfs/dbraw/zinc/38/39/94/330383994.db2.gz	PLOYSMOMQOTVHW-UHFFFAOYSA-N	-1	0	290.279	2.171	10	5		CEBERM
CCO[C@H](COc1cc(Cl)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000062763105	520520812	/nfs/dbraw/zinc/52/08/12/520520812.db2.gz	UPUUPEXWXTXFIB-SNVBAGLBSA-N	-1	0	289.671	2.117	10	5		CEBERM
CC[C@@H](Oc1cc(C)c([N+](=O)[O-])cc1C)C(=O)[O-]	ZINC000061192022	523035802	/nfs/dbraw/zinc/03/58/02/523035802.db2.gz	HXQVPSYQEVIAQZ-SNVBAGLBSA-N	-1	0	253.254	2.454	10	5		CEBERM
CN(c1cc(F)ccc1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061171131	523632522	/nfs/dbraw/zinc/63/25/22/523632522.db2.gz	BYTCRELCTBQYPB-UHFFFAOYSA-N	-1	0	256.233	2.033	10	5		CEBERM
C[C@H]1CSCCN1c1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000070222703	524755977	/nfs/dbraw/zinc/75/59/77/524755977.db2.gz	LZBFFUZRSZQOTL-QMMMGPOBSA-N	-1	0	282.321	2.235	10	5		CEBERM
C[C@]1(C(=O)[O-])CCCN(c2cccc([N+](=O)[O-])c2)C1	ZINC000062874546	525228661	/nfs/dbraw/zinc/22/86/61/525228661.db2.gz	JKFYVSYCPWSBKT-ZDUSSCGKSA-N	-1	0	264.281	2.286	10	5		CEBERM
Cc1c(N(CC(=O)[O-])CC(C)C)cccc1[N+](=O)[O-]	ZINC000062742548	525816869	/nfs/dbraw/zinc/81/68/69/525816869.db2.gz	OAGSJMHMGGFQFD-UHFFFAOYSA-N	-1	0	266.297	2.450	10	5		CEBERM
O=C([O-])[C@H](Nc1cc(F)cc([N+](=O)[O-])c1)C1CC1	ZINC000054505839	526314138	/nfs/dbraw/zinc/31/41/38/526314138.db2.gz	MCUPEDBEACVPMO-SNVBAGLBSA-N	-1	0	254.217	2.009	10	5		CEBERM
O=C([O-])[C@]1(Cc2ccc(Cl)cc2[N+](=O)[O-])CCOC1	ZINC000054634411	526337365	/nfs/dbraw/zinc/33/73/65/526337365.db2.gz	SCGHFZHCAIYRJX-LBPRGKRZSA-N	-1	0	285.683	2.282	10	5		CEBERM
O=C([O-])c1cc(N2CCC[C@H]2CCCO)ccc1[N+](=O)[O-]	ZINC000052763846	526348909	/nfs/dbraw/zinc/34/89/09/526348909.db2.gz	CWPBORDUDLTRNX-JTQLQIEISA-N	-1	0	294.307	2.034	10	5		CEBERM
O=C([O-])c1ccc([S@@](=O)Cc2ccccc2[N+](=O)[O-])o1	ZINC000069364040	526384990	/nfs/dbraw/zinc/38/49/90/526384990.db2.gz	VEHVIYQIJFKULS-HXUWFJFHSA-N	-1	0	295.272	2.194	10	5		CEBERM
O=C([O-])CC[C@H]1CCCCN1c1ccc([N+](=O)[O-])nc1	ZINC000050923872	527600242	/nfs/dbraw/zinc/60/02/42/527600242.db2.gz	OTCDQFBASJXWEP-SNVBAGLBSA-N	-1	0	279.296	2.214	10	5		CEBERM
O=C([O-])CC[C@H]1CCCCN1c1ncccc1[N+](=O)[O-]	ZINC000050923509	527600374	/nfs/dbraw/zinc/60/03/74/527600374.db2.gz	BTVMREMLKNBUHU-SNVBAGLBSA-N	-1	0	279.296	2.214	10	5		CEBERM
CCCC[C@@H](Nc1c([N+](=O)[O-])nc(C)n1CC)C(=O)[O-]	ZINC000261717402	629147282	/nfs/dbraw/zinc/14/72/82/629147282.db2.gz	JZMAXWQLLJYTDS-SECBINFHSA-N	-1	0	284.316	2.175	10	5		CEBERM
CCC[C@H](NC(=O)c1cc(F)cc(C)c1[N+](=O)[O-])C(=O)[O-]	ZINC000237010022	629250107	/nfs/dbraw/zinc/25/01/07/629250107.db2.gz	KUSIAAYFTQKMKS-JTQLQIEISA-N	-1	0	298.270	2.025	10	5		CEBERM
C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)CCS1	ZINC000137189433	344386971	/nfs/dbraw/zinc/38/69/71/344386971.db2.gz	CEGFKGVBXYNEQY-QMMMGPOBSA-N	-1	0	282.321	2.235	10	5		CEBERM
Cc1cc(N[C@H]2CCO[C@@H]2C)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000592973981	345417744	/nfs/dbraw/zinc/41/77/44/345417744.db2.gz	QMFRITJVUMDKLG-SCZZXKLOSA-N	-1	0	280.280	2.191	10	5		CEBERM
CCN(c1c([N+](=O)[O-])c(C)nn1C(C)C)[C@@H](C)CC(=O)[O-]	ZINC000097127992	185542489	/nfs/dbraw/zinc/54/24/89/185542489.db2.gz	ZJPZNVCOIKAWHY-VIFPVBQESA-N	-1	0	298.343	2.370	10	5		CEBERM
COc1cc(N[C@@H]2CCC[C@@H]2C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000085328942	179019719	/nfs/dbraw/zinc/01/97/19/179019719.db2.gz	YFHJOEAJMZVIPK-IONNQARKSA-N	-1	0	298.270	2.408	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1N1CCCC[C@H]1CCO	ZINC000019845258	136579265	/nfs/dbraw/zinc/57/92/65/136579265.db2.gz	IHXYKMUHKHIJOU-JTQLQIEISA-N	-1	0	294.307	2.034	10	5		CEBERM
C[C@H](CCC[C@@H](C)C(=O)[O-])Nc1ncc([N+](=O)[O-])cn1	ZINC000087674294	179468253	/nfs/dbraw/zinc/46/82/53/179468253.db2.gz	DRDKOPBUMWLVDK-RKDXNWHRSA-N	-1	0	282.300	2.076	10	5		CEBERM
Cc1cnc(N[C@@H]2CCCC[C@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691782	180024896	/nfs/dbraw/zinc/02/48/96/180024896.db2.gz	OFNZILNPZPCISF-NXEZZACHSA-N	-1	0	279.296	2.354	10	5		CEBERM
CCCc1nn(C)c(NC[C@@H](C(=O)[O-])C(C)C)c1[N+](=O)[O-]	ZINC000091560771	180192171	/nfs/dbraw/zinc/19/21/71/180192171.db2.gz	FOPVDTASMWSXFP-SECBINFHSA-N	-1	0	298.343	2.050	10	5		CEBERM
CC(C)c1nn(C)c(N[C@H]2CC[C@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000091577855	180197705	/nfs/dbraw/zinc/19/77/05/180197705.db2.gz	RMKNNFFLBMEFOW-IUCAKERBSA-N	-1	0	296.327	2.117	10	5		CEBERM
CCOC(OCC)C(=O)C=C([O-])c1ccccc1[N+](=O)[O-]	ZINC000106606438	186128923	/nfs/dbraw/zinc/12/89/23/186128923.db2.gz	LOKGYUABHAXDPH-UHFFFAOYSA-N	-1	0	295.291	2.136	10	5		CEBERM
Cc1nn(-c2nc(Cl)ccc2C(=O)[O-])c(C)c1[N+](=O)[O-]	ZINC000109597660	186265731	/nfs/dbraw/zinc/26/57/31/186265731.db2.gz	QLHAPXKXYURFGJ-UHFFFAOYSA-N	-1	0	296.670	2.144	10	5		CEBERM
O=C([O-])c1cncc(OCc2cc(F)ccc2[N+](=O)[O-])c1	ZINC000111685160	186441338	/nfs/dbraw/zinc/44/13/38/186441338.db2.gz	AKEZSZRGSXLVRM-UHFFFAOYSA-N	-1	0	292.222	2.406	10	5		CEBERM
CCCC[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000159427229	188425362	/nfs/dbraw/zinc/42/53/62/188425362.db2.gz	KYMMFSOTYXJTPY-SNVBAGLBSA-N	-1	0	298.270	2.107	10	5		CEBERM
CC[C@@H](CC(=O)c1cccc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000675073473	540115160	/nfs/dbraw/zinc/11/51/60/540115160.db2.gz	JRDNTVKIPBGFTI-QMMMGPOBSA-N	-1	0	251.238	2.278	10	5		CEBERM
Cc1c([C@H](O)C(=O)[O-])cc([N+](=O)[O-])cc1C(F)(F)F	ZINC000575673140	366323581	/nfs/dbraw/zinc/32/35/81/366323581.db2.gz	CITPSPYJKSJLGJ-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCOc1c(OC(F)F)ccc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575657503	366316614	/nfs/dbraw/zinc/31/66/14/366316614.db2.gz	NROQGUFINDXWMH-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1c(OC(F)F)cc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000575658777	366319081	/nfs/dbraw/zinc/31/90/81/366319081.db2.gz	WALYIGGPEJXODC-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
CCOc1cc([N+](=O)[O-])c(C(=O)[O-])cc1OC(F)F	ZINC000575659780	366320390	/nfs/dbraw/zinc/32/03/90/366320390.db2.gz	YZZWSGLRKOQWNM-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
O=C([O-])c1c(OC(F)F)ccc([N+](=O)[O-])c1F	ZINC000575661084	366321660	/nfs/dbraw/zinc/32/16/60/366321660.db2.gz	IKZXINBSJCDLQH-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])c1ccc(F)c(C(F)(F)F)c1[N+](=O)[O-]	ZINC000575710916	366339161	/nfs/dbraw/zinc/33/91/61/366339161.db2.gz	LWASERPSNIJBAC-UHFFFAOYSA-N	-1	0	253.107	2.451	10	5		CEBERM
CC(=O)c1c([O-])cc(Br)cc1[N+](=O)[O-]	ZINC000575690725	366329993	/nfs/dbraw/zinc/32/99/93/366329993.db2.gz	ACDHKLIHGRUEMV-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
CC(=O)c1cc([O-])c([N+](=O)[O-])cc1Br	ZINC000575690767	366330562	/nfs/dbraw/zinc/33/05/62/366330562.db2.gz	AQOFKQHFMWIMEQ-UHFFFAOYSA-N	-1	0	260.043	2.266	10	5		CEBERM
O=C([O-])C[C@@H]1CCCCN1C(=O)c1ccccc1[N+](=O)[O-]	ZINC000038026164	304074903	/nfs/dbraw/zinc/07/49/03/304074903.db2.gz	QRVNKNNVMDDFPJ-JTQLQIEISA-N	-1	0	292.291	2.064	10	5		CEBERM
O=C([O-])[C@@H]1CCCN(c2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000095077971	304110833	/nfs/dbraw/zinc/11/08/33/304110833.db2.gz	VWCKLTBBDMMBLM-MRVPVSSYSA-N	-1	0	291.263	2.037	10	5		CEBERM
O=c1c([N+](=O)[O-])c[n-]c2ccc(Br)nc12	ZINC000096032521	364397765	/nfs/dbraw/zinc/39/77/65/364397765.db2.gz	ZYBSJYQKQVLHSP-UHFFFAOYSA-N	-1	0	270.042	2.006	10	5		CEBERM
CC[C@H](C)[S@](=O)C=C([O-])c1cccc([N+](=O)[O-])c1	ZINC000081915466	177892466	/nfs/dbraw/zinc/89/24/66/177892466.db2.gz	VOUVBYNBYIZHBW-YYSFKGJASA-N	-1	0	269.322	2.325	10	5		CEBERM
O=C([O-])c1ccc(COc2ccc([N+](=O)[O-])cc2)nc1	ZINC000094755967	184853432	/nfs/dbraw/zinc/85/34/32/184853432.db2.gz	KRKCHLFVVQMQEB-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N1CCCC[C@H]1C(=O)[O-]	ZINC000037371645	134840946	/nfs/dbraw/zinc/84/09/46/134840946.db2.gz	FDBDLBMTNXUXAD-LBPRGKRZSA-N	-1	0	264.281	2.347	10	5		CEBERM
O=C([O-])Cc1cc(OC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000575338347	395659825	/nfs/dbraw/zinc/65/98/25/395659825.db2.gz	GUAKKIAQFMGQDA-UHFFFAOYSA-N	-1	0	265.143	2.121	10	5		CEBERM
COc1cc(C(=O)[O-])c([N+](=O)[O-])cc1OC(C)C	ZINC000037226502	173046310	/nfs/dbraw/zinc/04/63/10/173046310.db2.gz	DGWUAQWPAOFKAM-UHFFFAOYSA-N	-1	0	255.226	2.089	10	5		CEBERM
CCN(CC(=O)[O-])c1ccc([N+](=O)[O-])c2cccnc21	ZINC000038017278	173991175	/nfs/dbraw/zinc/99/11/75/173991175.db2.gz	OBBXLXNIMXUNBG-UHFFFAOYSA-N	-1	0	275.264	2.054	10	5		CEBERM
CCNc1ncnc([N-]c2cccc(C)n2)c1[N+](=O)[O-]	ZINC000040584534	174345782	/nfs/dbraw/zinc/34/57/82/174345782.db2.gz	SLRHWXSSXDXNAP-UHFFFAOYSA-N	-1	0	274.284	2.264	10	5		CEBERM
O=C([O-])C[C@@H]1CCCN1c1cc(F)cc([N+](=O)[O-])c1	ZINC000042161915	174644864	/nfs/dbraw/zinc/64/48/64/174644864.db2.gz	XIWGATLGOLGPJU-VIFPVBQESA-N	-1	0	268.244	2.177	10	5		CEBERM
Cc1c(N(C)C2CCOCC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043387015	175032649	/nfs/dbraw/zinc/03/26/49/175032649.db2.gz	NEJNSPGKQASFPV-UHFFFAOYSA-N	-1	0	294.307	2.217	10	5		CEBERM
Cn1cc(Sc2ccc([N+](=O)[O-])cc2C(=O)[O-])cn1	ZINC000048772228	175447829	/nfs/dbraw/zinc/44/78/29/175447829.db2.gz	XTJFHYRLMJSEKT-UHFFFAOYSA-N	-1	0	279.277	2.178	10	5		CEBERM
Cc1ccnc(N[C@H](CC(C)C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000070495591	175957098	/nfs/dbraw/zinc/95/70/98/175957098.db2.gz	OFPYCKNCHPRKDV-SECBINFHSA-N	-1	0	267.285	2.209	10	5		CEBERM
O=C([O-])C1CN(c2ccc([N+](=O)[O-])cc2C(F)F)C1	ZINC000071173458	176053291	/nfs/dbraw/zinc/05/32/91/176053291.db2.gz	SLKWZZCSRZHOSS-UHFFFAOYSA-N	-1	0	272.207	2.053	10	5		CEBERM
CC[C@H](CCNC(=O)c1ccc([N+](=O)[O-])o1)CCC(=O)[O-]	ZINC000079195992	177442694	/nfs/dbraw/zinc/44/26/94/177442694.db2.gz	NTDGBSIJTVYWCZ-VIFPVBQESA-N	-1	0	298.295	2.199	10	5		CEBERM
C[C@]1(C(=O)[O-])CCCN1c1ccc(F)cc1[N+](=O)[O-]	ZINC000079485413	177502138	/nfs/dbraw/zinc/50/21/38/177502138.db2.gz	WSGIJHLLFUSBON-GFCCVEGCSA-N	-1	0	268.244	2.177	10	5		CEBERM
CC[C@@H](COC)Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000079768761	177553169	/nfs/dbraw/zinc/55/31/69/177553169.db2.gz	ZEVWCNZRZXLIEM-VIFPVBQESA-N	-1	0	268.269	2.130	10	5		CEBERM
COCC[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000052786153	521978755	/nfs/dbraw/zinc/97/87/55/521978755.db2.gz	DWNYBCUENMLRKR-JTQLQIEISA-N	-1	0	288.687	2.150	10	5		CEBERM
COCCN(c1cc(C(=O)[O-])c([N+](=O)[O-])cc1F)C1CC1	ZINC000050031225	523783078	/nfs/dbraw/zinc/78/30/78/523783078.db2.gz	HYHJSWGOYPXXEN-UHFFFAOYSA-N	-1	0	298.270	2.047	10	5		CEBERM
Cc1cc(NC(=O)N(C)C(C)(C)C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000061176683	525167900	/nfs/dbraw/zinc/16/79/00/525167900.db2.gz	DWFULIXEFIFGAV-UHFFFAOYSA-N	-1	0	295.295	2.230	10	5		CEBERM
Cc1ccn(-c2cc(C(=O)[O-])cc([N+](=O)[O-])c2C)n1	ZINC000052855921	525555293	/nfs/dbraw/zinc/55/52/93/525555293.db2.gz	ZJMZCZIFHKYKGS-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
Cc1c(N(C)C(C)(C)C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000062723587	525816141	/nfs/dbraw/zinc/81/61/41/525816141.db2.gz	XBGIVJNFNSSIQB-UHFFFAOYSA-N	-1	0	252.270	2.203	10	5		CEBERM
Cc1nn(CCc2ccccc2[N+](=O)[O-])c(C)c1C(=O)[O-]	ZINC000062726739	526282626	/nfs/dbraw/zinc/28/26/26/526282626.db2.gz	HWAFKSWVQKDMLO-UHFFFAOYSA-N	-1	0	289.291	2.349	10	5		CEBERM
O=C([O-])c1ccc(NCc2ccccc2[N+](=O)[O-])o1	ZINC000050909517	526379518	/nfs/dbraw/zinc/37/95/18/526379518.db2.gz	UVQQKLLMNXGHIJ-UHFFFAOYSA-N	-1	0	262.221	2.498	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc2scnc2c1[N+](=O)[O-])C1CC1	ZINC000054521944	527655937	/nfs/dbraw/zinc/65/59/37/527655937.db2.gz	MSAHZAGYPQNPGD-VIFPVBQESA-N	-1	0	293.304	2.480	10	5		CEBERM
Cc1cc([N-]c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])nn1C	ZINC000092826153	344205274	/nfs/dbraw/zinc/20/52/74/344205274.db2.gz	ZGXNVKLEIQSRAT-UHFFFAOYSA-N	-1	0	277.240	2.289	10	5		CEBERM
O=c1[nH][nH]c(=O)c2cc3c(cccc3[N+](=O)[O-])cc12	ZINC000584639776	344971832	/nfs/dbraw/zinc/97/18/32/344971832.db2.gz	OBQIRLJAYMNOLL-UHFFFAOYSA-N	-1	0	257.205	2.102	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1	ZINC000085328639	179019132	/nfs/dbraw/zinc/01/91/32/179019132.db2.gz	CVQZOJKHRFYTHG-GHMZBOCLSA-N	-1	0	250.254	2.260	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000085328411	179019287	/nfs/dbraw/zinc/01/92/87/179019287.db2.gz	FBZOCEYDIPACNE-IUCAKERBSA-N	-1	0	295.251	2.168	10	5		CEBERM
COc1ccc(N[C@H]2CCC[C@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000085329206	179019935	/nfs/dbraw/zinc/01/99/35/179019935.db2.gz	XEHFJTXRXSHRND-ZJUUUORDSA-N	-1	0	280.280	2.269	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@H]1Nc1ncccc1[N+](=O)[O-]	ZINC000085330298	179020396	/nfs/dbraw/zinc/02/03/96/179020396.db2.gz	YFXBALKIJJTQON-DTWKUNHWSA-N	-1	0	265.269	2.045	10	5		CEBERM
CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c([O-])c1)C(C)C	ZINC000066326292	362860931	/nfs/dbraw/zinc/86/09/31/362860931.db2.gz	VLOQMJOJYFGDBB-SNVBAGLBSA-N	-1	0	266.297	2.465	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N1C[C@H](C)[C@H](C(=O)[O-])C1	ZINC000104188572	185920046	/nfs/dbraw/zinc/92/00/46/185920046.db2.gz	HVUFBIKLKIEWNG-GXSJLCMTSA-N	-1	0	264.281	2.060	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])nc1	ZINC000089381940	179775434	/nfs/dbraw/zinc/77/54/34/179775434.db2.gz	DDRPBWUGDHGNPH-ONGXEEELSA-N	-1	0	279.296	2.293	10	5		CEBERM
C[C@H](Nc1ccncc1[N+](=O)[O-])c1nc(C(=O)[O-])cs1	ZINC000090943278	180068896	/nfs/dbraw/zinc/06/88/96/180068896.db2.gz	HIPVNBNXHSPMRX-LURJTMIESA-N	-1	0	294.292	2.318	10	5		CEBERM
CC(C)c1nn(C)c(S[C@@H](C)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091578325	180198367	/nfs/dbraw/zinc/19/83/67/180198367.db2.gz	GSWUODRDIQNOCC-LURJTMIESA-N	-1	0	273.314	2.017	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@H](C(=O)[O-])C(C)C	ZINC000091554855	180189562	/nfs/dbraw/zinc/18/95/62/180189562.db2.gz	DRFCQYVDJRXFFX-VIFPVBQESA-N	-1	0	284.316	2.031	10	5		CEBERM
Cc1cc(Oc2cncc(C(=O)[O-])c2)ncc1[N+](=O)[O-]	ZINC000092048177	180311885	/nfs/dbraw/zinc/31/18/85/180311885.db2.gz	KCCDOVQFVFITNB-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
C[C@H]1CN(c2ccc(C(=O)[O-])cc2[N+](=O)[O-])C[C@H]1C	ZINC000092085930	180320231	/nfs/dbraw/zinc/32/02/31/180320231.db2.gz	QQRDITCBZLKJQF-DTORHVGOSA-N	-1	0	264.281	2.385	10	5		CEBERM
Cc1c(N[C@H](CO)C(C)C)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000092401341	180377784	/nfs/dbraw/zinc/37/77/84/180377784.db2.gz	XZMFVALKFJRUOM-LLVKDONJSA-N	-1	0	282.296	2.030	10	5		CEBERM
O=C([O-])CN(CC(F)(F)F)c1cc(F)ccc1[N+](=O)[O-]	ZINC000092436870	180385054	/nfs/dbraw/zinc/38/50/54/180385054.db2.gz	WCXRHDKKQYYCJQ-UHFFFAOYSA-N	-1	0	296.176	2.187	10	5		CEBERM
Cc1cccc(C(=O)N(CC(=O)[O-])C(C)(C)C)c1[N+](=O)[O-]	ZINC000092446719	180386251	/nfs/dbraw/zinc/38/62/51/180386251.db2.gz	BKJYGMXFWGQPKH-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
CC(C)c1c([O-])nc(-c2ccccc2[N+](=O)[O-])[nH]c1=O	ZINC000110620346	186305999	/nfs/dbraw/zinc/30/59/99/186305999.db2.gz	MXRDVIAQVJJPOG-UHFFFAOYSA-N	-1	0	275.264	2.174	10	5		CEBERM
O=C([O-])c1cccnc1NC(=O)c1ccc([N+](=O)[O-])s1	ZINC000110991466	186339705	/nfs/dbraw/zinc/33/97/05/186339705.db2.gz	JCMJSHORCDPUHP-UHFFFAOYSA-N	-1	0	293.260	2.002	10	5		CEBERM
Cc1cc(Br)c([N+](=O)[O-])cc1[S@](=O)[O-]	ZINC000675061635	540081056	/nfs/dbraw/zinc/08/10/56/540081056.db2.gz	LPRSXSKERJGLBE-UHFFFAOYSA-N	-1	0	280.099	2.246	10	5		CEBERM
O=C([O-])CCc1cc2c([nH]1)c([N+](=O)[O-])ccc2F	ZINC000575440506	366288660	/nfs/dbraw/zinc/28/86/60/366288660.db2.gz	MSIPJZKZKZUUNM-UHFFFAOYSA-N	-1	0	252.201	2.232	10	5		CEBERM
O=c1c2cccc(Br)c2[n-]nc1[N+](=O)[O-]	ZINC000575601136	366298825	/nfs/dbraw/zinc/29/88/25/366298825.db2.gz	KAUOGXOXNVAZQE-UHFFFAOYSA-N	-1	0	270.042	2.006	10	5		CEBERM
Cc1ccc(CC(=O)[O-])c(OC(F)F)c1[N+](=O)[O-]	ZINC000575667274	366323547	/nfs/dbraw/zinc/32/35/47/366323547.db2.gz	LKEAROYIPXCTGX-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
CCOc1cc(CC(=O)[O-])c([N+](=O)[O-])c(OC(F)F)c1	ZINC000575659797	366320243	/nfs/dbraw/zinc/32/02/43/366320243.db2.gz	ZPASLHAXSLQIMH-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
O=C([O-])c1ccc(OC(F)F)c([N+](=O)[O-])c1F	ZINC000575661075	366320823	/nfs/dbraw/zinc/32/08/23/366320823.db2.gz	IBPPQMOLLDXSET-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])c1c(OC(F)(F)F)ccc([N+](=O)[O-])c1F	ZINC000575711081	366340189	/nfs/dbraw/zinc/34/01/89/366340189.db2.gz	OLYRMZIMWLQBQG-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
CCOc1c([N+](=O)[O-])ccc(CC)c1CC(=O)[O-]	ZINC000575697008	366332697	/nfs/dbraw/zinc/33/26/97/366332697.db2.gz	QCMFHQNXAJSAAU-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
CCOC(=O)Cc1cc(Cl)c([N+](=O)[O-])cc1[O-]	ZINC000575700375	366334226	/nfs/dbraw/zinc/33/42/26/366334226.db2.gz	JCSWMEONAKRUIX-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
Nc1nc(N[C@@H](C(=O)[O-])C2CCCCC2)ccc1[N+](=O)[O-]	ZINC000094260909	184771108	/nfs/dbraw/zinc/77/11/08/184771108.db2.gz	ULNJOBYHEIYPHF-LLVKDONJSA-N	-1	0	294.311	2.017	10	5		CEBERM
Cc1cc(N(C)[C@H](C)C(=O)[O-])c2cccc([N+](=O)[O-])c2n1	ZINC000263510812	154110107	/nfs/dbraw/zinc/11/01/07/154110107.db2.gz	NJBMNLOVALGATE-SECBINFHSA-N	-1	0	289.291	2.361	10	5		CEBERM
CC[C@H](Oc1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000006048929	170172064	/nfs/dbraw/zinc/17/20/64/170172064.db2.gz	XTDHZWYAGSYQAB-QMMMGPOBSA-N	-1	0	259.645	2.490	10	5		CEBERM
O=C([O-])Cn1c2ccccc2c(=O)c2cc(F)ccc21	ZINC000006644364	170221483	/nfs/dbraw/zinc/22/14/83/170221483.db2.gz	BUIGGUVCWZQBED-UHFFFAOYSA-N	-1	0	271.247	2.378	10	5		CEBERM
Cc1c(-c2nnc(SCC(=O)[O-])o2)cccc1[N+](=O)[O-]	ZINC000020159317	171040197	/nfs/dbraw/zinc/04/01/97/171040197.db2.gz	ZLCDISAEUVFLFR-UHFFFAOYSA-N	-1	0	295.276	2.130	10	5		CEBERM
C[C@@H](CC(=O)[O-])Nc1ccc2scnc2c1[N+](=O)[O-]	ZINC000035344189	172136378	/nfs/dbraw/zinc/13/63/78/172136378.db2.gz	BUWGTMAUEYZLSL-LURJTMIESA-N	-1	0	281.293	2.480	10	5		CEBERM
O=C([O-])c1ccccc1OCc1ccc([N+](=O)[O-])o1	ZINC000037324060	173124951	/nfs/dbraw/zinc/12/49/51/173124951.db2.gz	JUACOJACYSRHLH-UHFFFAOYSA-N	-1	0	263.205	2.465	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N[C@H](C(=O)[O-])C(C)C	ZINC000037453251	173219204	/nfs/dbraw/zinc/21/92/04/173219204.db2.gz	AVRPUBSRTTYGKO-NSHDSACASA-N	-1	0	252.270	2.424	10	5		CEBERM
CCOc1ncnc([N-]c2cc(C)ccn2)c1[N+](=O)[O-]	ZINC000040588308	174345894	/nfs/dbraw/zinc/34/58/94/174345894.db2.gz	HPROKNVZYGNQLU-UHFFFAOYSA-N	-1	0	275.268	2.231	10	5		CEBERM
CC(C)Oc1ncnc([N-]c2nccs2)c1[N+](=O)[O-]	ZINC000040647806	174364913	/nfs/dbraw/zinc/36/49/13/174364913.db2.gz	ZGYNXZWJOSMLPX-UHFFFAOYSA-N	-1	0	281.297	2.372	10	5		CEBERM
COC(=O)CCSc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043387289	175032558	/nfs/dbraw/zinc/03/25/58/175032558.db2.gz	KXPYWWPYPNQOKS-UHFFFAOYSA-N	-1	0	299.304	2.257	10	5		CEBERM
O=C([O-])[C@@H]1CC[C@H](Cn2ccc3c2cccc3[N+](=O)[O-])O1	ZINC000071163706	176047165	/nfs/dbraw/zinc/04/71/65/176047165.db2.gz	WIQBDWBLDXJTMJ-RNCFNFMXSA-N	-1	0	290.275	2.182	10	5		CEBERM
Cc1cc(Oc2cnc(C(=O)[O-])cn2)ccc1[N+](=O)[O-]	ZINC000071182459	176057571	/nfs/dbraw/zinc/05/75/71/176057571.db2.gz	BJOXEOOFAAJNMF-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
O=[N+]([O-])c1cc(-c2n[nH]c(-c3ccco3)n2)ccc1[O-]	ZINC000072237676	176346601	/nfs/dbraw/zinc/34/66/01/176346601.db2.gz	OZAMYZDYWKADCY-UHFFFAOYSA-N	-1	0	272.220	2.346	10	5		CEBERM
CC(C)(C)c1nc(-c2cc([N+](=O)[O-])ccc2[O-])n[nH]1	ZINC000072237760	176346687	/nfs/dbraw/zinc/34/66/87/176346687.db2.gz	ONVVCDWEUCPFSL-UHFFFAOYSA-N	-1	0	262.269	2.383	10	5		CEBERM
CC(C)(C)c1nc(C(=O)[O-])nn1-c1cccc([N+](=O)[O-])c1	ZINC000536957939	330383601	/nfs/dbraw/zinc/38/36/01/330383601.db2.gz	GEIWHGGNVYCTSP-UHFFFAOYSA-N	-1	0	290.279	2.171	10	5		CEBERM
CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H](C)CC(=O)[O-]	ZINC000061181116	520001375	/nfs/dbraw/zinc/00/13/75/520001375.db2.gz	XREFLBKZRKNCBF-SECBINFHSA-N	-1	0	295.295	2.312	10	5		CEBERM
CN(C[C@@H]1CCCCO1)c1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070232472	523034674	/nfs/dbraw/zinc/03/46/74/523034674.db2.gz	HYMAGBXXRZLNTQ-NSHDSACASA-N	-1	0	294.307	2.298	10	5		CEBERM
CN(c1ccc2cc([N+](=O)[O-])ccc2n1)C(C)(C)C(=O)[O-]	ZINC000061171181	523644725	/nfs/dbraw/zinc/64/47/25/523644725.db2.gz	JAEWQYTVYXMDCB-UHFFFAOYSA-N	-1	0	289.291	2.442	10	5		CEBERM
Cc1ccc(NC(=O)C[C@@H](C)CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000061835746	525086801	/nfs/dbraw/zinc/08/68/01/525086801.db2.gz	CMKMKODJIXNDMO-SECBINFHSA-N	-1	0	280.280	2.343	10	5		CEBERM
Cc1ccc(OCc2csc(C(=O)[O-])n2)c([N+](=O)[O-])n1	ZINC000050440782	525446191	/nfs/dbraw/zinc/44/61/91/525446191.db2.gz	YTTOKUVALYKKLJ-UHFFFAOYSA-N	-1	0	295.276	2.032	10	5		CEBERM
O=C([O-])c1cc(NCc2nccs2)ccc1[N+](=O)[O-]	ZINC000049534899	526352338	/nfs/dbraw/zinc/35/23/38/526352338.db2.gz	VGBYHQXRKFLIDQ-UHFFFAOYSA-N	-1	0	279.277	2.362	10	5		CEBERM
Cc1nnc(Sc2cc(C(=O)[O-])c([N+](=O)[O-])cc2F)o1	ZINC000051037561	526390619	/nfs/dbraw/zinc/39/06/19/526390619.db2.gz	DYUWIHOQUVXIFB-UHFFFAOYSA-N	-1	0	299.239	2.275	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc([N+](=O)[O-])nc1)c1ccccc1	ZINC000050506963	527656047	/nfs/dbraw/zinc/65/60/47/527656047.db2.gz	OYGPCNQIVWQFBM-LBPRGKRZSA-N	-1	0	273.248	2.228	10	5		CEBERM
O=C([O-])c1c(Br)ccc(F)c1[N+](=O)[O-]	ZINC000307672826	344723826	/nfs/dbraw/zinc/72/38/26/344723826.db2.gz	XUOFZRSCPGKBBS-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
COc1cc(N[C@@H]2CCC[C@H]2C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000085328948	179019847	/nfs/dbraw/zinc/01/98/47/179019847.db2.gz	YFHJOEAJMZVIPK-VXNVDRBHSA-N	-1	0	298.270	2.408	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])nc1	ZINC000085330475	179020235	/nfs/dbraw/zinc/02/02/35/179020235.db2.gz	RHXKPYYELAJBIM-UWVGGRQHSA-N	-1	0	265.269	2.045	10	5		CEBERM
CCC[C@H](CNc1nccc(C)c1[N+](=O)[O-])C(=O)[O-]	ZINC000087512645	179437508	/nfs/dbraw/zinc/43/75/08/179437508.db2.gz	PROKAVVKBREYET-SECBINFHSA-N	-1	0	267.285	2.211	10	5		CEBERM
O=C([O-])Cn1nc(-c2ccccc2)c([N+](=O)[O-])c1Cl	ZINC000091561407	180191841	/nfs/dbraw/zinc/19/18/41/180191841.db2.gz	IZCIFWAMNCHJEZ-UHFFFAOYSA-N	-1	0	281.655	2.196	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@@H](Nc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000092182802	180339492	/nfs/dbraw/zinc/33/94/92/180339492.db2.gz	GYBAYRKGGVXWLH-VXNVDRBHSA-N	-1	0	266.228	2.175	10	5		CEBERM
CC[C@H](C(=O)[O-])N(C)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000110624920	186306777	/nfs/dbraw/zinc/30/67/77/186306777.db2.gz	TZVNDZPKSWWZOR-MRVPVSSYSA-N	-1	0	286.259	2.042	10	5		CEBERM
O=C([O-])c1cccnc1NC(=O)c1csc([N+](=O)[O-])c1	ZINC000110991818	186339998	/nfs/dbraw/zinc/33/99/98/186339998.db2.gz	IPZYQYHZUDOILI-UHFFFAOYSA-N	-1	0	293.260	2.002	10	5		CEBERM
O=C([O-])c1cc(Sc2cnccn2)ccc1[N+](=O)[O-]	ZINC000111235512	186372857	/nfs/dbraw/zinc/37/28/57/186372857.db2.gz	QAWSEXGHBHPMMJ-UHFFFAOYSA-N	-1	0	277.261	2.234	10	5		CEBERM
Cc1cc(OC(F)(F)F)c(CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000575673312	366323300	/nfs/dbraw/zinc/32/33/00/366323300.db2.gz	HDQCNAVEILGMLC-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
Cc1cc(C(F)(F)F)c([C@@H](O)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575675570	366325021	/nfs/dbraw/zinc/32/50/21/366325021.db2.gz	WHULWMBKXMPBIU-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCOc1cc(OC(F)F)c(CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000575659570	366320567	/nfs/dbraw/zinc/32/05/67/366320567.db2.gz	VYZBUQZFJWUSBZ-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
COc1cc(OC(F)F)c([N+](=O)[O-])cc1[S-]	ZINC000575665801	366322305	/nfs/dbraw/zinc/32/23/05/366322305.db2.gz	UMWOKLLKPQRWRW-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
O=C([O-])[C@H](O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1Cl	ZINC000575694959	366331035	/nfs/dbraw/zinc/33/10/35/366331035.db2.gz	OXFMBLQXNLXRQT-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCC[C@@H]1C[C@H]1NC(=O)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000233304363	370518171	/nfs/dbraw/zinc/51/81/71/370518171.db2.gz	LPVTZSQKAPNSPL-LDYMZIIASA-N	-1	0	264.281	2.219	10	5		CEBERM
O=C([O-])c1cc(F)c(Br)c([N+](=O)[O-])c1	ZINC000043578234	304224689	/nfs/dbraw/zinc/22/46/89/304224689.db2.gz	VNBUOQRPHGBTIQ-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1OCC(C)(C)C(=O)[O-]	ZINC000093703541	184707776	/nfs/dbraw/zinc/70/77/76/184707776.db2.gz	PDHXATCLOVULLD-UHFFFAOYSA-N	-1	0	253.254	2.393	10	5		CEBERM
CCOCCCC(=O)Nc1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000095034750	184919602	/nfs/dbraw/zinc/91/96/02/184919602.db2.gz	DTUADIMCSXVSMP-UHFFFAOYSA-N	-1	0	296.279	2.048	10	5		CEBERM
CCC[C@@H](Nc1ccc([N+](=O)[O-])c(C(C)=O)c1)C(=O)[O-]	ZINC000263539408	154122609	/nfs/dbraw/zinc/12/26/09/154122609.db2.gz	BQIACXJCBJGSFC-LLVKDONJSA-N	-1	0	280.280	2.463	10	5		CEBERM
CCC[C@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(=O)[O-]	ZINC000263564184	154125661	/nfs/dbraw/zinc/12/56/61/154125661.db2.gz	UROMQAJLISLHHL-VIFPVBQESA-N	-1	0	278.268	2.136	10	5		CEBERM
CCC[C@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000263566044	154128829	/nfs/dbraw/zinc/12/88/29/154128829.db2.gz	WDVCNENUJUUHKH-NSHDSACASA-N	-1	0	280.280	2.463	10	5		CEBERM
O=C([O-])[C@H]1C[C@@H]2CCCC[C@@H]2N1c1ccc([N+](=O)[O-])nc1	ZINC000019868373	170900236	/nfs/dbraw/zinc/90/02/36/170900236.db2.gz	AMEFCMDXBROEBQ-ZMLRMANQSA-N	-1	0	291.307	2.212	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1NCCCCC(=O)[O-]	ZINC000020474553	171218734	/nfs/dbraw/zinc/21/87/34/171218734.db2.gz	YWWQMHXPZUFGEB-UHFFFAOYSA-N	-1	0	268.269	2.270	10	5		CEBERM
CCc1c(C(=O)[O-])nnn1-c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000037291041	173096014	/nfs/dbraw/zinc/09/60/14/173096014.db2.gz	QNACCTZXFYBZTB-UHFFFAOYSA-N	-1	0	296.670	2.090	10	5		CEBERM
O=C([O-])c1ccc(Nc2ccncc2[N+](=O)[O-])cc1	ZINC000037453524	173218938	/nfs/dbraw/zinc/21/89/38/173218938.db2.gz	XCBKMGUPSLWCRY-UHFFFAOYSA-N	-1	0	259.221	2.432	10	5		CEBERM
C[C@H]1CCC[C@](Nc2ccncc2[N+](=O)[O-])(C(=O)[O-])C1	ZINC000041035195	174458315	/nfs/dbraw/zinc/45/83/15/174458315.db2.gz	AFERPGTXRRWAOV-TVQRCGJNSA-N	-1	0	279.296	2.435	10	5		CEBERM
COC[C@@H](C)Oc1ccc([N+](=O)[O-])cc1/C=C/C(=O)[O-]	ZINC000070376637	175900082	/nfs/dbraw/zinc/90/00/82/175900082.db2.gz	GOEQBKSDAOQMHC-BSPAPZMXSA-N	-1	0	281.264	2.106	10	5		CEBERM
CC[C@@H](Oc1cc([N+](=O)[O-])ccc1Cl)C(=O)[O-]	ZINC000078446042	177342442	/nfs/dbraw/zinc/34/24/42/177342442.db2.gz	DFUVNHILMGBILZ-MRVPVSSYSA-N	-1	0	259.645	2.490	10	5		CEBERM
Cc1nn(CCc2ccccc2[N+](=O)[O-])cc1C(=O)[O-]	ZINC000080044375	177600992	/nfs/dbraw/zinc/60/09/92/177600992.db2.gz	KRZMNJRDDQZIJX-UHFFFAOYSA-N	-1	0	275.264	2.041	10	5		CEBERM
CC(C)CN(CC(=O)[O-])c1ccc([N+](=O)[O-])cc1	ZINC000062742589	519712279	/nfs/dbraw/zinc/71/22/79/519712279.db2.gz	AAPKEEIUAIWGDZ-UHFFFAOYSA-N	-1	0	252.270	2.142	10	5		CEBERM
CCN(C(=O)c1cccc(C)c1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061149074	520097354	/nfs/dbraw/zinc/09/73/54/520097354.db2.gz	YSAJGYQDMARJRX-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCO[C@H](COc1ccc([N+](=O)[O-])c(Cl)c1)C(=O)[O-]	ZINC000062763253	520523901	/nfs/dbraw/zinc/52/39/01/520523901.db2.gz	OKVYCEAKRUANCF-SNVBAGLBSA-N	-1	0	289.671	2.117	10	5		CEBERM
CCO[C@H]1CCCN(c2cc([N+](=O)[O-])ccc2C(=O)[O-])C1	ZINC000070232696	520526842	/nfs/dbraw/zinc/52/68/42/520526842.db2.gz	VPRVFHWJRQHZQC-NSHDSACASA-N	-1	0	294.307	2.298	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])C(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000061215042	521197370	/nfs/dbraw/zinc/19/73/70/521197370.db2.gz	DRMBQHAGQOVBPP-SNVBAGLBSA-N	-1	0	294.307	2.086	10	5		CEBERM
CCC[C@]1(C(=O)[O-])CCCN(c2cc([N+](=O)[O-])ccn2)C1	ZINC000062875218	521302261	/nfs/dbraw/zinc/30/22/61/521302261.db2.gz	SEHNAZHFIAXMQB-AWEZNQCLSA-N	-1	0	293.323	2.461	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1OCCCCC(=O)[O-]	ZINC000050504940	522984376	/nfs/dbraw/zinc/98/43/76/522984376.db2.gz	QOLKHEQYBYPCDN-UHFFFAOYSA-N	-1	0	269.253	2.237	10	5		CEBERM
CO[C@H]1CCC[C@@H]1Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000050375435	523981438	/nfs/dbraw/zinc/98/14/38/523981438.db2.gz	YRQWMFRAKSOQFF-JQWIXIFHSA-N	-1	0	280.280	2.272	10	5		CEBERM
Cc1cc(CNc2cc(C(=O)[O-])c([N+](=O)[O-])cc2F)on1	ZINC000050032497	524786437	/nfs/dbraw/zinc/78/64/37/524786437.db2.gz	RELGKLIVGXIAMQ-UHFFFAOYSA-N	-1	0	295.226	2.341	10	5		CEBERM
Cc1cc(N[C@H](C(=O)[O-])C2CC2)ccc1[N+](=O)[O-]	ZINC000054521888	525298898	/nfs/dbraw/zinc/29/88/98/525298898.db2.gz	LPOBYJGWFKAYNF-NSHDSACASA-N	-1	0	250.254	2.178	10	5		CEBERM
Cc1ccc(N[C@@H](C(=O)[O-])C2CC2)cc1[N+](=O)[O-]	ZINC000061700633	525307655	/nfs/dbraw/zinc/30/76/55/525307655.db2.gz	FGFVRHPLDOYGSY-LLVKDONJSA-N	-1	0	250.254	2.178	10	5		CEBERM
Cc1cc(SCC(=O)[O-])n(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000052307031	525435625	/nfs/dbraw/zinc/43/56/25/525435625.db2.gz	IGMLKWASQNCYQV-UHFFFAOYSA-N	-1	0	293.304	2.266	10	5		CEBERM
Cc1c(N[C@H](C(=O)[O-])C(C)C)cccc1[N+](=O)[O-]	ZINC000062723528	525873933	/nfs/dbraw/zinc/87/39/33/525873933.db2.gz	HMMZQLNVUZLYCT-NSHDSACASA-N	-1	0	252.270	2.424	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1-c1noc([C@@H]2C[C@@H]2C(=O)[O-])n1	ZINC000050441232	526068702	/nfs/dbraw/zinc/06/87/02/526068702.db2.gz	QBTIXLPTDDRBBB-ZJUUUORDSA-N	-1	0	289.247	2.141	10	5		CEBERM
O=C([O-])c1ccc(Cl)cc1-n1ccc([N+](=O)[O-])n1	ZINC000062787722	526369990	/nfs/dbraw/zinc/36/99/90/526369990.db2.gz	LQNJOMQFSCVTKB-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
O=C([O-])c1nccnc1Oc1ccc([N+](=O)[O-])cc1F	ZINC000054553568	526410172	/nfs/dbraw/zinc/41/01/72/526410172.db2.gz	RKWXPBCWRALMHM-UHFFFAOYSA-N	-1	0	279.183	2.014	10	5		CEBERM
O=C([O-])C1(C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000050292759	527552505	/nfs/dbraw/zinc/55/25/05/527552505.db2.gz	RBYOEYHEIWTWFI-UHFFFAOYSA-N	-1	0	284.655	2.052	10	5		CEBERM
O=C([O-])CCCOc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000050469892	527588501	/nfs/dbraw/zinc/58/85/01/527588501.db2.gz	ASYJZLDPZIIGFC-UHFFFAOYSA-N	-1	0	259.645	2.492	10	5		CEBERM
O=C([O-])c1cnc2c3ccc(Cl)cc3[nH]cc-2c1=O	ZINC000584597693	344961873	/nfs/dbraw/zinc/96/18/73/344961873.db2.gz	OYNSVDHEZVEYKX-UHFFFAOYSA-N	-1	0	274.663	2.428	10	5		CEBERM
O=C([O-])[C@@H](F)c1ccc(Br)cc1[N+](=O)[O-]	ZINC000584625515	344968277	/nfs/dbraw/zinc/96/82/77/344968277.db2.gz	ZYJFVYBDVURTPZ-ZETCQYMHSA-N	-1	0	278.033	2.453	10	5		CEBERM
CCn1c2ccc([N+](=O)[O-])cc2c(C=O)c1C(=O)[O-]	ZINC000584880377	344995481	/nfs/dbraw/zinc/99/54/81/344995481.db2.gz	WBXQKNNFYYMDJG-UHFFFAOYSA-N	-1	0	262.221	2.080	10	5		CEBERM
O=C([O-])[C@H]1CCC[C@@H]1Nc1cccc([N+](=O)[O-])c1	ZINC000085328848	179019520	/nfs/dbraw/zinc/01/95/20/179019520.db2.gz	MZRDYSKWAMRDMZ-QWRGUYRKSA-N	-1	0	250.254	2.260	10	5		CEBERM
CCC[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000087489308	179433835	/nfs/dbraw/zinc/43/38/35/179433835.db2.gz	FJEKWOKIOJTWRY-VIFPVBQESA-N	-1	0	295.295	2.217	10	5		CEBERM
CC(C)(CCOc1cccc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000087592007	179451527	/nfs/dbraw/zinc/45/15/27/179451527.db2.gz	ZTSRRZFGYNKDIX-UHFFFAOYSA-N	-1	0	253.254	2.475	10	5		CEBERM
CCn1cncc1COc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000090235659	179936863	/nfs/dbraw/zinc/93/68/63/179936863.db2.gz	GBNNOTKUXSJFNU-UHFFFAOYSA-N	-1	0	291.263	2.088	10	5		CEBERM
Cc1cnc(NC[C@@H]2CCC[C@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691809	180024926	/nfs/dbraw/zinc/02/49/26/180024926.db2.gz	LTNVPTGHYNBFKP-VHSXEESVSA-N	-1	0	279.296	2.211	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1NCc1nc(C(=O)[O-])cs1	ZINC000090933113	180066704	/nfs/dbraw/zinc/06/67/04/180066704.db2.gz	PKSIXWBAOAFLGR-UHFFFAOYSA-N	-1	0	294.292	2.065	10	5		CEBERM
O=C([O-])c1cncc(Oc2ccc([N+](=O)[O-])cc2F)n1	ZINC000091417403	180149905	/nfs/dbraw/zinc/14/99/05/180149905.db2.gz	CPAXMVCRJHFFBO-UHFFFAOYSA-N	-1	0	279.183	2.014	10	5		CEBERM
O=C([O-])c1ccn(CCc2ccc([N+](=O)[O-])cc2)c1	ZINC000091839805	180268338	/nfs/dbraw/zinc/26/83/38/180268338.db2.gz	ZXPSIVAOUFCBRM-UHFFFAOYSA-N	-1	0	260.249	2.337	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])c1ccc([N+](=O)[O-])cc1F	ZINC000092448665	180386927	/nfs/dbraw/zinc/38/69/27/180386927.db2.gz	GZCITQQHMSWKMX-UHFFFAOYSA-N	-1	0	270.260	2.423	10	5		CEBERM
O=C([O-])c1cc(N[C@H]2CCCOC2)c(F)cc1[N+](=O)[O-]	ZINC000109550372	186261720	/nfs/dbraw/zinc/26/17/20/186261720.db2.gz	GNRUBNJBVIDMKJ-ZETCQYMHSA-N	-1	0	284.243	2.023	10	5		CEBERM
CCCc1c([O-])nc(-c2cccc([N+](=O)[O-])c2)[nH]c1=O	ZINC000110619796	186305396	/nfs/dbraw/zinc/30/53/96/186305396.db2.gz	BNLOIBVLLHIQEQ-UHFFFAOYSA-N	-1	0	275.264	2.003	10	5		CEBERM
COc1c(CC(=O)[O-])cc([N+](=O)[O-])cc1C(F)(F)F	ZINC000575679186	366326099	/nfs/dbraw/zinc/32/60/99/366326099.db2.gz	NXVHWFIQQCPRQR-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
CCc1cc(CC(=O)[O-])cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575660509	366319864	/nfs/dbraw/zinc/31/98/64/366319864.db2.gz	QQMPVRFFHQZPLQ-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
CCc1ccc(C(=O)[O-])c(OC(F)F)c1[N+](=O)[O-]	ZINC000575660358	366320405	/nfs/dbraw/zinc/32/04/05/366320405.db2.gz	UZWSFORCCQKKRT-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1c(F)c([N+](=O)[O-])ccc1C(F)(F)F	ZINC000575709139	366339375	/nfs/dbraw/zinc/33/93/75/366339375.db2.gz	SYVPLZAHADRLOF-UHFFFAOYSA-N	-1	0	253.107	2.451	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(Cl)c([N+](=O)[O-])cc1C(F)(F)F	ZINC000575694277	366331005	/nfs/dbraw/zinc/33/10/05/366331005.db2.gz	LBJJPRLPPNSBJS-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOc1cc(CC)cc([N+](=O)[O-])c1CC(=O)[O-]	ZINC000575696220	366331461	/nfs/dbraw/zinc/33/14/61/366331461.db2.gz	KSQMGOQZMJEMAK-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
O=C(c1cccc([N+](=O)[O-])c1)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000098178935	364536823	/nfs/dbraw/zinc/53/68/23/364536823.db2.gz	XPJYGIIROCVTJT-UHFFFAOYSA-N	-1	0	288.215	2.440	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])c1ccc([N+](=O)[O-])cc1	ZINC000092448806	184619953	/nfs/dbraw/zinc/61/99/53/184619953.db2.gz	MHYWAZYLJNVRMP-UHFFFAOYSA-N	-1	0	252.270	2.284	10	5		CEBERM
CC[C@H](C)[S@](=O)C=C([O-])c1ccc([N+](=O)[O-])cc1	ZINC000081915218	177892898	/nfs/dbraw/zinc/89/28/98/177892898.db2.gz	QIYNURMQEIOCGU-YYSFKGJASA-N	-1	0	269.322	2.325	10	5		CEBERM
C[C@](NCc1ccccc1[N+](=O)[O-])(C(=O)[O-])C(F)(F)F	ZINC000094229614	184766212	/nfs/dbraw/zinc/76/62/12/184766212.db2.gz	GMKPDCIJUNRNMD-JTQLQIEISA-N	-1	0	292.213	2.090	10	5		CEBERM
O=C([O-])Cc1ccc(OC(F)(F)F)cc1[N+](=O)[O-]	ZINC000575338354	395659908	/nfs/dbraw/zinc/65/99/08/395659908.db2.gz	WKCXUCHGYXRTAY-UHFFFAOYSA-N	-1	0	265.143	2.121	10	5		CEBERM
O=C([O-])c1cc(Br)cc(F)c1[N+](=O)[O-]	ZINC000306654939	400335389	/nfs/dbraw/zinc/33/53/89/400335389.db2.gz	KFAFCTMISBRSAW-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1c1ccc([N+](=O)[O-])nc1	ZINC000019868370	170900098	/nfs/dbraw/zinc/90/00/98/170900098.db2.gz	AMEFCMDXBROEBQ-DLOVCJGASA-N	-1	0	291.307	2.212	10	5		CEBERM
CCOC(=O)C=C([O-])c1ccc(C)c([N+](=O)[O-])c1	ZINC000020475435	171219236	/nfs/dbraw/zinc/21/92/36/171219236.db2.gz	QGJVBZZOOPFTEC-UHFFFAOYSA-N	-1	0	251.238	2.039	10	5		CEBERM
Cc1nc2cc(N(C)CC(=O)[O-])c([N+](=O)[O-])cc2s1	ZINC000035342351	172134813	/nfs/dbraw/zinc/13/48/13/172134813.db2.gz	SDSRAOLNOWQEBT-UHFFFAOYSA-N	-1	0	281.293	2.034	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc([N+](=O)[O-])nc1)C1CCCCC1	ZINC000038037087	174036578	/nfs/dbraw/zinc/03/65/78/174036578.db2.gz	JSWPKCFWPFOMFV-GFCCVEGCSA-N	-1	0	279.296	2.435	10	5		CEBERM
Cc1c([N+](=O)[O-])cc(C(=O)[O-])cc1N1CC[C@H](C)C1	ZINC000043387055	175032638	/nfs/dbraw/zinc/03/26/38/175032638.db2.gz	YIENGWXKWFPBLO-QMMMGPOBSA-N	-1	0	264.281	2.448	10	5		CEBERM
O=C([O-])c1cnc(Oc2ccc([N+](=O)[O-])cc2F)cn1	ZINC000071182465	176057648	/nfs/dbraw/zinc/05/76/48/176057648.db2.gz	IBNMNHDTGYPXDH-UHFFFAOYSA-N	-1	0	279.183	2.014	10	5		CEBERM
C[C@]1(C(=O)[O-])CCCN1c1cc(F)cc([N+](=O)[O-])c1	ZINC000079485302	177501625	/nfs/dbraw/zinc/50/16/25/177501625.db2.gz	GZTZEKSFESHMMZ-GFCCVEGCSA-N	-1	0	268.244	2.177	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1cc(F)cc([N+](=O)[O-])c1	ZINC000061217494	521247100	/nfs/dbraw/zinc/24/71/00/521247100.db2.gz	JQOLSRMOFFIITG-QMMMGPOBSA-N	-1	0	270.260	2.281	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])C(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000061215043	521246224	/nfs/dbraw/zinc/24/62/24/521246224.db2.gz	DRMBQHAGQOVBPP-JTQLQIEISA-N	-1	0	294.307	2.086	10	5		CEBERM
CCC[C@]1(C(=O)[O-])CCCN(c2ncccc2[N+](=O)[O-])C1	ZINC000062875238	521302272	/nfs/dbraw/zinc/30/22/72/521302272.db2.gz	JPPRYGWYGZRIFJ-AWEZNQCLSA-N	-1	0	293.323	2.461	10	5		CEBERM
CCC[C@]1(C(=O)[O-])CCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000062934547	521303353	/nfs/dbraw/zinc/30/33/53/521303353.db2.gz	DDPXPDZNBINSOD-ZDUSSCGKSA-N	-1	0	279.296	2.071	10	5		CEBERM
CCN(c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061171385	521492611	/nfs/dbraw/zinc/49/26/11/521492611.db2.gz	IWAOSYYHNBPIKF-UHFFFAOYSA-N	-1	0	297.267	2.193	10	5		CEBERM
CO[C@@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000050375438	523635229	/nfs/dbraw/zinc/63/52/29/523635229.db2.gz	ZQQYVSZNGBOKIT-NWDGAFQWSA-N	-1	0	280.280	2.272	10	5		CEBERM
CC[C@H](C(=O)[O-])N(C)c1cc(F)ccc1[N+](=O)[O-]	ZINC000052099803	523807618	/nfs/dbraw/zinc/80/76/18/523807618.db2.gz	RXJNCFGSZVLEEW-MRVPVSSYSA-N	-1	0	256.233	2.033	10	5		CEBERM
Cc1cccc(C(=O)NC(C)(C)CCC(=O)[O-])c1[N+](=O)[O-]	ZINC000050195014	524189109	/nfs/dbraw/zinc/18/91/09/524189109.db2.gz	FSKRMTPFBDOFKA-UHFFFAOYSA-N	-1	0	294.307	2.276	10	5		CEBERM
C[C@@]1(C(=O)[O-])CCCN(c2cc(F)ccc2[N+](=O)[O-])C1	ZINC000062874429	525816357	/nfs/dbraw/zinc/81/63/57/525816357.db2.gz	DUHYDQSVWUAJDI-CYBMUJFWSA-N	-1	0	282.271	2.425	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1-c1noc(CCCC(=O)[O-])n1	ZINC000050441231	526067456	/nfs/dbraw/zinc/06/74/56/526067456.db2.gz	FPGRMBXXLMHJNE-UHFFFAOYSA-N	-1	0	291.263	2.361	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1-c1ncc(C(=O)[O-])cn1	ZINC000054856943	526067811	/nfs/dbraw/zinc/06/78/11/526067811.db2.gz	NGONIFUZJIXAMW-UHFFFAOYSA-N	-1	0	259.221	2.058	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NCc1nccs1	ZINC000049534896	526355691	/nfs/dbraw/zinc/35/56/91/526355691.db2.gz	KEICJHHZMAWOCL-UHFFFAOYSA-N	-1	0	279.277	2.362	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(OCC(F)(F)F)c1	ZINC000050517681	526384189	/nfs/dbraw/zinc/38/41/89/526384189.db2.gz	RRLWYKWVYVDXSC-UHFFFAOYSA-N	-1	0	265.143	2.234	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(OCc2ccncc2)c1	ZINC000050517679	526384257	/nfs/dbraw/zinc/38/42/57/526384257.db2.gz	MHVMTQUOZSYVGG-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
Cc1ncsc1CCn1cc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000050285270	527493162	/nfs/dbraw/zinc/49/31/62/527493162.db2.gz	SJKOMYHSJYOQGQ-UHFFFAOYSA-N	-1	0	281.293	2.102	10	5		CEBERM
O=C([O-])Cc1ccc(Oc2ccncc2[N+](=O)[O-])cc1	ZINC000048802638	527638779	/nfs/dbraw/zinc/63/87/79/527638779.db2.gz	ZYMJVYCQGNIJOS-UHFFFAOYSA-N	-1	0	274.232	2.409	10	5		CEBERM
CCc1cc2[nH]c(=O)c([N+](=O)[O-])c([O-])c2cc1CC	ZINC000168450672	344480234	/nfs/dbraw/zinc/48/02/34/344480234.db2.gz	YXFNWXBLJSLNKJ-UHFFFAOYSA-N	-1	0	262.265	2.267	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(Cl)c(Cl)cc1[N+](=O)[O-]	ZINC000396121545	344845359	/nfs/dbraw/zinc/84/53/59/344845359.db2.gz	VLAYDXUDYRGCRA-SSDOTTSWSA-N	-1	0	266.036	2.020	10	5		CEBERM
O=C([O-])[C@H](O)c1c(Cl)cc([N+](=O)[O-])cc1Cl	ZINC000396121429	344845472	/nfs/dbraw/zinc/84/54/72/344845472.db2.gz	UPNHPGLWFDUAQI-SSDOTTSWSA-N	-1	0	266.036	2.020	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(Cl)cc([N+](=O)[O-])c1Cl	ZINC000396114942	344845655	/nfs/dbraw/zinc/84/56/55/344845655.db2.gz	GLZXDJLUBGTXLL-ZETCQYMHSA-N	-1	0	266.036	2.020	10	5		CEBERM
COc1ccc(N[C@H]2CC[C@H](C(=O)[O-])C2)c([N+](=O)[O-])c1	ZINC000097066330	185519967	/nfs/dbraw/zinc/51/99/67/185519967.db2.gz	SBOTWSUOEMCSDP-IUCAKERBSA-N	-1	0	280.280	2.269	10	5		CEBERM
Cc1cc(N[C@H]2CCO[C@H]2C)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000592973983	345417771	/nfs/dbraw/zinc/41/77/71/345417771.db2.gz	QMFRITJVUMDKLG-WPRPVWTQSA-N	-1	0	280.280	2.191	10	5		CEBERM
Cc1nn(C(C)C)c(N[C@H]2CCC[C@H]2C(=O)[O-])c1[N+](=O)[O-]	ZINC000097128042	185542787	/nfs/dbraw/zinc/54/27/87/185542787.db2.gz	CMISDDMEUPSNQH-ZJUUUORDSA-N	-1	0	296.327	2.346	10	5		CEBERM
O=C([O-])[C@@H]1CCC[C@@H]1Nc1cccc([N+](=O)[O-])c1	ZINC000085328853	179019867	/nfs/dbraw/zinc/01/98/67/179019867.db2.gz	MZRDYSKWAMRDMZ-MNOVXSKESA-N	-1	0	250.254	2.260	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1[C@H](C(=O)[O-])C1(C)C	ZINC000085407981	179055373	/nfs/dbraw/zinc/05/53/73/179055373.db2.gz	GZMKHNZYLPAFTA-GHMZBOCLSA-N	-1	0	292.291	2.199	10	5		CEBERM
COC[C@@H](Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-])C(C)C	ZINC000086702996	179321565	/nfs/dbraw/zinc/32/15/65/179321565.db2.gz	AIOVLLKEUKOOQU-LLVKDONJSA-N	-1	0	282.296	2.376	10	5		CEBERM
O=c1[n-]c(-c2ccc([N+](=O)[O-])cc2)ncc1Br	ZINC000090747513	180035872	/nfs/dbraw/zinc/03/58/72/180035872.db2.gz	NRDSVLRHWWGELF-UHFFFAOYSA-N	-1	0	296.080	2.108	10	5		CEBERM
C[C@@H](CCO)Sc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000091261704	180116204	/nfs/dbraw/zinc/11/62/04/180116204.db2.gz	DFZNAVZWUUVRJA-ZETCQYMHSA-N	-1	0	271.294	2.156	10	5		CEBERM
CCCc1nn(C)c(NC[C@H](CCC)C(=O)[O-])c1[N+](=O)[O-]	ZINC000091560775	180192104	/nfs/dbraw/zinc/19/21/04/180192104.db2.gz	MPFDFEGQCBHSJY-VIFPVBQESA-N	-1	0	298.343	2.194	10	5		CEBERM
Cc1cn([C@H](C)c2ccc(C(=O)[O-])o2)nc1[N+](=O)[O-]	ZINC000091779971	180252588	/nfs/dbraw/zinc/25/25/88/180252588.db2.gz	KXVCQGNCHYUMNT-SSDOTTSWSA-N	-1	0	265.225	2.000	10	5		CEBERM
O=C([O-])CN(CC(F)(F)F)c1ccc([N+](=O)[O-])cc1	ZINC000092436704	180385353	/nfs/dbraw/zinc/38/53/53/180385353.db2.gz	BIQRDRNFIZSBEY-UHFFFAOYSA-N	-1	0	278.186	2.048	10	5		CEBERM
COc1c(CC(=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575678705	366326561	/nfs/dbraw/zinc/32/65/61/366326561.db2.gz	KJSQSMVNMJHCCG-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
CCc1c([N+](=O)[O-])ccc(OC(F)F)c1C(=O)[O-]	ZINC000575660536	366319944	/nfs/dbraw/zinc/31/99/44/366319944.db2.gz	XYLVYGSDTSPCPK-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1cc(C(F)(F)F)c(F)cc1[N+](=O)[O-]	ZINC000575709902	366338859	/nfs/dbraw/zinc/33/88/59/366338859.db2.gz	CBHILIVVTWJYMX-UHFFFAOYSA-N	-1	0	253.107	2.451	10	5		CEBERM
O=C([O-])[C@@H](O)c1cc(C(F)(F)F)c([N+](=O)[O-])cc1Cl	ZINC000575695874	366331730	/nfs/dbraw/zinc/33/17/30/366331730.db2.gz	UIFIPSZUFGWLQC-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)Cc1c(Cl)cc([O-])cc1[N+](=O)[O-]	ZINC000575700528	366333557	/nfs/dbraw/zinc/33/35/57/366333557.db2.gz	LWJNTJCBVGVSDT-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
CCOC(=O)Cc1cc(F)c([S-])c([N+](=O)[O-])c1	ZINC000575701705	366334036	/nfs/dbraw/zinc/33/40/36/366334036.db2.gz	WHSJIOHGRZUMPM-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
CCOC(=O)Cc1cc(F)c([S-])cc1[N+](=O)[O-]	ZINC000575701098	366334107	/nfs/dbraw/zinc/33/41/07/366334107.db2.gz	IQYUUGVOYSJGJE-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
CCOC(=O)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000575701040	366334199	/nfs/dbraw/zinc/33/41/99/366334199.db2.gz	QPYZRNLEBFVBQN-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
O=c1c(-c2nnn[n-]2)coc2ccc3ccccc3c21	ZINC000095186856	364341681	/nfs/dbraw/zinc/34/16/81/364341681.db2.gz	BTXFSFMZIWCCGI-UHFFFAOYSA-N	-1	0	264.244	2.126	10	5		CEBERM
O=C([O-])CCc1nc2cc3ccccc3cc2c(=O)[nH]1	ZINC000169339053	367369039	/nfs/dbraw/zinc/36/90/39/367369039.db2.gz	TWWCJNGKSHYGBX-UHFFFAOYSA-N	-1	0	268.272	2.094	10	5		CEBERM
O=C([O-])[C@H]1CCCCN1c1cccc(F)c1[N+](=O)[O-]	ZINC000037418962	134842988	/nfs/dbraw/zinc/84/29/88/134842988.db2.gz	AQOOMDGJFHYDFY-SNVBAGLBSA-N	-1	0	268.244	2.177	10	5		CEBERM
O=[N+]([O-])c1ccc([O-])c(I)c1F	ZINC000299890158	400326164	/nfs/dbraw/zinc/32/61/64/400326164.db2.gz	VAURZJCQPPHGNV-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
O=C([O-])c1c2c(nc3ccc([N+](=O)[O-])cc31)CCC2	ZINC000022218525	171376995	/nfs/dbraw/zinc/37/69/95/171376995.db2.gz	JWZJWRWGWDFPTI-UHFFFAOYSA-N	-1	0	258.233	2.330	10	5		CEBERM
Cc1cc(C)n(-c2ccc([N+](=O)[O-])c(C(=O)[O-])c2)n1	ZINC000022219636	171377461	/nfs/dbraw/zinc/37/74/61/171377461.db2.gz	DUPVURHIPRAINS-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
CCCC[C@H](Nc1nc2sccn2c1[N+](=O)[O-])C(=O)[O-]	ZINC000035412591	172183947	/nfs/dbraw/zinc/18/39/47/172183947.db2.gz	XIVKPRFNYBOYNY-ZETCQYMHSA-N	-1	0	298.324	2.359	10	5		CEBERM
CCCC[C@@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000037669212	173610409	/nfs/dbraw/zinc/61/04/09/173610409.db2.gz	KGSGHQPALPSKDK-SNVBAGLBSA-N	-1	0	298.270	2.107	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])cc2F)c(C)c1C(=O)[O-]	ZINC000043299312	175000028	/nfs/dbraw/zinc/00/00/28/175000028.db2.gz	MXMQDVGAVINMRZ-UHFFFAOYSA-N	-1	0	279.227	2.235	10	5		CEBERM
Cn1cnc([N+](=O)[O-])c1NCC1(CC(=O)[O-])CCCCC1	ZINC000043413581	175037373	/nfs/dbraw/zinc/03/73/73/175037373.db2.gz	HQBHLJOTNNACHN-UHFFFAOYSA-N	-1	0	296.327	2.165	10	5		CEBERM
O=C([O-])c1cnc(-c2ccccc2[N+](=O)[O-])s1	ZINC000044732053	175240753	/nfs/dbraw/zinc/24/07/53/175240753.db2.gz	WKXJBHUOUQZDLL-UHFFFAOYSA-N	-1	0	250.235	2.417	10	5		CEBERM
C/C(C(=O)[O-])=C(\C)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000071164736	176047571	/nfs/dbraw/zinc/04/75/71/176047571.db2.gz	SQPSBMBWGAKMES-QROTZFDESA-N	-1	0	292.291	2.193	10	5		CEBERM
O=C([O-])c1ccc(CNc2ccc(O)cc2[N+](=O)[O-])o1	ZINC000071395986	176149534	/nfs/dbraw/zinc/14/95/34/176149534.db2.gz	XZQUREKGYSELGA-UHFFFAOYSA-N	-1	0	278.220	2.204	10	5		CEBERM
O=[N+]([O-])c1cc(-c2n[nH]c(-c3ccc(O)cc3)n2)ccc1[O-]	ZINC000072237684	176346732	/nfs/dbraw/zinc/34/67/32/176346732.db2.gz	QCIGXFOKIMEWDO-UHFFFAOYSA-N	-1	0	298.258	2.458	10	5		CEBERM
CCOc1cc(N2CCC[C@@]2(C)C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000079485352	177502174	/nfs/dbraw/zinc/50/21/74/177502174.db2.gz	FVKBDZRFYMBFBG-AWEZNQCLSA-N	-1	0	294.307	2.437	10	5		CEBERM
O=C([O-])c1nc(C2CCC2)n(-c2ccccc2[N+](=O)[O-])n1	ZINC000536959609	330384005	/nfs/dbraw/zinc/38/40/05/330384005.db2.gz	OWMXIIPFCHOHJF-UHFFFAOYSA-N	-1	0	288.263	2.141	10	5		CEBERM
CCN(c1cc(F)cc([N+](=O)[O-])c1)[C@H](C)CC(=O)[O-]	ZINC000061181776	521478558	/nfs/dbraw/zinc/47/85/58/521478558.db2.gz	DGVWZNLOYBBUHQ-MRVPVSSYSA-N	-1	0	270.260	2.423	10	5		CEBERM
CCN(C(=O)c1cc([N+](=O)[O-])ccc1C)C(C)(C)C(=O)[O-]	ZINC000061149744	520072166	/nfs/dbraw/zinc/07/21/66/520072166.db2.gz	NTVIZFAHFQWYEQ-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
COCC[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)[O-]	ZINC000052786154	521864276	/nfs/dbraw/zinc/86/42/76/521864276.db2.gz	DWNYBCUENMLRKR-SNVBAGLBSA-N	-1	0	288.687	2.150	10	5		CEBERM
Cc1nnc(Sc2ccc(C(=O)[O-])cc2[N+](=O)[O-])o1	ZINC000049934001	526391114	/nfs/dbraw/zinc/39/11/14/526391114.db2.gz	PZQXKHONEYXWMB-UHFFFAOYSA-N	-1	0	281.249	2.136	10	5		CEBERM
Cc1nn(-c2cccc([N+](=O)[O-])c2C)c(C)c1CC(=O)[O-]	ZINC000062724717	527536776	/nfs/dbraw/zinc/53/67/76/527536776.db2.gz	SUQBWRLWCOXVFT-UHFFFAOYSA-N	-1	0	289.291	2.333	10	5		CEBERM
O=C([O-])[C@@H](Nc1cc(F)ccc1[N+](=O)[O-])C1CC1	ZINC000054505967	527655464	/nfs/dbraw/zinc/65/54/64/527655464.db2.gz	IXKXTELQSPDJRY-JTQLQIEISA-N	-1	0	254.217	2.009	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cnc1Nc1ccccc1	ZINC000082568459	178100891	/nfs/dbraw/zinc/10/08/91/178100891.db2.gz	PJQGCJXMOQVOIZ-UHFFFAOYSA-N	-1	0	259.221	2.432	10	5		CEBERM
O=C(c1c(Cl)ccc([N+](=O)[O-])c1[O-])N1CCCC1	ZINC000584631368	344970089	/nfs/dbraw/zinc/97/00/89/344970089.db2.gz	OJAGLSGOEHBDKZ-UHFFFAOYSA-N	-1	0	270.672	2.190	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])nc1	ZINC000085330478	179020357	/nfs/dbraw/zinc/02/03/57/179020357.db2.gz	RHXKPYYELAJBIM-ZJUUUORDSA-N	-1	0	265.269	2.045	10	5		CEBERM
Cc1cc([N+](=O)[O-])cnc1SC[C@@H](C)C(=O)[O-]	ZINC000086111040	179232869	/nfs/dbraw/zinc/23/28/69/179232869.db2.gz	XIGPCHHSTFRRKA-SSDOTTSWSA-N	-1	0	256.283	2.111	10	5		CEBERM
COC[C@H](Nc1cc([N+](=O)[O-])ccc1C(=O)[O-])C(C)C	ZINC000086703061	179321870	/nfs/dbraw/zinc/32/18/70/179321870.db2.gz	UMZBWRIHQNIOTE-LBPRGKRZSA-N	-1	0	282.296	2.376	10	5		CEBERM
CCC[C@H](CNc1ncc([N+](=O)[O-])cc1C)C(=O)[O-]	ZINC000087512294	179437568	/nfs/dbraw/zinc/43/75/68/179437568.db2.gz	DXVUJVPILYYTQO-SECBINFHSA-N	-1	0	267.285	2.211	10	5		CEBERM
CC(C)C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])o1)CC(=O)[O-]	ZINC000088272898	179572771	/nfs/dbraw/zinc/57/27/71/179572771.db2.gz	XRNISKAKPWNVBS-SECBINFHSA-N	-1	0	298.295	2.055	10	5		CEBERM
Cc1cnc(SC[C@H](C)C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691872	180024815	/nfs/dbraw/zinc/02/48/15/180024815.db2.gz	DGSCXONBNPAPKS-ZETCQYMHSA-N	-1	0	256.283	2.111	10	5		CEBERM
Nc1ccc(S(=O)(=O)Nc2ccsc2)cc1[N+](=O)[O-]	ZINC000090868004	180048790	/nfs/dbraw/zinc/04/87/90/180048790.db2.gz	IDEWEZPOMVEZNJ-UHFFFAOYSA-N	-1	0	299.333	2.039	10	5		CEBERM
O=C([O-])c1cncc(Oc2ccc(F)cc2[N+](=O)[O-])n1	ZINC000091417513	180150231	/nfs/dbraw/zinc/15/02/31/180150231.db2.gz	NLNZWSUMHOZRRT-UHFFFAOYSA-N	-1	0	279.183	2.014	10	5		CEBERM
CCC[C@H](CNc1c([N+](=O)[O-])c(C(C)C)nn1C)C(=O)[O-]	ZINC000091576853	180197703	/nfs/dbraw/zinc/19/77/03/180197703.db2.gz	XADMCRAMCHWIMM-SECBINFHSA-N	-1	0	298.343	2.365	10	5		CEBERM
C[C@H]1CN(c2ccc([N+](=O)[O-])cc2C(=O)[O-])C[C@H]1C	ZINC000092085942	180320718	/nfs/dbraw/zinc/32/07/18/180320718.db2.gz	WQSLTHPASPFRCY-DTORHVGOSA-N	-1	0	264.281	2.385	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@@H](Nc2c(F)c(F)ccc2[N+](=O)[O-])C1	ZINC000092182864	180339466	/nfs/dbraw/zinc/33/94/66/180339466.db2.gz	BPGJHLLWORTMHY-NKWVEPMBSA-N	-1	0	284.218	2.314	10	5		CEBERM
Cc1nn(C(C)C)c(N[C@H]2C=C[C@@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000092183544	180339646	/nfs/dbraw/zinc/33/96/46/180339646.db2.gz	AYTQBCYIRDBFJG-ZJUUUORDSA-N	-1	0	294.311	2.122	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(C(=O)N(CC(=O)[O-])C(C)(C)C)c1	ZINC000092446872	180386478	/nfs/dbraw/zinc/38/64/78/180386478.db2.gz	ZDSISPCUXZMYFB-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
CC(C)c1nn(C)c(N(CC(=O)[O-])C(C)(C)C)c1[N+](=O)[O-]	ZINC000092448711	180386929	/nfs/dbraw/zinc/38/69/29/180386929.db2.gz	XBFOGKHKEOKBRQ-UHFFFAOYSA-N	-1	0	298.343	2.141	10	5		CEBERM
COc1cc(-n2nc(C)c(C(=O)[O-])c2C)ccc1[N+](=O)[O-]	ZINC000111053905	186348155	/nfs/dbraw/zinc/34/81/55/186348155.db2.gz	QZQJODAUSDKOOT-UHFFFAOYSA-N	-1	0	291.263	2.104	10	5		CEBERM
CCCOCCOc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000111106633	186352326	/nfs/dbraw/zinc/35/23/26/186352326.db2.gz	KLJDSHMETUTEBU-UHFFFAOYSA-N	-1	0	269.253	2.098	10	5		CEBERM
O=C([O-])c1cn(-c2ccc([N+](=O)[O-])cc2C(F)F)cn1	ZINC000111292058	186391219	/nfs/dbraw/zinc/39/12/19/186391219.db2.gz	MUAZLMBNGHSFHL-UHFFFAOYSA-N	-1	0	283.190	2.416	10	5		CEBERM
Cc1c([C@@H](O)C(=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000575673680	366324722	/nfs/dbraw/zinc/32/47/22/366324722.db2.gz	LYKXCAJIVQVHCB-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
Cc1cc(C(F)(F)F)c([C@H](O)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575675571	366325086	/nfs/dbraw/zinc/32/50/86/366325086.db2.gz	WHULWMBKXMPBIU-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
COc1cc([N+](=O)[O-])c(C(=O)[O-])c(C(F)(F)F)c1	ZINC000575674609	366325189	/nfs/dbraw/zinc/32/51/89/366325189.db2.gz	UBZMXMLSCASDLP-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
COc1cc([N+](=O)[O-])c(CC(=O)[O-])cc1C(F)(F)F	ZINC000575679499	366326487	/nfs/dbraw/zinc/32/64/87/366326487.db2.gz	UNMYKLJEFAHNDW-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
CCOc1c(CC(=O)[O-])ccc(OC(F)F)c1[N+](=O)[O-]	ZINC000575657095	366316301	/nfs/dbraw/zinc/31/63/01/366316301.db2.gz	JCOCXSQKMQECPK-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
CCOc1cc([N+](=O)[O-])c(OC(F)F)cc1C(=O)[O-]	ZINC000575659476	366318935	/nfs/dbraw/zinc/31/89/35/366318935.db2.gz	VIBYIYJYXQRJIN-UHFFFAOYSA-N	-1	0	277.179	2.293	10	5		CEBERM
O=C([O-])c1cc(F)c([N+](=O)[O-])cc1OC(F)F	ZINC000575661146	366321598	/nfs/dbraw/zinc/32/15/98/366321598.db2.gz	KDRQMSIRALNKLF-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(C(F)(F)F)cc(Cl)c1[N+](=O)[O-]	ZINC000575696596	366332284	/nfs/dbraw/zinc/33/22/84/366332284.db2.gz	XQOHOFFHZTXZOX-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])cc(Br)c1F	ZINC000098095434	304227745	/nfs/dbraw/zinc/22/77/45/304227745.db2.gz	NJJWVKUETMQWGE-UHFFFAOYSA-N	-1	0	264.006	2.195	10	5		CEBERM
Cc1c([N+](=O)[O-])cccc1N1CCSC[C@@H]1CC(=O)[O-]	ZINC000091130490	135067060	/nfs/dbraw/zinc/06/70/60/135067060.db2.gz	XEIOHCFIRHUYQR-JTQLQIEISA-N	-1	0	296.348	2.300	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc([N+](=O)[O-])cn1)c1ccccc1	ZINC000020278768	171132943	/nfs/dbraw/zinc/13/29/43/171132943.db2.gz	YPFXRBFHMRSQKL-LBPRGKRZSA-N	-1	0	273.248	2.228	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1-n1nnc(C(=O)[O-])c1C1CC1	ZINC000037291092	173096167	/nfs/dbraw/zinc/09/61/67/173096167.db2.gz	JZUYLTVIHFWNMH-UHFFFAOYSA-N	-1	0	288.263	2.060	10	5		CEBERM
O=C([O-])c1occc1COc1ccc([N+](=O)[O-])cc1	ZINC000037333231	173134536	/nfs/dbraw/zinc/13/45/36/173134536.db2.gz	WNEBPSMRXGXSQS-UHFFFAOYSA-N	-1	0	263.205	2.465	10	5		CEBERM
CCOc1ncnc([N-]c2ncccc2C)c1[N+](=O)[O-]	ZINC000040625945	174356319	/nfs/dbraw/zinc/35/63/19/174356319.db2.gz	SHLZENBVTUZWMA-UHFFFAOYSA-N	-1	0	275.268	2.231	10	5		CEBERM
Cc1c(Sc2nccn2C)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043387245	175032592	/nfs/dbraw/zinc/03/25/92/175032592.db2.gz	BXLWVOUXRJPJDC-UHFFFAOYSA-N	-1	0	293.304	2.486	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])C(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000061214860	521195576	/nfs/dbraw/zinc/19/55/76/521195576.db2.gz	RIVDEPBJNXUJTE-SNVBAGLBSA-N	-1	0	294.307	2.086	10	5		CEBERM
CCN(c1cc(F)cc([N+](=O)[O-])c1)[C@@H](C)CC(=O)[O-]	ZINC000061181775	521479460	/nfs/dbraw/zinc/47/94/60/521479460.db2.gz	DGVWZNLOYBBUHQ-QMMMGPOBSA-N	-1	0	270.260	2.423	10	5		CEBERM
CCN(c1cccc(F)c1[N+](=O)[O-])[C@H](C)CC(=O)[O-]	ZINC000061181770	521496165	/nfs/dbraw/zinc/49/61/65/521496165.db2.gz	JDKJCRZBRCLCIS-MRVPVSSYSA-N	-1	0	270.260	2.423	10	5		CEBERM
CCN(c1cccc([N+](=O)[O-])c1)[C@H](C)CC(=O)[O-]	ZINC000061182024	521496198	/nfs/dbraw/zinc/49/61/98/521496198.db2.gz	OQDSAWOGCBRKSH-SECBINFHSA-N	-1	0	252.270	2.284	10	5		CEBERM
COc1ccc(CC2(C(=O)[O-])CCOCC2)cc1[N+](=O)[O-]	ZINC000061674706	523914437	/nfs/dbraw/zinc/91/44/37/523914437.db2.gz	FYHLOADHDZCNBG-UHFFFAOYSA-N	-1	0	295.291	2.027	10	5		CEBERM
C[C@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)C(=O)[O-]	ZINC000054334572	524506771	/nfs/dbraw/zinc/50/67/71/524506771.db2.gz	DMUHPQZDZITSJS-MRVPVSSYSA-N	-1	0	275.264	2.276	10	5		CEBERM
Cc1ccc(N(C)C[C@H](C)C(=O)[O-])cc1[N+](=O)[O-]	ZINC000061700599	524886240	/nfs/dbraw/zinc/88/62/40/524886240.db2.gz	GTNYMQSACCLWQD-VIFPVBQESA-N	-1	0	252.270	2.060	10	5		CEBERM
Cc1cc(N(CC(=O)[O-])CC(C)C)ccc1[N+](=O)[O-]	ZINC000062742627	525032129	/nfs/dbraw/zinc/03/21/29/525032129.db2.gz	DGPUUXJILXSLCL-UHFFFAOYSA-N	-1	0	266.297	2.450	10	5		CEBERM
Cc1ccc(Oc2nccnc2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000054553665	525480798	/nfs/dbraw/zinc/48/07/98/525480798.db2.gz	OAALKYKUSZTUDT-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
C[C@@H](SCCc1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000062726094	525974521	/nfs/dbraw/zinc/97/45/21/525974521.db2.gz	DJBDSSBVUFKMSC-MRVPVSSYSA-N	-1	0	255.295	2.344	10	5		CEBERM
O=C([O-])c1ccc(-n2ccc([N+](=O)[O-])n2)c(Cl)c1	ZINC000062796399	526359863	/nfs/dbraw/zinc/35/98/63/526359863.db2.gz	DRAMSQHHQUPAOU-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
O=C([O-])c1cccc(NCc2ccc([N+](=O)[O-])cc2)n1	ZINC000051043262	526391768	/nfs/dbraw/zinc/39/17/68/526391768.db2.gz	YWXDMCZSDUBEBT-UHFFFAOYSA-N	-1	0	273.248	2.300	10	5		CEBERM
O=C([O-])c1cccc(Oc2ccccc2[N+](=O)[O-])n1	ZINC000051041655	526394391	/nfs/dbraw/zinc/39/43/91/526394391.db2.gz	JAUWFHMDNOLPOY-UHFFFAOYSA-N	-1	0	260.205	2.480	10	5		CEBERM
Cc1nn(-c2cc([N+](=O)[O-])ccc2C(=O)[O-])c(C)c1C	ZINC000070231959	527518583	/nfs/dbraw/zinc/51/85/83/527518583.db2.gz	DHMLUMACLARJIF-UHFFFAOYSA-N	-1	0	275.264	2.404	10	5		CEBERM
O=C([O-])C1(Cc2ccccc2[N+](=O)[O-])CCOCC1	ZINC000061674686	527555176	/nfs/dbraw/zinc/55/51/76/527555176.db2.gz	VLJSORLKWIMKIH-UHFFFAOYSA-N	-1	0	265.265	2.019	10	5		CEBERM
Cc1nn(-c2ccccc2C(=O)[O-])c(C)c1[N+](=O)[O-]	ZINC000050912880	527565044	/nfs/dbraw/zinc/56/50/44/527565044.db2.gz	NQQJVEGMJLWDEY-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
O=C([O-])[C@@H](Nc1ccc([N+](=O)[O-])c2cnccc12)C1CC1	ZINC000054521928	527655764	/nfs/dbraw/zinc/65/57/64/527655764.db2.gz	LJNPTGFNHWTTCL-ZDUSSCGKSA-N	-1	0	287.275	2.418	10	5		CEBERM
CC[C@H](NC(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1)C(C)C	ZINC000262651486	535862571	/nfs/dbraw/zinc/86/25/71/535862571.db2.gz	KPDKWPUNTDBAGH-LBPRGKRZSA-N	-1	0	294.307	2.457	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1-c1ccc(CO)cc1	ZINC000095495073	184998051	/nfs/dbraw/zinc/99/80/51/184998051.db2.gz	UIOUBUJQHHGPAK-UHFFFAOYSA-N	-1	0	273.244	2.452	10	5		CEBERM
Cn1cnc([N+](=O)[O-])c1Sc1ccc(CC(=O)[O-])cc1	ZINC000085960007	179204199	/nfs/dbraw/zinc/20/41/99/179204199.db2.gz	GYVHURSWAFVXAA-UHFFFAOYSA-N	-1	0	293.304	2.107	10	5		CEBERM
O=C([O-])[C@H]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])cn1	ZINC000089382169	179776201	/nfs/dbraw/zinc/77/62/01/179776201.db2.gz	WGCKLRLLBGWASL-ONGXEEELSA-N	-1	0	279.296	2.293	10	5		CEBERM
CCCC[C@@H](Nc1ncc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000090691642	180024505	/nfs/dbraw/zinc/02/45/05/180024505.db2.gz	RVGFDHVSUIDZJK-SECBINFHSA-N	-1	0	267.285	2.354	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@H](C)CCC(=O)[O-]	ZINC000091555399	180190409	/nfs/dbraw/zinc/19/04/09/180190409.db2.gz	HXIAUWFYOAJFBX-MRVPVSSYSA-N	-1	0	284.316	2.175	10	5		CEBERM
CC(C)c1nn(C)c(N[C@@H]2CC[C@@H](C(=O)[O-])C2)c1[N+](=O)[O-]	ZINC000091577857	180197752	/nfs/dbraw/zinc/19/77/52/180197752.db2.gz	RMKNNFFLBMEFOW-RKDXNWHRSA-N	-1	0	296.327	2.117	10	5		CEBERM
O=C([O-])c1cccn1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000091840325	180269115	/nfs/dbraw/zinc/26/91/15/180269115.db2.gz	SFGXTXQPOLYTIU-UHFFFAOYSA-N	-1	0	291.219	2.051	10	5		CEBERM
Cc1cc(NC[C@@H]2CCC[C@@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000092026552	180308786	/nfs/dbraw/zinc/30/87/86/180308786.db2.gz	RRWLYNCOJPIUHO-UWVGGRQHSA-N	-1	0	279.296	2.211	10	5		CEBERM
COc1cc(N(CC(=O)[O-])C(C)(C)C)ccc1[N+](=O)[O-]	ZINC000092448804	180387128	/nfs/dbraw/zinc/38/71/28/180387128.db2.gz	CWAZOFQSGJGDDL-UHFFFAOYSA-N	-1	0	282.296	2.293	10	5		CEBERM
Cc1ccc(Nc2ncc([N+](=O)[O-])cn2)cc1C(=O)[O-]	ZINC000110989192	186339760	/nfs/dbraw/zinc/33/97/60/186339760.db2.gz	BZEDLMCNFCHXEQ-UHFFFAOYSA-N	-1	0	274.236	2.135	10	5		CEBERM
Cc1c([N+](=O)[O-])ccc(CC(=O)[O-])c1OC(F)F	ZINC000575666188	366323409	/nfs/dbraw/zinc/32/34/09/366323409.db2.gz	HCWONDMCUJFAJO-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
CCc1cc(OC(F)F)c([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000575658545	366317457	/nfs/dbraw/zinc/31/74/57/366317457.db2.gz	GNKFHWIIZUFGPA-UHFFFAOYSA-N	-1	0	261.180	2.457	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(F)c1OC(F)F	ZINC000575661348	366320795	/nfs/dbraw/zinc/32/07/95/366320795.db2.gz	MGNHKJNAZWIAPL-UHFFFAOYSA-N	-1	0	251.116	2.034	10	5		CEBERM
COc1cc(OC(F)F)cc([N+](=O)[O-])c1[S-]	ZINC000575665874	366322445	/nfs/dbraw/zinc/32/24/45/366322445.db2.gz	VBPMKGKJWLFAEC-UHFFFAOYSA-N	-1	0	251.210	2.494	10	5		CEBERM
CCOC(=O)c1cc([O-])c(Br)cc1[N+](=O)[O-]	ZINC000575700214	366333510	/nfs/dbraw/zinc/33/35/10/366333510.db2.gz	PSFMBVZQMARFOK-UHFFFAOYSA-N	-1	0	290.069	2.240	10	5		CEBERM
CCOC(=O)Cc1c([O-])ccc([N+](=O)[O-])c1Cl	ZINC000575701130	366333907	/nfs/dbraw/zinc/33/39/07/366333907.db2.gz	UQRHASZNZSMPLN-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
CCOC(=O)Cc1cc(Cl)c([O-])cc1[N+](=O)[O-]	ZINC000575701378	366334315	/nfs/dbraw/zinc/33/43/15/366334315.db2.gz	XMIRHQCESGEFDS-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
O=C([O-])[C@@H]1CCCCN1c1nc2cc([N+](=O)[O-])ccc2o1	ZINC000095077915	304106918	/nfs/dbraw/zinc/10/69/18/304106918.db2.gz	BEHDUBHNKIVYPK-JTQLQIEISA-N	-1	0	291.263	2.180	10	5		CEBERM
COCCCSc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000088613638	363912563	/nfs/dbraw/zinc/91/25/63/363912563.db2.gz	ZARNQMQYSOTZNE-UHFFFAOYSA-N	-1	0	271.294	2.422	10	5		CEBERM
C[C@H]1[C@H](C(=O)[O-])CCN1c1cccc(F)c1[N+](=O)[O-]	ZINC000092923458	184635615	/nfs/dbraw/zinc/63/56/15/184635615.db2.gz	YCLLMVWXTHKZQG-JGVFFNPUSA-N	-1	0	268.244	2.033	10	5		CEBERM
Cc1c(C(=O)[O-])cnn1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000093633166	184699669	/nfs/dbraw/zinc/69/96/69/184699669.db2.gz	MIDBFBULPPKJCW-UHFFFAOYSA-N	-1	0	295.682	2.500	10	5		CEBERM
C[C@](Nc1ccccc1[N+](=O)[O-])(C(=O)[O-])C(F)(F)F	ZINC000094221933	184765238	/nfs/dbraw/zinc/76/52/38/184765238.db2.gz	SUIMKBBASBQEEE-VIFPVBQESA-N	-1	0	278.186	2.412	10	5		CEBERM
Cc1c([N+](=O)[O-])cc(C(=O)[O-])cc1N1C[C@@H](C)OC[C@@H]1C	ZINC000043386962	134900257	/nfs/dbraw/zinc/90/02/57/134900257.db2.gz	KAOODGHWJPQQAU-DTWKUNHWSA-N	-1	0	294.307	2.215	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1N1CCSC[C@@H]1CC(=O)[O-]	ZINC000091130189	135067318	/nfs/dbraw/zinc/06/73/18/135067318.db2.gz	BJMFBJYASWXALN-NSHDSACASA-N	-1	0	296.348	2.300	10	5		CEBERM
CCC1(C(=O)[O-])CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1	ZINC000092026457	135075282	/nfs/dbraw/zinc/07/52/82/135075282.db2.gz	RZMVZKZNMSGEGT-UHFFFAOYSA-N	-1	0	293.323	2.379	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)c1[O-]	ZINC000005378153	170091275	/nfs/dbraw/zinc/09/12/75/170091275.db2.gz	STAVJPCOVBMMQP-UHFFFAOYSA-N	-1	0	278.224	2.011	10	5		CEBERM
Cc1cccc(C(=O)[O-])c1NC(=O)c1ccc([N+](=O)[O-])o1	ZINC000019278592	170770562	/nfs/dbraw/zinc/77/05/62/170770562.db2.gz	KDLUMZYAHCFAHU-UHFFFAOYSA-N	-1	0	290.231	2.447	10	5		CEBERM
CC[C@@H](C)n1nc([N+](=O)[O-])c(Br)c1C(=O)[O-]	ZINC000020313920	171145687	/nfs/dbraw/zinc/14/56/87/171145687.db2.gz	ULBTWHXJQUBMRY-SCSAIBSYSA-N	-1	0	292.089	2.223	10	5		CEBERM
Cc1c(O[C@H](C(=O)[O-])C(C)C)cccc1[N+](=O)[O-]	ZINC000035282917	172101257	/nfs/dbraw/zinc/10/12/57/172101257.db2.gz	NLMMVZCQSYTPKQ-NSHDSACASA-N	-1	0	253.254	2.391	10	5		CEBERM
O=C([O-])c1ccccc1NCc1ccc([N+](=O)[O-])o1	ZINC000037251704	173063844	/nfs/dbraw/zinc/06/38/44/173063844.db2.gz	HFPOXHKFJDMGEH-UHFFFAOYSA-N	-1	0	262.221	2.498	10	5		CEBERM
CCCN(CC(=O)[O-])c1cc(F)cc([N+](=O)[O-])c1	ZINC000038021137	174000154	/nfs/dbraw/zinc/00/01/54/174000154.db2.gz	HGKRMPDQDZJLDJ-UHFFFAOYSA-N	-1	0	256.233	2.035	10	5		CEBERM
O=C([O-])[C@@H](Nc1ncccc1[N+](=O)[O-])C1CCCCC1	ZINC000038036930	174037027	/nfs/dbraw/zinc/03/70/27/174037027.db2.gz	FYGGLLOISIOLML-NSHDSACASA-N	-1	0	279.296	2.435	10	5		CEBERM
CCC[C@H](NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1)C(=O)[O-]	ZINC000040546323	174325061	/nfs/dbraw/zinc/32/50/61/174325061.db2.gz	NBLXFJPHMHWRIU-JTQLQIEISA-N	-1	0	295.295	2.278	10	5		CEBERM
Cc1cccc([N-]c2ncnc(-n3ccnc3)c2[N+](=O)[O-])n1	ZINC000040584909	174345800	/nfs/dbraw/zinc/34/58/00/174345800.db2.gz	UYLVYEHVKZKRQT-UHFFFAOYSA-N	-1	0	297.278	2.018	10	5		CEBERM
O=C([O-])c1ccc(C[S@](=O)c2ccccc2[N+](=O)[O-])o1	ZINC000040958760	174439628	/nfs/dbraw/zinc/43/96/28/174439628.db2.gz	GZPHFZOUFDGHCO-HXUWFJFHSA-N	-1	0	295.272	2.194	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])cc2F)c(C)c1CC(=O)[O-]	ZINC000043299234	175000160	/nfs/dbraw/zinc/00/01/60/175000160.db2.gz	HDYKSNGRBUQDMB-UHFFFAOYSA-N	-1	0	293.254	2.164	10	5		CEBERM
C/C(C(=O)[O-])=C(\C)C(=O)Nc1ccc(C)cc1[N+](=O)[O-]	ZINC000071165019	176047971	/nfs/dbraw/zinc/04/79/71/176047971.db2.gz	NAKGJCQVLCIEMU-HJWRWDBZSA-N	-1	0	278.264	2.263	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])cc1C)C(C)(C)C(=O)[O-]	ZINC000061149751	520090644	/nfs/dbraw/zinc/09/06/44/520090644.db2.gz	GGPCNWLUMKSNMP-UHFFFAOYSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@H](C)CC(=O)[O-]	ZINC000061178203	520091480	/nfs/dbraw/zinc/09/14/80/520091480.db2.gz	OFTGXRUUGJKRFN-SNVBAGLBSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCC[C@H](NC(=O)c1cc([N+](=O)[O-])c(C)cc1C)C(=O)[O-]	ZINC000263198780	521143883	/nfs/dbraw/zinc/14/38/83/521143883.db2.gz	MCRMXVSTIAOVAD-NSHDSACASA-N	-1	0	294.307	2.195	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1ccccc1[N+](=O)[O-]	ZINC000061217613	521247441	/nfs/dbraw/zinc/24/74/41/521247441.db2.gz	QPPXMAVYMBECQX-VIFPVBQESA-N	-1	0	252.270	2.142	10	5		CEBERM
CCN(C[C@H]1CCCO1)c1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000070232482	521270377	/nfs/dbraw/zinc/27/03/77/521270377.db2.gz	WTSJOPUWIKZVPG-LLVKDONJSA-N	-1	0	294.307	2.298	10	5		CEBERM
CCN(c1ccccc1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061171424	521502623	/nfs/dbraw/zinc/50/26/23/521502623.db2.gz	QPKJTKMBSCEZRR-UHFFFAOYSA-N	-1	0	252.270	2.284	10	5		CEBERM
CC[C@H](Oc1cc(C)c([N+](=O)[O-])cc1C)C(=O)[O-]	ZINC000061192019	522866406	/nfs/dbraw/zinc/86/64/06/522866406.db2.gz	HXQVPSYQEVIAQZ-JTQLQIEISA-N	-1	0	253.254	2.454	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1-c1ccc(C(=O)[O-])n1C	ZINC000061628685	522974326	/nfs/dbraw/zinc/97/43/26/522974326.db2.gz	KSHVGNMGMWNDHP-UHFFFAOYSA-N	-1	0	276.248	2.307	10	5		CEBERM
COc1cc([N+](=O)[O-])ccc1O[C@@H](C(=O)[O-])C(C)C	ZINC000050504931	522984670	/nfs/dbraw/zinc/98/46/70/522984670.db2.gz	GNJREKKZVOJXOW-LLVKDONJSA-N	-1	0	269.253	2.091	10	5		CEBERM
CN(C(=O)Nc1cc([N+](=O)[O-])ccc1F)C(C)(C)C(=O)[O-]	ZINC000061173935	523883232	/nfs/dbraw/zinc/88/32/32/523883232.db2.gz	NNGSFULWDUHQCK-UHFFFAOYSA-N	-1	0	299.258	2.061	10	5		CEBERM
Cc1c([N+](=O)[O-])cccc1N1CCC(C(=O)[O-])CC1	ZINC000062723441	525930220	/nfs/dbraw/zinc/93/02/20/525930220.db2.gz	MMWWBPBOEPKSJF-UHFFFAOYSA-N	-1	0	264.281	2.204	10	5		CEBERM
Cc1ccc(C(=O)[O-])cc1Oc1ncc([N+](=O)[O-])cn1	ZINC000048804263	526235136	/nfs/dbraw/zinc/23/51/36/526235136.db2.gz	RJGODQWZXNVUPM-UHFFFAOYSA-N	-1	0	275.220	2.184	10	5		CEBERM
O=C([O-])c1c2ccccc2oc1Cn1cc([N+](=O)[O-])cn1	ZINC000051360768	526339859	/nfs/dbraw/zinc/33/98/59/526339859.db2.gz	NERHTOBAORWUFN-UHFFFAOYSA-N	-1	0	287.231	2.284	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(OCc2cccnc2)c1	ZINC000050517678	526384182	/nfs/dbraw/zinc/38/41/82/526384182.db2.gz	MMDCDRXLPNVPMA-UHFFFAOYSA-N	-1	0	274.232	2.267	10	5		CEBERM
Cc1nn(-c2ccc(C)c([N+](=O)[O-])c2)c(C)c1CC(=O)[O-]	ZINC000061701505	527521171	/nfs/dbraw/zinc/52/11/71/527521171.db2.gz	AFOOXPGVLFIJNI-UHFFFAOYSA-N	-1	0	289.291	2.333	10	5		CEBERM
CCOc1cccc(N2C[C@H](C(=O)[O-])[C@H](C)C2)c1[N+](=O)[O-]	ZINC000229313676	643383434	/nfs/dbraw/zinc/38/34/34/643383434.db2.gz	QDDPLEXGIWGGRN-ZJUUUORDSA-N	-1	0	294.307	2.150	10	5		CEBERM
O=C([O-])c1cc(-c2ccc(CO)cc2)cc([N+](=O)[O-])c1	ZINC000095495072	184997771	/nfs/dbraw/zinc/99/77/71/184997771.db2.gz	DAXACYDYWTTYCW-UHFFFAOYSA-N	-1	0	273.244	2.452	10	5		CEBERM
C[C@H](C(=O)[O-])c1ccc(Cn2cnc([N+](=O)[O-])c2)cc1	ZINC000097801180	185669840	/nfs/dbraw/zinc/66/98/40/185669840.db2.gz	BLZYSVALNGVOBW-VIFPVBQESA-N	-1	0	275.264	2.028	10	5		CEBERM
Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1[C@H](C(=O)[O-])C1(C)C	ZINC000085411057	179057178	/nfs/dbraw/zinc/05/71/78/179057178.db2.gz	ZHSBZEZLVPHJHU-WDEREUQCSA-N	-1	0	292.291	2.199	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NC[C@H]1CCCC[C@@H]1O	ZINC000086016920	179216796	/nfs/dbraw/zinc/21/67/96/179216796.db2.gz	STTXLGDYXIENMN-RNCFNFMXSA-N	-1	0	294.307	2.256	10	5		CEBERM
COc1ccc(CCn2cc([N+](=O)[O-])cc2C(=O)[O-])cc1	ZINC000088102851	179549165	/nfs/dbraw/zinc/54/91/65/179549165.db2.gz	BXCSBXVQVJPVLM-UHFFFAOYSA-N	-1	0	290.275	2.346	10	5		CEBERM
Cc1cnc(N[C@H]2CCCC[C@@H]2C(=O)[O-])c([N+](=O)[O-])c1	ZINC000090691781	180024936	/nfs/dbraw/zinc/02/49/36/180024936.db2.gz	OFNZILNPZPCISF-UWVGGRQHSA-N	-1	0	279.296	2.354	10	5		CEBERM
COc1ccc([N+](=O)[O-])cc1Cn1cccc1C(=O)[O-]	ZINC000091840289	180268779	/nfs/dbraw/zinc/26/87/79/180268779.db2.gz	BBHHVXFIYBWFTB-UHFFFAOYSA-N	-1	0	276.248	2.151	10	5		CEBERM
COc1cc(N2CCC[C@H]2CC(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000110624880	186306706	/nfs/dbraw/zinc/30/67/06/186306706.db2.gz	ITJQRBCRNCMAAX-QMMMGPOBSA-N	-1	0	298.270	2.186	10	5		CEBERM
Cc1cc(C(=O)[O-])c(NC(=O)c2cc([N+](=O)[O-])c[nH]2)s1	ZINC000110775009	186322546	/nfs/dbraw/zinc/32/25/46/186322546.db2.gz	ZQEYURFZNOQDNZ-UHFFFAOYSA-N	-1	0	295.276	2.243	10	5		CEBERM
Cc1c(CC(=O)[O-])cc(OC(F)(F)F)cc1[N+](=O)[O-]	ZINC000575673284	366323751	/nfs/dbraw/zinc/32/37/51/366323751.db2.gz	GJOOOBGGFWPMIV-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1[C@H](O)C(=O)[O-]	ZINC000575673160	366323771	/nfs/dbraw/zinc/32/37/71/366323771.db2.gz	CQAYYMJUNHGJIE-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1[C@@H](O)C(=O)[O-]	ZINC000575673159	366323847	/nfs/dbraw/zinc/32/38/47/366323847.db2.gz	CQAYYMJUNHGJIE-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
O=C([O-])c1cc(F)c(OC(F)(F)F)cc1[N+](=O)[O-]	ZINC000575710977	366339324	/nfs/dbraw/zinc/33/93/24/366339324.db2.gz	MTYMUIZIRSEIFA-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
O=C([O-])c1ccc(F)c(OC(F)(F)F)c1[N+](=O)[O-]	ZINC000575711776	366340008	/nfs/dbraw/zinc/34/00/08/366340008.db2.gz	YHCJMEDGDYHWKH-UHFFFAOYSA-N	-1	0	269.106	2.331	10	5		CEBERM
O=C([O-])[C@H](O)c1cc([N+](=O)[O-])c(Cl)cc1C(F)(F)F	ZINC000575695590	366331210	/nfs/dbraw/zinc/33/12/10/366331210.db2.gz	QAXGQTNTCGARNK-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOc1cc(CC(=O)[O-])c(CC)cc1[N+](=O)[O-]	ZINC000575697114	366332597	/nfs/dbraw/zinc/33/25/97/366332597.db2.gz	UHGSELIEMHRJFY-UHFFFAOYSA-N	-1	0	253.254	2.183	10	5		CEBERM
CCOC(=O)Cc1cc([N+](=O)[O-])cc(F)c1[S-]	ZINC000575701071	366333381	/nfs/dbraw/zinc/33/33/81/366333381.db2.gz	HWIUBXROQIDEEX-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
CCOC(=O)Cc1cc([S-])c([N+](=O)[O-])cc1F	ZINC000575701063	366334010	/nfs/dbraw/zinc/33/40/10/366334010.db2.gz	HPWHUFQRJRJTLY-UHFFFAOYSA-N	-1	0	259.258	2.128	10	5		CEBERM
O=C([O-])c1c[nH]c(=O)c(-c2cccc([N+](=O)[O-])c2)c1	ZINC000065347850	304278870	/nfs/dbraw/zinc/27/88/70/304278870.db2.gz	ONGXFPGYDOBXQB-UHFFFAOYSA-N	-1	0	260.205	2.061	10	5		CEBERM
CC(C)(C)c1c(C(=O)[O-])nnn1-c1cccc([N+](=O)[O-])c1	ZINC000037291074	173096192	/nfs/dbraw/zinc/09/61/92/173096192.db2.gz	VDBPCWABNUWSHR-UHFFFAOYSA-N	-1	0	290.279	2.171	10	5		CEBERM
O=C([O-])c1ccn(-c2ccc(Cl)c([N+](=O)[O-])c2)n1	ZINC000037291143	173096542	/nfs/dbraw/zinc/09/65/42/173096542.db2.gz	HQUQDSDOHDAIIY-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
CCC[C@@H](Nc1cccc(F)c1[N+](=O)[O-])C(=O)[O-]	ZINC000037418973	173196425	/nfs/dbraw/zinc/19/64/25/173196425.db2.gz	RFAWIMNUJZPCSC-SECBINFHSA-N	-1	0	256.233	2.399	10	5		CEBERM
CCCCN(C)c1nc[n-]c(=NNC(C)(C)C)c1[N+](=O)[O-]	ZINC000040612094	174353676	/nfs/dbraw/zinc/35/36/76/174353676.db2.gz	JBGVJFMDCYJPKN-UHFFFAOYSA-N	-1	0	296.375	2.336	10	5		CEBERM
CCCCN(CCO)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043387127	175032415	/nfs/dbraw/zinc/03/24/15/175032415.db2.gz	SREVCRQUWLQQNS-UHFFFAOYSA-N	-1	0	296.323	2.200	10	5		CEBERM
O=C([O-])Cc1csc(Sc2ccncc2[N+](=O)[O-])n1	ZINC000071300938	176113930	/nfs/dbraw/zinc/11/39/30/176113930.db2.gz	SUORTAUUTLLBNU-UHFFFAOYSA-N	-1	0	297.317	2.225	10	5		CEBERM
Cc1nn(-c2ccc([N+](=O)[O-])cc2C(=O)[O-])cc1Cl	ZINC000080010079	177594820	/nfs/dbraw/zinc/59/48/20/177594820.db2.gz	BUQDGUIHOJOWPY-UHFFFAOYSA-N	-1	0	281.655	2.441	10	5		CEBERM
Cc1nn(-c2ccc(C)c([N+](=O)[O-])c2)cc1C(=O)[O-]	ZINC000080046218	177601605	/nfs/dbraw/zinc/60/16/05/177601605.db2.gz	RIRLPJQRRURQQL-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@@H](C)CC(=O)[O-]	ZINC000061178202	520090635	/nfs/dbraw/zinc/09/06/35/520090635.db2.gz	OFTGXRUUGJKRFN-JTQLQIEISA-N	-1	0	294.307	2.229	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])cc1C)[C@H](C)CC(=O)[O-]	ZINC000061180966	520091129	/nfs/dbraw/zinc/09/11/29/520091129.db2.gz	ICHFIWDHOBPQOX-SNVBAGLBSA-N	-1	0	294.307	2.229	10	5		CEBERM
CCO[C@@H](CCOc1cccc(C)c1[N+](=O)[O-])C(=O)[O-]	ZINC000062763791	520305642	/nfs/dbraw/zinc/30/56/42/520305642.db2.gz	WWYSIZAYAIGZJJ-NSHDSACASA-N	-1	0	283.280	2.162	10	5		CEBERM
CCN(c1ccc([N+](=O)[O-])cc1)[C@@H](C)CC(=O)[O-]	ZINC000061181815	521492362	/nfs/dbraw/zinc/49/23/62/521492362.db2.gz	RTJQIUHOBSYUNB-VIFPVBQESA-N	-1	0	252.270	2.284	10	5		CEBERM
CCN(c1cccc(F)c1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061171381	521496090	/nfs/dbraw/zinc/49/60/90/521496090.db2.gz	BPOFJKJJAFHDCJ-UHFFFAOYSA-N	-1	0	270.260	2.423	10	5		CEBERM
CCn1ccnc1COc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000054743621	523541877	/nfs/dbraw/zinc/54/18/77/523541877.db2.gz	AOJGOYPUVDTHQD-UHFFFAOYSA-N	-1	0	291.263	2.088	10	5		CEBERM
CN(c1cccc(F)c1[N+](=O)[O-])C(C)(C)C(=O)[O-]	ZINC000061171090	523646975	/nfs/dbraw/zinc/64/69/75/523646975.db2.gz	RFAJCVWBQAXERQ-UHFFFAOYSA-N	-1	0	256.233	2.033	10	5		CEBERM
CO[C@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000050375439	523981185	/nfs/dbraw/zinc/98/11/85/523981185.db2.gz	ZQQYVSZNGBOKIT-RYUDHWBXSA-N	-1	0	280.280	2.272	10	5		CEBERM
Cc1cc(C)c(OCCCC(=O)[O-])c([N+](=O)[O-])c1	ZINC000050441748	524310383	/nfs/dbraw/zinc/31/03/83/524310383.db2.gz	KFSQZHZWDAHGRS-UHFFFAOYSA-N	-1	0	253.254	2.455	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1-c1noc([C@H]2C[C@H]2C(=O)[O-])n1	ZINC000050441235	526069638	/nfs/dbraw/zinc/06/96/38/526069638.db2.gz	QBTIXLPTDDRBBB-VHSXEESVSA-N	-1	0	289.247	2.141	10	5		CEBERM
O=C([O-])c1cccc(NCc2cccc([N+](=O)[O-])c2)n1	ZINC000052926090	526392116	/nfs/dbraw/zinc/39/21/16/526392116.db2.gz	PNRWGDFHQCLBPL-UHFFFAOYSA-N	-1	0	273.248	2.300	10	5		CEBERM
O=C([O-])c1coc(-c2cc(F)c(F)cc2[N+](=O)[O-])n1	ZINC000051075458	526405824	/nfs/dbraw/zinc/40/58/24/526405824.db2.gz	AQDKMFNXRKTTKH-UHFFFAOYSA-N	-1	0	270.147	2.226	10	5		CEBERM
O=C([O-])CC[C@@H]1CCCCN1c1ccncc1[N+](=O)[O-]	ZINC000050923899	527596026	/nfs/dbraw/zinc/59/60/26/527596026.db2.gz	MFIWUTNPSTVQHZ-JTQLQIEISA-N	-1	0	279.296	2.214	10	5		CEBERM
O=C([O-])[C@@H](O)c1ccc([N+](=O)[O-])c(Cl)c1Cl	ZINC000396123217	344845406	/nfs/dbraw/zinc/84/54/06/344845406.db2.gz	YJAPEVINTYVAEV-ZETCQYMHSA-N	-1	0	266.036	2.020	10	5		CEBERM
Cc1cc(C)n(-c2sc(C(=O)[O-])cc2[N+](=O)[O-])n1	ZINC000039124079	301235282	/nfs/dbraw/zinc/23/52/82/301235282.db2.gz	FKJVDZIOVCSSQW-UHFFFAOYSA-N	-1	0	267.266	2.157	10	5		CEBERM
Cc1c(NC(=O)[C@H]2[C@H](C(=O)[O-])C2(C)C)cccc1[N+](=O)[O-]	ZINC000085408013	179055578	/nfs/dbraw/zinc/05/55/78/179055578.db2.gz	INKQJXSSGONOTI-GHMZBOCLSA-N	-1	0	292.291	2.199	10	5		CEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1NC[C@@H]1CCCC[C@H]1O	ZINC000086017044	179216782	/nfs/dbraw/zinc/21/67/82/179216782.db2.gz	WGKQRCKEAAUFSD-TVQRCGJNSA-N	-1	0	294.307	2.256	10	5		CEBERM
CCCc1nn(C)c(S[C@@H](C)CC(=O)[O-])c1[N+](=O)[O-]	ZINC000090098659	179914217	/nfs/dbraw/zinc/91/42/17/179914217.db2.gz	NMHRWWVIIPKSAN-ZETCQYMHSA-N	-1	0	287.341	2.236	10	5		CEBERM
C[C@@H](C(=O)[O-])N(C)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000054054991	295801062	/nfs/dbraw/zinc/80/10/62/295801062.db2.gz	IHDRQPLAVOCOJM-LURJTMIESA-N	-1	0	258.661	2.158	10	5		CEBERM
CCC[C@](C)(Nc1ncc(C)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000090691645	180024553	/nfs/dbraw/zinc/02/45/53/180024553.db2.gz	YYERIJLPFVPHMI-LBPRGKRZSA-N	-1	0	267.285	2.354	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@@](C)(C(=O)[O-])C1CC1	ZINC000091555889	180190400	/nfs/dbraw/zinc/19/04/00/180190400.db2.gz	BNNMMVIPFFHOGH-CYBMUJFWSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCCn1nc(C)c([N+](=O)[O-])c1N[C@@H](C)CCC(=O)[O-]	ZINC000091555396	180190436	/nfs/dbraw/zinc/19/04/36/180190436.db2.gz	HXIAUWFYOAJFBX-QMMMGPOBSA-N	-1	0	284.316	2.175	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCC[C@@H](C(=O)[O-])C1	ZINC000091556595	180190862	/nfs/dbraw/zinc/19/08/62/180190862.db2.gz	AQETVORPXARLPS-NXEZZACHSA-N	-1	0	296.327	2.175	10	5		CEBERM
CC(C)C[C@@H](Nc1c([N+](=O)[O-])c(C(C)C)nn1C)C(=O)[O-]	ZINC000091579769	180198606	/nfs/dbraw/zinc/19/86/06/180198606.db2.gz	UNXJSMBCAHFCCP-SECBINFHSA-N	-1	0	298.343	2.363	10	5		CEBERM
Cc1cc(N2CCCCC[C@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000092026497	180308356	/nfs/dbraw/zinc/30/83/56/180308356.db2.gz	OXMDRDNDXYXTCL-JTQLQIEISA-N	-1	0	279.296	2.132	10	5		CEBERM
C[C@@H]1CN(c2cc([N+](=O)[O-])ccc2C(=O)[O-])C[C@H]1C	ZINC000092090971	180322269	/nfs/dbraw/zinc/32/22/69/180322269.db2.gz	PVSBRSHKKIHRHO-RKDXNWHRSA-N	-1	0	264.281	2.385	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1N[C@H]1C=C[C@@H](C(=O)[O-])C1	ZINC000092182705	180339015	/nfs/dbraw/zinc/33/90/15/180339015.db2.gz	YIUNPALMFNDIHH-ZJUUUORDSA-N	-1	0	262.265	2.344	10	5		CEBERM
COc1cc(N[C@@H]2C=C[C@H](C(=O)[O-])C2)c([N+](=O)[O-])cc1F	ZINC000092182752	180339471	/nfs/dbraw/zinc/33/94/71/180339471.db2.gz	QCOVINRONGDQAD-JGVFFNPUSA-N	-1	0	296.254	2.184	10	5		CEBERM
Cc1c(=O)n(-c2cccc([N+](=O)[O-])c2)[n-]c1C(F)(F)F	ZINC000111308868	186395243	/nfs/dbraw/zinc/39/52/43/186395243.db2.gz	WFFQMFLXUUVOFX-LURJTMIESA-N	-1	0	287.197	2.496	10	5		CEBERM
Cc1c(C(F)(F)F)ccc([N+](=O)[O-])c1[C@H](O)C(=O)[O-]	ZINC000575673422	366323290	/nfs/dbraw/zinc/32/32/90/366323290.db2.gz	JOIIVOYPDDMDAT-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
Cc1cc(CC(=O)[O-])cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575666178	366323600	/nfs/dbraw/zinc/32/36/00/366323600.db2.gz	HCKFOQHFFWBVQL-UHFFFAOYSA-N	-1	0	261.180	2.132	10	5		CEBERM
Cc1cc(CC(=O)[O-])c(OC(F)(F)F)cc1[N+](=O)[O-]	ZINC000575673709	366325057	/nfs/dbraw/zinc/32/50/57/366325057.db2.gz	MEDFVVVLYKCRDE-UHFFFAOYSA-N	-1	0	279.170	2.429	10	5		CEBERM
COc1cc(C(F)(F)F)c([N+](=O)[O-])cc1CC(=O)[O-]	ZINC000575679475	366326241	/nfs/dbraw/zinc/32/62/41/366326241.db2.gz	TWLOQQSKRLYRGG-UHFFFAOYSA-N	-1	0	279.170	2.249	10	5		CEBERM
CCOc1ccc(CC(=O)[O-])c([N+](=O)[O-])c1OC(F)F	ZINC000575657109	366316371	/nfs/dbraw/zinc/31/63/71/366316371.db2.gz	JIIPRFZMTBWNFG-UHFFFAOYSA-N	-1	0	291.206	2.222	10	5		CEBERM
O=C([O-])[C@H](O)c1cc(Cl)c([N+](=O)[O-])cc1C(F)(F)F	ZINC000575694275	366331352	/nfs/dbraw/zinc/33/13/52/366331352.db2.gz	LBJJPRLPPNSBJS-SSDOTTSWSA-N	-1	0	299.588	2.385	10	5		CEBERM
O=C([O-])[C@@H](O)c1c([N+](=O)[O-])cc(Cl)cc1C(F)(F)F	ZINC000575694053	366331776	/nfs/dbraw/zinc/33/17/76/366331776.db2.gz	IDFHKCZJMOOHRI-ZETCQYMHSA-N	-1	0	299.588	2.385	10	5		CEBERM
CCOC(=O)Cc1c([O-])cc([N+](=O)[O-])cc1Cl	ZINC000575701304	366333958	/nfs/dbraw/zinc/33/39/58/366333958.db2.gz	UVQPWTUCYKHRGW-UHFFFAOYSA-N	-1	0	259.645	2.059	10	5		CEBERM
O=C([O-])[C@@]12CCC[C@H]1CN(c1ccc(F)cc1[N+](=O)[O-])C2	ZINC000263542139	304168832	/nfs/dbraw/zinc/16/88/32/304168832.db2.gz	DMABFWUOYYXJPH-LKFCYVNXSA-N	-1	0	294.282	2.425	10	5		CEBERM
O=C([O-])c1sc(Br)cc1[N+](=O)[O-]	ZINC000022012924	304285592	/nfs/dbraw/zinc/28/55/92/304285592.db2.gz	HJCDDONOCCNMLW-UHFFFAOYSA-N	-1	0	252.045	2.117	10	5		CEBERM
O=C([O-])c1cc(OC(F)(F)F)cc([N+](=O)[O-])c1	ZINC000575345634	395660551	/nfs/dbraw/zinc/66/05/51/395660551.db2.gz	IHBXVJDKTNZJQN-UHFFFAOYSA-N	-1	0	251.116	2.192	10	5		CEBERM
O=C([O-])c1cnn(-c2ccc([N+](=O)[O-])cc2Cl)c1	ZINC000020353660	171156638	/nfs/dbraw/zinc/15/66/38/171156638.db2.gz	XLQUKCKLBHKTLQ-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
CN(CCCC(=O)[O-])c1cccc(F)c1[N+](=O)[O-]	ZINC000037418926	173196243	/nfs/dbraw/zinc/19/62/43/173196243.db2.gz	VKZGNAZKXAYXJU-UHFFFAOYSA-N	-1	0	256.233	2.035	10	5		CEBERM
COc1ccc(OCc2ccc([N+](=O)[O-])o2)c(C(=O)[O-])c1	ZINC000043334171	175010499	/nfs/dbraw/zinc/01/04/99/175010499.db2.gz	MXJUWGJHCQLJMK-UHFFFAOYSA-N	-1	0	293.231	2.474	10	5		CEBERM
CCCC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000043570398	175067752	/nfs/dbraw/zinc/06/77/52/175067752.db2.gz	PMILFYUHPZFSBU-NSHDSACASA-N	-1	0	298.270	2.107	10	5		CEBERM
Cc1c(NC[C@H]2CCCOC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000044933615	175280801	/nfs/dbraw/zinc/28/08/01/175280801.db2.gz	QTQPGEPRZDSXHZ-SNVBAGLBSA-N	-1	0	294.307	2.440	10	5		CEBERM
CCN(C(=O)c1ccc([N+](=O)[O-])c(F)c1)[C@H](C)CC(=O)[O-]	ZINC000061180874	520089958	/nfs/dbraw/zinc/08/99/58/520089958.db2.gz	FCTFZMCETFEMBY-MRVPVSSYSA-N	-1	0	298.270	2.059	10	5		CEBERM
CCO[C@@H](CCOc1cc(C)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000062763659	520305261	/nfs/dbraw/zinc/30/52/61/520305261.db2.gz	KQXNNEHMSQAQLT-NSHDSACASA-N	-1	0	283.280	2.162	10	5		CEBERM
CCN(C[C@@H](C)C(=O)[O-])c1cccc([N+](=O)[O-])c1	ZINC000061217739	521200372	/nfs/dbraw/zinc/20/03/72/521200372.db2.gz	OQYPEAJTLJWJKB-SECBINFHSA-N	-1	0	252.270	2.142	10	5		CEBERM
CCN(C[C@H](C)C(=O)[O-])c1ccc(C)cc1[N+](=O)[O-]	ZINC000061217919	521247302	/nfs/dbraw/zinc/24/73/02/521247302.db2.gz	FJAKWXYXOPOGKN-JTQLQIEISA-N	-1	0	266.297	2.450	10	5		CEBERM
CCOc1oc(-c2ccc([N+](=O)[O-])cc2)nc1C(=O)[O-]	ZINC000061641397	521629405	/nfs/dbraw/zinc/62/94/05/521629405.db2.gz	YYJGJQJIGKVHLZ-UHFFFAOYSA-N	-1	0	278.220	2.347	10	5		CEBERM
CC[C@@H]1COCCN1c1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000050030412	523502532	/nfs/dbraw/zinc/50/25/32/523502532.db2.gz	FNKFRHJLORGTSR-MRVPVSSYSA-N	-1	0	298.270	2.047	10	5		CEBERM
Cc1cc(NC(=O)[C@H]2[C@H](C(=O)[O-])C2(C)C)ccc1[N+](=O)[O-]	ZINC000068688773	525237504	/nfs/dbraw/zinc/23/75/04/525237504.db2.gz	FBHYIMCYWVMQLJ-GHMZBOCLSA-N	-1	0	292.291	2.199	10	5		CEBERM
C[C@@](Nc1cc([N+](=O)[O-])ccn1)(C(=O)[O-])c1ccccc1	ZINC000052879912	525756497	/nfs/dbraw/zinc/75/64/97/525756497.db2.gz	MCRVXFMAZMFCPS-AWEZNQCLSA-N	-1	0	287.275	2.402	10	5		CEBERM
C[C@@](Nc1ncccc1[N+](=O)[O-])(C(=O)[O-])c1ccccc1	ZINC000052879830	525757270	/nfs/dbraw/zinc/75/72/70/525757270.db2.gz	VDLHSVHAZNRQMH-AWEZNQCLSA-N	-1	0	287.275	2.402	10	5		CEBERM
O=C([O-])[C@H](Nc1ccc([N+](=O)[O-])nc1)c1ccccc1	ZINC000050506967	526315112	/nfs/dbraw/zinc/31/51/12/526315112.db2.gz	OYGPCNQIVWQFBM-GFCCVEGCSA-N	-1	0	273.248	2.228	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NC(=O)C1CCCC1	ZINC000060362162	526355212	/nfs/dbraw/zinc/35/52/12/526355212.db2.gz	PKFOYLRBDNHWMV-UHFFFAOYSA-N	-1	0	278.264	2.422	10	5		CEBERM
O=C([O-])C(F)(F)Oc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000050469920	527551059	/nfs/dbraw/zinc/55/10/59/527551059.db2.gz	OTUYAKCTXLHOLP-UHFFFAOYSA-N	-1	0	267.571	2.304	10	5		CEBERM
CCC[C@@H](Nc1cc(OC)c([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000227855232	639608223	/nfs/dbraw/zinc/60/82/23/639608223.db2.gz	GTUSRDIWPIRJFF-MRVPVSSYSA-N	-1	0	286.259	2.408	10	5		CEBERM
O=C([O-])[C@@H]1Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@H]12	ZINC000005347437	136394445	/nfs/dbraw/zinc/39/44/45/136394445.db2.gz	RIKMSJBWDDECKT-DGCLKSJQSA-N	-1	0	276.292	2.211	10	5		CEBERM
Cc1ccc([N+](=O)[O-])c(Br)c1C(=O)[O-]	ZINC000307642184	344723658	/nfs/dbraw/zinc/72/36/58/344723658.db2.gz	LFBRDFUCYWHUSY-UHFFFAOYSA-N	-1	0	260.043	2.364	10	5		CEBERM
O=C([O-])[C@H](O)c1c(Cl)ccc([N+](=O)[O-])c1Cl	ZINC000396119558	344845517	/nfs/dbraw/zinc/84/55/17/344845517.db2.gz	PLWDLTIQNMJZBG-SSDOTTSWSA-N	-1	0	266.036	2.020	10	5		CEBERM
O=C([O-])[C@@H]1CCCC[C@@H]1Nc1ncccc1[N+](=O)[O-]	ZINC000085330303	179020286	/nfs/dbraw/zinc/02/02/86/179020286.db2.gz	YFXBALKIJJTQON-BDAKNGLRSA-N	-1	0	265.269	2.045	10	5		CEBERM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000085407988	179055436	/nfs/dbraw/zinc/05/54/36/179055436.db2.gz	BRNLXLIBKTYZCH-NXEZZACHSA-N	-1	0	296.254	2.029	10	5		CEBERM
O=C([O-])c1ccc(NC[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000086016871	179216400	/nfs/dbraw/zinc/21/64/00/179216400.db2.gz	LOLNHPKHBXIJBD-GXFFZTMASA-N	-1	0	294.307	2.256	10	5		CEBERM
O=C([O-])CC1(COc2cccc([N+](=O)[O-])c2)CC1	ZINC000088256560	179571536	/nfs/dbraw/zinc/57/15/36/179571536.db2.gz	DTDTYNWRBAPSEQ-UHFFFAOYSA-N	-1	0	251.238	2.229	10	5		CEBERM
Cc1c(S[C@H](C)CCO)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000091261737	180116077	/nfs/dbraw/zinc/11/60/77/180116077.db2.gz	HGFQHIVFPFZJPE-SSDOTTSWSA-N	-1	0	285.321	2.464	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCC[C@H](C(=O)[O-])C1	ZINC000091556591	180190179	/nfs/dbraw/zinc/19/01/79/180190179.db2.gz	AQETVORPXARLPS-VHSXEESVSA-N	-1	0	296.327	2.175	10	5		CEBERM
CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1CCC[C@H]1C(=O)[O-]	ZINC000091550256	180188760	/nfs/dbraw/zinc/18/87/60/180188760.db2.gz	GMACKTZCMWFGFC-VHSXEESVSA-N	-1	0	296.327	2.032	10	5		CEBERM
CCC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1CCC)C(=O)[O-]	ZINC000091554370	180189720	/nfs/dbraw/zinc/18/97/20/180189720.db2.gz	MSTLMCCQYYTGDG-SECBINFHSA-N	-1	0	284.316	2.175	10	5		CEBERM
O=C([O-])c1cc(NN2CCCCC2)ccc1[N+](=O)[O-]	ZINC000105790693	186072101	/nfs/dbraw/zinc/07/21/01/186072101.db2.gz	NTPPRVLPLBBBTL-UHFFFAOYSA-N	-1	0	265.269	2.106	10	5		CEBERM
O=C([O-])[C@@H]1C=C[C@H](Nc2ccc([N+](=O)[O-])cc2F)C1	ZINC000092182873	180339372	/nfs/dbraw/zinc/33/93/72/180339372.db2.gz	SQEKGFOQJLYGOC-SFYZADRCSA-N	-1	0	266.228	2.175	10	5		CEBERM
O=C([O-])[C@H]1C=C[C@H](Nc2cc(F)cc([N+](=O)[O-])c2)C1	ZINC000092183578	180339653	/nfs/dbraw/zinc/33/96/53/180339653.db2.gz	NXIQVNLWFKMKRQ-CBAPKCEASA-N	-1	0	266.228	2.175	10	5		CEBERM
CC(C)(C)N(CC(=O)[O-])C(=O)c1ccc([N+](=O)[O-])c(F)c1	ZINC000092447510	180386928	/nfs/dbraw/zinc/38/69/28/180386928.db2.gz	XNSMHNIJCXKBRU-UHFFFAOYSA-N	-1	0	298.270	2.059	10	5		CEBERM
COc1cc(N[C@H](C(=O)[O-])C(C)C)c([N+](=O)[O-])cc1F	ZINC000110624900	186306255	/nfs/dbraw/zinc/30/62/55/186306255.db2.gz	FWYHUTJJZDOOJI-NSHDSACASA-N	-1	0	286.259	2.264	10	5		CEBERM
CCOCCN(CC)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000111125429	186354782	/nfs/dbraw/zinc/35/47/82/186354782.db2.gz	OYNKBYRRNDSMJU-UHFFFAOYSA-N	-1	0	296.323	2.464	10	5		CEBERM
Cc1c(=O)n(-c2ccc([N+](=O)[O-])cc2)[n-]c1C(F)(F)F	ZINC000111308796	186394240	/nfs/dbraw/zinc/39/42/40/186394240.db2.gz	FWHTZGQCCBRMGG-LURJTMIESA-N	-1	0	287.197	2.496	10	5		CEBERM
Cc1cc([C@@H](O)C(=O)[O-])c([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000575673063	366323762	/nfs/dbraw/zinc/32/37/62/366323762.db2.gz	AFAFVSAWBAYGMI-MRVPVSSYSA-N	-1	0	279.170	2.040	10	5		CEBERM
COc1cc([N+](=O)[O-])c(C(F)(F)F)cc1C(=O)[O-]	ZINC000575673122	366323846	/nfs/dbraw/zinc/32/38/46/366323846.db2.gz	CYBCVBPIVRBZDQ-UHFFFAOYSA-N	-1	0	265.143	2.320	10	5		CEBERM
Cc1cc([N+](=O)[O-])cc([C@H](O)C(=O)[O-])c1C(F)(F)F	ZINC000575673717	366324942	/nfs/dbraw/zinc/32/49/42/366324942.db2.gz	MNHITYABWYHJIY-QMMMGPOBSA-N	-1	0	279.170	2.040	10	5		CEBERM
CCc1cc(CC(=O)[O-])c(OC(F)F)c([N+](=O)[O-])c1	ZINC000575658637	366318733	/nfs/dbraw/zinc/31/87/33/366318733.db2.gz	CZDRYKGUJBSSBU-UHFFFAOYSA-N	-1	0	275.207	2.386	10	5		CEBERM
O=[N+]([O-])c1ccc(I)c(F)c1[O-]	ZINC000575707071	366337638	/nfs/dbraw/zinc/33/76/38/366337638.db2.gz	IXQRSMNYEXCJFS-UHFFFAOYSA-N	-1	0	282.996	2.044	10	5		CEBERM
C[C@H](C(=O)[O-])[C@H](C)n1ncc2ccc([N+](=O)[O-])cc21	ZINC000093017620	184642503	/nfs/dbraw/zinc/64/25/03/184642503.db2.gz	FHDFYPKBRHNYFM-YUMQZZPRSA-N	-1	0	263.253	2.226	10	5		CEBERM
CC[C@@](C)(Nc1ccc([N+](=O)[O-])cc1F)C(=O)[O-]	ZINC000094221827	184765116	/nfs/dbraw/zinc/76/51/16/184765116.db2.gz	MBXBDKHLBVPKJN-LLVKDONJSA-N	-1	0	256.233	2.399	10	5		CEBERM
O=C([O-])[C@H]1CCCCC[C@H]1Nc1ccc([N+](=O)[O-])cn1	ZINC000094745049	184851681	/nfs/dbraw/zinc/85/16/81/184851681.db2.gz	LXBMDBHSMTZMIX-WDEREUQCSA-N	-1	0	279.296	2.435	10	5		CEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NCc1ccncc1	ZINC000020557722	171250600	/nfs/dbraw/zinc/25/06/00/171250600.db2.gz	SNGHHDAETINIPH-UHFFFAOYSA-N	-1	0	273.248	2.300	10	5		CEBERM
O=C([O-])c1cc(-n2ccc([N+](=O)[O-])n2)nc2ccccc21	ZINC000040517169	174307362	/nfs/dbraw/zinc/30/73/62/174307362.db2.gz	RXWYDHCEQXFGCI-UHFFFAOYSA-N	-1	0	284.231	2.027	10	5		CEBERM
Cc1ccc(Cn2cc([N+](=O)[O-])cc2C(=O)[O-])cc1	ZINC000041040477	174462967	/nfs/dbraw/zinc/46/29/67/174462967.db2.gz	GEHNURNBHUGKLN-UHFFFAOYSA-N	-1	0	260.249	2.451	10	5		CEBERM
Cc1cnn(-c2cc(C(=O)[O-])cc([N+](=O)[O-])c2C)c1	ZINC000043386519	175032108	/nfs/dbraw/zinc/03/21/08/175032108.db2.gz	CAAHVDBHAUABHG-UHFFFAOYSA-N	-1	0	261.237	2.096	10	5		CEBERM
Cc1c(OCC2CC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000043386597	175032517	/nfs/dbraw/zinc/03/25/17/175032517.db2.gz	DJYMJOSWWOYPRQ-UHFFFAOYSA-N	-1	0	251.238	2.390	10	5		CEBERM
CCO[C@@H](COc1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-]	ZINC000062761221	520315668	/nfs/dbraw/zinc/31/56/68/520315668.db2.gz	RTXHUPLTSKQURK-JTQLQIEISA-N	-1	0	289.671	2.117	10	5		CEBERM
Cc1ccc(N2CCC(C(=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000061700555	524935970	/nfs/dbraw/zinc/93/59/70/524935970.db2.gz	ZBBVEHSQEBUNSL-UHFFFAOYSA-N	-1	0	264.281	2.204	10	5		CEBERM
Cc1c(NC[C@@H]2CCOC2)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000061147387	525869794	/nfs/dbraw/zinc/86/97/94/525869794.db2.gz	BDFOJUAVXOCOOO-VIFPVBQESA-N	-1	0	280.280	2.050	10	5		CEBERM
Cc1ccc([N+](=O)[O-])cc1-c1noc([C@@H]2C[C@H]2C(=O)[O-])n1	ZINC000050441234	526069041	/nfs/dbraw/zinc/06/90/41/526069041.db2.gz	QBTIXLPTDDRBBB-NXEZZACHSA-N	-1	0	289.247	2.141	10	5		CEBERM
O=C([O-])[C@]1(CCc2ccccc2[N+](=O)[O-])CCOC1	ZINC000062727088	526337329	/nfs/dbraw/zinc/33/73/29/526337329.db2.gz	PTTZQSAHGWAIBC-CYBMUJFWSA-N	-1	0	265.265	2.019	10	5		CEBERM
O=C([O-])c1cc(NCc2cccc([N+](=O)[O-])c2)ccn1	ZINC000052926086	526353047	/nfs/dbraw/zinc/35/30/47/526353047.db2.gz	ZVBNZKCHTIYVER-UHFFFAOYSA-N	-1	0	273.248	2.300	10	5		CEBERM
O=C([O-])c1ccc(Cl)cc1-n1cc([N+](=O)[O-])cn1	ZINC000062787693	526369729	/nfs/dbraw/zinc/36/97/29/526369729.db2.gz	OINHUKCZIPNTDR-UHFFFAOYSA-N	-1	0	267.628	2.132	10	5		CEBERM
C[C@@H]1CN(c2c(F)cc([N+](=O)[O-])cc2F)C[C@H]1C(=O)[O-]	ZINC000235374671	625345617	/nfs/dbraw/zinc/34/56/17/625345617.db2.gz	OALMMWLXFCCLFD-HTRCEHHLSA-N	-1	0	286.234	2.030	10	5		CEBERM
CC[C@H]1OCC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000234152025	623216589	/nfs/dbraw/zinc/21/65/89/623216589.db2.gz	HQPPSDLCSSCDFB-BXKDBHETSA-N	-1	0	280.280	2.054	10	5		CEBERM