smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1CC(C(=O)[O-])(c2cccc([N+](=O)[O-])c2)C1	ZINC000232275160	398164466	/nfs/dbraw/zinc/16/44/66/398164466.db2.gz	GJYVEPMWFCIUKX-UHFFFAOYSA-N	-1	0	235.239	2.347	10	5		BEBERM
O=C([O-])c1c(O)ccc2nc3ccccc3nc21	ZINC000014502686	343125330	/nfs/dbraw/zinc/12/53/30/343125330.db2.gz	GXLWPTUCVZRTBQ-UHFFFAOYSA-N	-1	0	240.218	2.187	10	5		BEBERM
Cc1ccc([N+](=O)[O-])c(C)c1/C=C/C(=O)[O-]	ZINC000396113907	344605963	/nfs/dbraw/zinc/60/59/63/344605963.db2.gz	OONBISYGIYZIQW-GQCTYLIASA-N	-1	0	221.212	2.309	10	5		BEBERM
O=[N+]([O-])c1cc([O-])cc(Br)c1F	ZINC000307466843	352616042	/nfs/dbraw/zinc/61/60/42/352616042.db2.gz	OKVJKVNVHKDPDI-UHFFFAOYSA-N	-1	0	235.996	2.202	10	5		BEBERM
O=C([O-])c1c(Cl)ccc(F)c1[N+](=O)[O-]	ZINC000306923333	353045024	/nfs/dbraw/zinc/04/50/24/353045024.db2.gz	ZOAWNFQERBTHEE-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
Cc1cc([C@@H](C)C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000140436461	372675350	/nfs/dbraw/zinc/67/53/50/372675350.db2.gz	VXEOJYKDIYIGBW-SSDOTTSWSA-N	-1	0	209.201	2.091	10	5		BEBERM
CC(=O)c1cc([O-])c([N+](=O)[O-])cc1OC(F)F	ZINC000575663194	384422344	/nfs/dbraw/zinc/42/23/44/384422344.db2.gz	SDFREZHLUCOWPK-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
CC(C)OC(=O)c1n[n-]c2cc([N+](=O)[O-])ccc21	ZINC000575432093	387056934	/nfs/dbraw/zinc/05/69/34/387056934.db2.gz	DPBKJGKDVBMXDH-UHFFFAOYSA-N	-1	0	249.226	2.036	10	5		BEBERM
O=[N+]([O-])c1cc(F)cc([O-])c1OC(F)F	ZINC000575661952	387159254	/nfs/dbraw/zinc/15/92/54/387159254.db2.gz	WVRPTGDIQPFJHA-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
Cc1cc(C(=O)[O-])c([N+](=O)[O-])cc1OC(F)F	ZINC000575667463	387319024	/nfs/dbraw/zinc/31/90/24/387319024.db2.gz	NKUJVRMTKHYZAV-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
Cc1ccc([N+](=O)[O-])c([O-])c1OC(F)F	ZINC000575665446	387313897	/nfs/dbraw/zinc/31/38/97/387313897.db2.gz	DVMLMABNXBNQGP-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
Cc1c(C(=O)[O-])ccc([N+](=O)[O-])c1OC(F)F	ZINC000575667357	387317329	/nfs/dbraw/zinc/31/73/29/387317329.db2.gz	MOZHYTOGIRGARV-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
CC(=O)c1cc([N+](=O)[O-])c(OC(F)F)cc1[O-]	ZINC000575663360	387287416	/nfs/dbraw/zinc/28/74/16/387287416.db2.gz	XHIKBEBIIAHTMI-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
COc1cc(C)c([N+](=O)[O-])c(/C=C/C(=O)[O-])c1	ZINC000575674718	387358389	/nfs/dbraw/zinc/35/83/89/387358389.db2.gz	USYCGTPSRGUVHQ-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
COc1cc([N+](=O)[O-])c(Br)cc1[O-]	ZINC000575691205	387378810	/nfs/dbraw/zinc/37/88/10/387378810.db2.gz	JUDSJPQBIPLMLE-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
Cc1c([N+](=O)[O-])ccc(OC(F)F)c1C(=O)[O-]	ZINC000575668268	387325650	/nfs/dbraw/zinc/32/56/50/387325650.db2.gz	TXNAUNKFLKUQCE-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
COc1cc([N+](=O)[O-])cc([O-])c1C(F)F	ZINC000575669308	387326787	/nfs/dbraw/zinc/32/67/87/387326787.db2.gz	RUDQTBNEQDFNDW-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
O=Cc1ccc(C(F)F)c([O-])c1[N+](=O)[O-]	ZINC000575669443	387328377	/nfs/dbraw/zinc/32/83/77/387328377.db2.gz	VTNRATMORADTAZ-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
O=Cc1cc([N+](=O)[O-])c(C(F)F)cc1C(=O)[O-]	ZINC000575670194	387330406	/nfs/dbraw/zinc/33/04/06/387330406.db2.gz	WYBPHMOSORNKDL-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
O=C([O-])c1cc(C(F)F)cc([N+](=O)[O-])c1F	ZINC000575669734	387331282	/nfs/dbraw/zinc/33/12/82/387331282.db2.gz	MBKRZPSQVIPUSM-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
COc1cc(C(F)F)c([N+](=O)[O-])cc1C(=O)[O-]	ZINC000575670772	387335605	/nfs/dbraw/zinc/33/56/05/387335605.db2.gz	BLYMLKJMTLDCGR-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
CCOc1cc(C)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575698772	387391622	/nfs/dbraw/zinc/39/16/22/387391622.db2.gz	JMHJBTJNLGLBTN-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCOC(=O)c1c(Cl)ccc([O-])c1[N+](=O)[O-]	ZINC000575699991	387403411	/nfs/dbraw/zinc/40/34/11/387403411.db2.gz	FZJGVVHJJKYMNJ-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
O=[N+]([O-])c1c(F)ccc(OC(F)F)c1[O-]	ZINC000575661681	387949183	/nfs/dbraw/zinc/94/91/83/387949183.db2.gz	TVVFOSHGSMXBHW-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
O=C([O-])Cc1nc2ccccc2c2ncccc12	ZINC000002456098	388728718	/nfs/dbraw/zinc/72/87/18/388728718.db2.gz	PZTNQJNTUMCVDQ-UHFFFAOYSA-N	-1	0	238.246	2.410	10	5		BEBERM
CCC(=O)c1cc(F)c([O-])c([N+](=O)[O-])c1	ZINC000095883944	168254557	/nfs/dbraw/zinc/25/45/57/168254557.db2.gz	SDGMJBWBRTXGGP-UHFFFAOYSA-N	-1	0	213.164	2.032	10	5		BEBERM
CSc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000050033206	175572811	/nfs/dbraw/zinc/57/28/11/175572811.db2.gz	WXUXNPCMTCIZAM-UHFFFAOYSA-N	-1	0	231.204	2.154	10	5		BEBERM
O=C([O-])c1cc(Cl)c([N+](=O)[O-])cc1F	ZINC000306608402	398223796	/nfs/dbraw/zinc/22/37/96/398223796.db2.gz	VYCFZQAMQMUFFC-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
C/C(=C\c1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000034566155	346950183	/nfs/dbraw/zinc/95/01/83/346950183.db2.gz	IPKIDCQRPLWBFO-VOTSOKGWSA-N	-1	0	207.185	2.083	10	5		BEBERM
Cc1c(F)ccc(/C=C/C(=O)[O-])c1[N+](=O)[O-]	ZINC000396125368	344609898	/nfs/dbraw/zinc/60/98/98/344609898.db2.gz	KROWBQUXQGDWGR-HWKANZROSA-N	-1	0	225.175	2.140	10	5		BEBERM
Cc1c(C)c([N+](=O)[O-])ccc1/C=C/C(=O)[O-]	ZINC000396113145	344605851	/nfs/dbraw/zinc/60/58/51/344605851.db2.gz	MYOCMACVDQIDNX-GQCTYLIASA-N	-1	0	221.212	2.309	10	5		BEBERM
Cc1c(CC(=O)[O-])ccc(Cl)c1[N+](=O)[O-]	ZINC000396160715	344633453	/nfs/dbraw/zinc/63/34/53/344633453.db2.gz	NUAJMEGXSUWVHA-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
Cc1[n-]n(C)c(=O)c1-c1cccc([N+](=O)[O-])c1	ZINC000675053644	537887708	/nfs/dbraw/zinc/88/77/08/537887708.db2.gz	JSPNSKNQFJTKCJ-UHFFFAOYSA-N	-1	0	233.227	2.009	10	5		BEBERM
C[C@@H](CC(=O)[O-])Cc1ccccc1[N+](=O)[O-]	ZINC000168821367	537909123	/nfs/dbraw/zinc/90/91/23/537909123.db2.gz	VHFWWWIFUPQZSB-MRVPVSSYSA-N	-1	0	223.228	2.248	10	5		BEBERM
CC(=O)c1c(O)cc([N+](=O)[O-])cc1OC(F)F	ZINC000575663306	384425006	/nfs/dbraw/zinc/42/50/06/384425006.db2.gz	WEXLXUGXEQTNJC-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
CCOc1cc([O-])c([N+](=O)[O-])c(OC(F)F)c1	ZINC000575658941	387047763	/nfs/dbraw/zinc/04/77/63/387047763.db2.gz	UCTMQHRHFPHTIH-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
CCc1cc([O-])cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575658802	387049509	/nfs/dbraw/zinc/04/95/09/387049509.db2.gz	DTNOBYGIEBUHJS-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
CCOc1cc(OC(F)F)cc([O-])c1[N+](=O)[O-]	ZINC000575659748	387053280	/nfs/dbraw/zinc/05/32/80/387053280.db2.gz	XWJGNSDDZJFQQV-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
CCOc1ccc(OC(F)F)c([N+](=O)[O-])c1[O-]	ZINC000575659737	387053292	/nfs/dbraw/zinc/05/32/92/387053292.db2.gz	XRLGVTVRPKZBLY-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
O=[N+]([O-])c1c([O-])c(F)ccc1OC(F)F	ZINC000575661300	387067743	/nfs/dbraw/zinc/06/77/43/387067743.db2.gz	KQRPXLKDQVDLFY-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
O=C([O-])c1cc2c([nH]1)c([N+](=O)[O-])ccc2Cl	ZINC000536958126	387171543	/nfs/dbraw/zinc/17/15/43/387171543.db2.gz	HJRIDMDMPGOJLA-UHFFFAOYSA-N	-1	0	240.602	2.428	10	5		BEBERM
CC(=O)c1cc(OC(F)F)c([O-])c([N+](=O)[O-])c1	ZINC000575662607	387197569	/nfs/dbraw/zinc/19/75/69/387197569.db2.gz	CVSZAAUXMOBPSF-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
O=Cc1cc([O-])cc(C(F)F)c1[N+](=O)[O-]	ZINC000575667505	387318950	/nfs/dbraw/zinc/31/89/50/387318950.db2.gz	FVRQHVCJJZTFKW-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
CC(=O)c1cc([N+](=O)[O-])cc(OC(F)F)c1[O-]	ZINC000575663391	387286729	/nfs/dbraw/zinc/28/67/29/387286729.db2.gz	YHADEVOZYJDTFX-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
COc1cc([O-])c(Br)cc1[N+](=O)[O-]	ZINC000575692212	387379480	/nfs/dbraw/zinc/37/94/80/387379480.db2.gz	VOSDCXVMSTUABU-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
COc1cc([O-])c([N+](=O)[O-])c(Br)c1	ZINC000575691965	387380050	/nfs/dbraw/zinc/38/00/50/387380050.db2.gz	RIYIIRNIRZGAIM-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
COc1c([O-])c(Br)ccc1[N+](=O)[O-]	ZINC000575690848	387381557	/nfs/dbraw/zinc/38/15/57/387381557.db2.gz	CUIMTNMFYTVZKB-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
CC(=O)c1cc([O-])cc([N+](=O)[O-])c1C(F)F	ZINC000575668835	387321386	/nfs/dbraw/zinc/32/13/86/387321386.db2.gz	OOGRCYGNERIBII-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
Cc1ccc(OC(F)F)c([N+](=O)[O-])c1[O-]	ZINC000575668090	387325043	/nfs/dbraw/zinc/32/50/43/387325043.db2.gz	QPGSGCJZHWHWOO-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
COc1c(/C=C/C(=O)[O-])c(C)ccc1[N+](=O)[O-]	ZINC000575673102	387339376	/nfs/dbraw/zinc/33/93/76/387339376.db2.gz	CIIRXUVZTJRYPV-GQCTYLIASA-N	-1	0	237.211	2.010	10	5		BEBERM
COc1cc(C(F)F)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575671857	387341815	/nfs/dbraw/zinc/34/18/15/387341815.db2.gz	NZIWRKCORFAGIU-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
CCOc1cc([N+](=O)[O-])cc(CC)c1C(=O)[O-]	ZINC000575697597	387392641	/nfs/dbraw/zinc/39/26/41/387392641.db2.gz	ZZBQSIBLEVAGPQ-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1cc(CC)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575696408	387397856	/nfs/dbraw/zinc/39/78/56/387397856.db2.gz	NJCLOYVDXXGZRB-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOC(=O)c1cc(Cl)cc([O-])c1[N+](=O)[O-]	ZINC000575700514	387403722	/nfs/dbraw/zinc/40/37/22/387403722.db2.gz	LQPNEVTXRAIGIT-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
COc1ccc([N+](=O)[O-])c(Br)c1[O-]	ZINC000091297339	388610946	/nfs/dbraw/zinc/61/09/46/388610946.db2.gz	BAADLJBNKVHGKS-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
CCC(=O)c1cc(C)cc([N+](=O)[O-])c1[O-]	ZINC000002573991	168254617	/nfs/dbraw/zinc/25/46/17/168254617.db2.gz	CBYZMXQAOPOQBI-UHFFFAOYSA-N	-1	0	209.201	2.202	10	5		BEBERM
C[C@@H](Sc1cc(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000052118857	176009377	/nfs/dbraw/zinc/00/93/77/176009377.db2.gz	PTNMJAWAVKTMLH-RXMQYKEDSA-N	-1	0	245.231	2.299	10	5		BEBERM
C[C@H]1C[C@@H]1Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000052293623	177350674	/nfs/dbraw/zinc/35/06/74/177350674.db2.gz	RZYMPWWPLGJZLC-RCOVLWMOSA-N	-1	0	236.227	2.113	10	5		BEBERM
O=C([O-])[C@@H]1C[C@H]1c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000757169521	586433054	/nfs/dbraw/zinc/43/30/54/586433054.db2.gz	WSROFWDLORBPLF-JGVFFNPUSA-N	-1	0	241.630	2.436	10	5		BEBERM
Cc1ccc(SCC(=O)[O-])cc1[N+](=O)[O-]	ZINC000061700645	187322761	/nfs/dbraw/zinc/32/27/61/187322761.db2.gz	YZPAPURRTJKPQA-UHFFFAOYSA-N	-1	0	227.241	2.080	10	5		BEBERM
O=C([O-])c1c(=O)nc2c3cccc4cccc(c1-2)c34	ZINC000039133501	187263512	/nfs/dbraw/zinc/26/35/12/187263512.db2.gz	QVYZVXCAGFXPEW-UHFFFAOYSA-N	-1	0	249.225	2.427	10	5		BEBERM
C[C@H](CC(=O)[O-])Cc1ccccc1[N+](=O)[O-]	ZINC000168821473	537848180	/nfs/dbraw/zinc/84/81/80/537848180.db2.gz	VHFWWWIFUPQZSB-QMMMGPOBSA-N	-1	0	223.228	2.248	10	5		BEBERM
Cc1cc(/C=C/C(=O)[O-])c([N+](=O)[O-])cc1C	ZINC000396118166	344607552	/nfs/dbraw/zinc/60/75/52/344607552.db2.gz	YRAXDRYDGLVDEK-ONEGZZNKSA-N	-1	0	221.212	2.309	10	5		BEBERM
O=[N+]([O-])c1cncc([S-])c1Br	ZINC000306824436	351131526	/nfs/dbraw/zinc/13/15/26/351131526.db2.gz	UCMHEENBMPSIBM-UHFFFAOYSA-N	-1	0	235.062	2.041	10	5		BEBERM
CC(C)N(C)c1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000019844977	187590210	/nfs/dbraw/zinc/59/02/10/187590210.db2.gz	LLOHHMXJVUMVIN-UHFFFAOYSA-N	-1	0	238.243	2.138	10	5		BEBERM
Cc1cc(Cl)c([N+](=O)[O-])cc1[S@@](=O)[O-]	ZINC000125993707	538529016	/nfs/dbraw/zinc/52/90/16/538529016.db2.gz	GSERCRXAMPOJKB-UHFFFAOYSA-N	-1	0	235.648	2.137	10	5		BEBERM
O=[N+]([O-])c1ccc(C([O-])=C2CC2(F)F)cc1	ZINC000584608155	358268669	/nfs/dbraw/zinc/26/86/69/358268669.db2.gz	XCMCPTXGEJSCLN-MRVPVSSYSA-N	-1	0	227.166	2.433	10	5		BEBERM
CO[C@@H](C)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000584635086	358319504	/nfs/dbraw/zinc/31/95/04/358319504.db2.gz	PZWRYYARRGRLSF-LURJTMIESA-N	-1	0	225.200	2.000	10	5		BEBERM
O=c1c2c([n-]n1-c1cccc([N+](=O)[O-])c1)CCC2	ZINC000104707319	358351825	/nfs/dbraw/zinc/35/18/25/358351825.db2.gz	TZERFYFWHDIQJH-JTQLQIEISA-N	-1	0	245.238	2.098	10	5		BEBERM
CSc1cc(F)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000130253482	358987941	/nfs/dbraw/zinc/98/79/41/358987941.db2.gz	XXEJBXVVZCHLDS-UHFFFAOYSA-N	-1	0	231.204	2.154	10	5		BEBERM
O=C([O-])c1c(Cl)ccc([N+](=O)[O-])c1F	ZINC000215586656	371588613	/nfs/dbraw/zinc/58/86/13/371588613.db2.gz	APMNCSWWCVNTCO-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
CCc1cc([O-])c([N+](=O)[O-])cc1OC(F)F	ZINC000575660501	384408954	/nfs/dbraw/zinc/40/89/54/384408954.db2.gz	QKSBXUFLAQYMPH-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
CC(=O)c1cc([O-])c([N+](=O)[O-])cc1C(F)F	ZINC000575668255	384446503	/nfs/dbraw/zinc/44/65/03/384446503.db2.gz	LUWICNUMJPTKPO-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
Cc1cc([N+](=O)[O-])cc(OC(F)F)c1C(=O)[O-]	ZINC000575665186	384432542	/nfs/dbraw/zinc/43/25/42/384432542.db2.gz	BXNMRQBTOKKVNW-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
Cc1cc([N+](=O)[O-])cc(C(=O)[O-])c1OC(F)F	ZINC000575667512	384443688	/nfs/dbraw/zinc/44/36/88/384443688.db2.gz	OAZUYQFMKZPEHV-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
CCOc1ccc([O-])c([N+](=O)[O-])c1OC(F)F	ZINC000575657980	387050547	/nfs/dbraw/zinc/05/05/47/387050547.db2.gz	NWPVPVXFRRLJRE-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
O=[N+]([O-])c1ccc(F)c(OC(F)F)c1[O-]	ZINC000575661064	387050709	/nfs/dbraw/zinc/05/07/09/387050709.db2.gz	HSAPVEFDDUFWGL-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
CC[C@@H](Cc1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000040377742	387058357	/nfs/dbraw/zinc/05/83/57/387058357.db2.gz	LOMPHOSQUBPVRP-QMMMGPOBSA-N	-1	0	223.228	2.248	10	5		BEBERM
CC(=O)c1ccc(OC(F)F)c([O-])c1[N+](=O)[O-]	ZINC000575663385	387287372	/nfs/dbraw/zinc/28/73/72/387287372.db2.gz	XYXDETUYTWIHIO-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
O=Cc1cc([O-])c(C(F)F)c([N+](=O)[O-])c1	ZINC000575668774	387327681	/nfs/dbraw/zinc/32/76/81/387327681.db2.gz	NVUBHMKNDFTJQR-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
COc1cc([N+](=O)[O-])cc(C(F)F)c1[O-]	ZINC000575668758	387327941	/nfs/dbraw/zinc/32/79/41/387327941.db2.gz	NGBWKXQYTONXIQ-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
CC(=O)c1cc(C(F)F)cc([N+](=O)[O-])c1[O-]	ZINC000575669448	387328912	/nfs/dbraw/zinc/32/89/12/387328912.db2.gz	VUUQLDUYHYDEAH-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
O=Cc1cc([N+](=O)[O-])c(C(F)F)cc1[O-]	ZINC000575669499	387329955	/nfs/dbraw/zinc/32/99/55/387329955.db2.gz	YGSNDHIAEZVNEV-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
O=C([O-])c1cc([N+](=O)[O-])c(C(F)F)cc1F	ZINC000575669717	387330417	/nfs/dbraw/zinc/33/04/17/387330417.db2.gz	KYETWAXNQJKTNK-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
Cc1cc(C(=O)[O-])cc([N+](=O)[O-])c1OC(F)F	ZINC000575669128	387332938	/nfs/dbraw/zinc/33/29/38/387332938.db2.gz	YRQCQTJTBXPXGT-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
COc1cc([N+](=O)[O-])cc(C(=O)[O-])c1C(F)F	ZINC000575670896	387335751	/nfs/dbraw/zinc/33/57/51/387335751.db2.gz	DZMBPRAZABEJNF-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1cc(/C=C/C(=O)[O-])c(C)c([N+](=O)[O-])c1	ZINC000575673421	387338004	/nfs/dbraw/zinc/33/80/04/387338004.db2.gz	KUCMPTPHXZHMBE-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
COc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C(F)F	ZINC000575671848	387341804	/nfs/dbraw/zinc/34/18/04/387341804.db2.gz	NXLJBMUVMQTGOX-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1c(C)cc([N+](=O)[O-])cc1/C=C/C(=O)[O-]	ZINC000575673798	387342575	/nfs/dbraw/zinc/34/25/75/387342575.db2.gz	ONULJDKHNPKJTE-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
CCOc1cc([N+](=O)[O-])c(CC)cc1C(=O)[O-]	ZINC000575695420	387396309	/nfs/dbraw/zinc/39/63/09/387396309.db2.gz	IDLPSYSXOVVTLW-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1cc(CC)c([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000575696995	387397418	/nfs/dbraw/zinc/39/74/18/387397418.db2.gz	PXSPXAKOYAIYPY-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1cc([O-])c([N+](=O)[O-])cc1CC	ZINC000575696347	387397623	/nfs/dbraw/zinc/39/76/23/387397623.db2.gz	LYYVZOBRTCVEDL-UHFFFAOYSA-N	-1	0	211.217	2.262	10	5		BEBERM
CCOC(=O)c1c(Cl)ccc([N+](=O)[O-])c1[O-]	ZINC000575701100	387405425	/nfs/dbraw/zinc/40/54/25/387405425.db2.gz	STENDUFNCXCORR-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
COc1cc(F)c([S-])cc1[N+](=O)[O-]	ZINC000575708849	387413681	/nfs/dbraw/zinc/41/36/81/387413681.db2.gz	SAEMHCKUTMUZTE-UHFFFAOYSA-N	-1	0	203.194	2.031	10	5		BEBERM
O=C([O-])CCCn1ccc2cc([N+](=O)[O-])ccc21	ZINC000036925253	388022553	/nfs/dbraw/zinc/02/25/53/388022553.db2.gz	XOJVNKCTFYYYNI-UHFFFAOYSA-N	-1	0	248.238	2.414	10	5		BEBERM
COc1ccc(CCC([O-])=S)cc1[N+](=O)[O-]	ZINC000095932824	175088618	/nfs/dbraw/zinc/08/86/18/175088618.db2.gz	HNKGGAIJJZAIAV-UHFFFAOYSA-N	-1	0	241.268	2.421	10	5		BEBERM
Cc1c2cc([N+](=O)[O-])ccc2oc1C(=O)[O-]	ZINC000001617932	177573666	/nfs/dbraw/zinc/57/36/66/177573666.db2.gz	BFOGZBLYCKTATH-UHFFFAOYSA-N	-1	0	221.168	2.348	10	5		BEBERM
CCOc1ccc([N+](=O)[O-])cc1/C=C\C(=O)[O-]	ZINC000087957110	641182361	/nfs/dbraw/zinc/18/23/61/641182361.db2.gz	UMXNLKBDMNEXIT-UTCJRWHESA-N	-1	0	237.211	2.091	10	5		BEBERM
Cc1cc([O-])c(Br)c([N+](=O)[O-])c1	ZINC000307636384	343955843	/nfs/dbraw/zinc/95/58/43/343955843.db2.gz	UMEWFEGPRJRIOY-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
Cc1cc(F)cc([N+](=O)[O-])c1/C=C/C(=O)[O-]	ZINC000396123651	344609366	/nfs/dbraw/zinc/60/93/66/344609366.db2.gz	DRVIUHPHFCZLMV-NSCUHMNNSA-N	-1	0	225.175	2.140	10	5		BEBERM
Cc1ccc([N+](=O)[O-])c(CC(=O)[O-])c1Cl	ZINC000396153598	344625606	/nfs/dbraw/zinc/62/56/06/344625606.db2.gz	DDNUJIIBXZJHCD-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
CSc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000143654173	345908240	/nfs/dbraw/zinc/90/82/40/345908240.db2.gz	CPDDHOWMYREZAG-UHFFFAOYSA-N	-1	0	213.214	2.015	10	5		BEBERM
Cc1cc([N+](=O)[O-])cc([O-])c1Br	ZINC000306704703	350851917	/nfs/dbraw/zinc/85/19/17/350851917.db2.gz	NUCBCUAVYIXXIS-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
O=[N+]([O-])c1c(Br)[nH]ccc1=S	ZINC000306820799	351129110	/nfs/dbraw/zinc/12/91/10/351129110.db2.gz	JMRPJRAVRDWRJT-UHFFFAOYSA-N	-1	0	235.062	2.041	10	5		BEBERM
Cc1c([O-])ccc([N+](=O)[O-])c1Br	ZINC000307023532	351427806	/nfs/dbraw/zinc/42/78/06/351427806.db2.gz	VLBHDFKHTCDWLX-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
O=C([O-])c1cc(Cl)cc(F)c1[N+](=O)[O-]	ZINC000307448722	352603156	/nfs/dbraw/zinc/60/31/56/352603156.db2.gz	MLXYDHDKDFZKAM-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
O=[N+]([O-])c1cc([S-])cnc1Br	ZINC000307522312	352636627	/nfs/dbraw/zinc/63/66/27/352636627.db2.gz	BUHNMSIWINSGPZ-UHFFFAOYSA-N	-1	0	235.062	2.041	10	5		BEBERM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000075491234	187962307	/nfs/dbraw/zinc/96/23/07/187962307.db2.gz	HDPBGCMAHQVYBD-VHSXEESVSA-N	-1	0	235.239	2.419	10	5		BEBERM
CC(C)c1nc(-c2ccc([O-])c([N+](=O)[O-])c2)n[nH]1	ZINC000072237677	188307248	/nfs/dbraw/zinc/30/72/48/188307248.db2.gz	OOOWMJGJTAZQIS-UHFFFAOYSA-N	-1	0	248.242	2.209	10	5		BEBERM
O=[N+]([O-])c1ccc(C([O-])=C2CC2(F)F)cc1	ZINC000584608165	358268225	/nfs/dbraw/zinc/26/82/25/358268225.db2.gz	XCMCPTXGEJSCLN-QMMMGPOBSA-N	-1	0	227.166	2.433	10	5		BEBERM
O=c1c2c([n-]n1-c1cccc([N+](=O)[O-])c1)CCC2	ZINC000104707313	358351628	/nfs/dbraw/zinc/35/16/28/358351628.db2.gz	TZERFYFWHDIQJH-SNVBAGLBSA-N	-1	0	245.238	2.098	10	5		BEBERM
Cc1cc(C(=O)[O-])cc([N+](=O)[O-])c1Cl	ZINC000132173670	371761012	/nfs/dbraw/zinc/76/10/12/371761012.db2.gz	JFWTVQOCEMERAY-UHFFFAOYSA-N	-1	0	215.592	2.255	10	5		BEBERM
O=C([O-])C1(c2ccccc2[N+](=O)[O-])CCC1	ZINC000095760870	182425891	/nfs/dbraw/zinc/42/58/91/182425891.db2.gz	QHVGCSMSRCZUDC-UHFFFAOYSA-N	-1	0	221.212	2.101	10	5		BEBERM
O=C([O-])c1cc(-c2ccncc2)cc([N+](=O)[O-])c1	ZINC000047214353	182550808	/nfs/dbraw/zinc/55/08/08/182550808.db2.gz	ZFBVSIAPJYXEKU-UHFFFAOYSA-N	-1	0	244.206	2.355	10	5		BEBERM
CCCN(C)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000028825509	169087703	/nfs/dbraw/zinc/08/77/03/169087703.db2.gz	BTUXDHDGZYFYKO-UHFFFAOYSA-N	-1	0	238.243	2.139	10	5		BEBERM
CCCNc1cc([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000068575534	169294304	/nfs/dbraw/zinc/29/43/04/169294304.db2.gz	LUWSXRPDVOLFRQ-UHFFFAOYSA-N	-1	0	224.216	2.115	10	5		BEBERM
O=C([O-])c1c(F)cc([N+](=O)[O-])cc1C(F)F	ZINC000575669675	384453966	/nfs/dbraw/zinc/45/39/66/384453966.db2.gz	JBCGMEYHQBWCFK-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=Cc1cc(C(=O)[O-])c([N+](=O)[O-])cc1C(F)F	ZINC000575669813	384456615	/nfs/dbraw/zinc/45/66/15/384456615.db2.gz	PDGMGRGUFJDQRX-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
CC(C)c1nc(-c2cc([N+](=O)[O-])ccc2[O-])n[nH]1	ZINC000072237746	384843929	/nfs/dbraw/zinc/84/39/29/384843929.db2.gz	VYOGZGZASTXIOP-UHFFFAOYSA-N	-1	0	248.242	2.209	10	5		BEBERM
O=c1[n-]c(Cl)c([N+](=O)[O-])cc1Cl	ZINC000584622093	385642019	/nfs/dbraw/zinc/64/20/19/385642019.db2.gz	QKDDUPHWZBYTBL-UHFFFAOYSA-N	-1	0	208.988	2.002	10	5		BEBERM
CCOc1cc([O-])c([N+](=O)[O-])cc1OC(F)F	ZINC000575657714	387043736	/nfs/dbraw/zinc/04/37/36/387043736.db2.gz	LGKYIPKBOOUDSR-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
O=c1[n-]cc(Cl)c(Cl)c1[N+](=O)[O-]	ZINC000575434429	387045195	/nfs/dbraw/zinc/04/51/95/387045195.db2.gz	XGRRWCXHTNRKFV-UHFFFAOYSA-N	-1	0	208.988	2.002	10	5		BEBERM
CCc1c(OC(F)F)ccc([O-])c1[N+](=O)[O-]	ZINC000575658571	387047529	/nfs/dbraw/zinc/04/75/29/387047529.db2.gz	CDJXVTLBAWTULE-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
CCOc1c([O-])c([N+](=O)[O-])ccc1OC(F)F	ZINC000575658797	387049474	/nfs/dbraw/zinc/04/94/74/387049474.db2.gz	SEXJOZDQYKEQCJ-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
CCc1cc([N+](=O)[O-])c(OC(F)F)cc1[O-]	ZINC000575660826	387054658	/nfs/dbraw/zinc/05/46/58/387054658.db2.gz	ZVJMSLIZIGLACO-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
O=[N+]([O-])c1cc(O)cc(OC(F)F)c1F	ZINC000575662022	387161393	/nfs/dbraw/zinc/16/13/93/387161393.db2.gz	ZSBMXNXMVNISCI-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
Cc1cc(OC(F)F)cc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575667269	387315853	/nfs/dbraw/zinc/31/58/53/387315853.db2.gz	LKDUNXIQFUAVRA-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
COc1cc(C(F)F)c([O-])c([N+](=O)[O-])c1	ZINC000575667213	387316077	/nfs/dbraw/zinc/31/60/77/387316077.db2.gz	CLQRBNKWJZGGSE-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
Cc1c(OC(F)F)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575666401	387317527	/nfs/dbraw/zinc/31/75/27/387317527.db2.gz	IPHQUAJMJXFTRK-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
Cc1c(OC(F)F)ccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575666262	387317662	/nfs/dbraw/zinc/31/76/62/387317662.db2.gz	HQLCQXAALPFWIP-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
CC(=O)c1cc([N+](=O)[O-])c([O-])cc1OC(F)F	ZINC000575663375	387287348	/nfs/dbraw/zinc/28/73/48/387287348.db2.gz	XOGYAFLRAHZDHX-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
COc1ccc([N+](=O)[O-])c([O-])c1Br	ZINC000575692094	387379586	/nfs/dbraw/zinc/37/95/86/387379586.db2.gz	UABWNKWJOFEHQX-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
COc1cc([N+](=O)[O-])c([O-])cc1C(F)F	ZINC000575668025	387324052	/nfs/dbraw/zinc/32/40/52/387324052.db2.gz	IKBFSCWTKIEYAI-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
CC(=O)c1cc([O-])cc(C(F)F)c1[N+](=O)[O-]	ZINC000575668129	387324963	/nfs/dbraw/zinc/32/49/63/387324963.db2.gz	KJGLSZDZQCISMS-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
COc1cc([O-])c([N+](=O)[O-])c(C(F)F)c1	ZINC000575668128	387325322	/nfs/dbraw/zinc/32/53/22/387325322.db2.gz	KJDRRTCLEGEFDA-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
Cc1cc(C(=O)[O-])cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575668185	387325692	/nfs/dbraw/zinc/32/56/92/387325692.db2.gz	RVHIDUSXAZBPDH-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
O=Cc1cc(C(=O)[O-])c(C(F)F)cc1[N+](=O)[O-]	ZINC000575669888	387330851	/nfs/dbraw/zinc/33/08/51/387330851.db2.gz	RMAFKOSXAHVYSK-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
CCOc1cc(C(=O)[O-])c(CC)cc1[N+](=O)[O-]	ZINC000575697038	387397380	/nfs/dbraw/zinc/39/73/80/387397380.db2.gz	RGPGINUCOGXJAM-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOC(=O)c1cc([N+](=O)[O-])c([O-])cc1Cl	ZINC000575700490	387403239	/nfs/dbraw/zinc/40/32/39/387403239.db2.gz	LJJYHANMYYOXBR-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
CC1(C)[C@H](C(=O)[O-])[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000075490950	168005629	/nfs/dbraw/zinc/00/56/29/168005629.db2.gz	RVZUUUCWHZZLRJ-ZJUUUORDSA-N	-1	0	235.239	2.419	10	5		BEBERM
C[C@H](Sc1cc(F)cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000037666427	177029457	/nfs/dbraw/zinc/02/94/57/177029457.db2.gz	IBWWVKJAWALOKJ-YFKPBYRVSA-N	-1	0	245.231	2.299	10	5		BEBERM
O=C([O-])c1c[nH]cc1-c1ccc([N+](=O)[O-])cc1	ZINC000037245278	361776282	/nfs/dbraw/zinc/77/62/82/361776282.db2.gz	UWDHRUNKPWXPRW-UHFFFAOYSA-N	-1	0	232.195	2.288	10	5		BEBERM
Cc1cc(C)c([N+](=O)[O-])cc1/C=C/C(=O)[O-]	ZINC000396114562	344606326	/nfs/dbraw/zinc/60/63/26/344606326.db2.gz	PHVJHPNFNNDBTA-ONEGZZNKSA-N	-1	0	221.212	2.309	10	5		BEBERM
Cc1cc(CC(=O)[O-])c([N+](=O)[O-])cc1Cl	ZINC000396167265	344636905	/nfs/dbraw/zinc/63/69/05/344636905.db2.gz	XXAYXHBAIYLTNV-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
Cc1cc(Cl)c(C(=O)[O-])c([N+](=O)[O-])c1	ZINC000306719785	350880340	/nfs/dbraw/zinc/88/03/40/350880340.db2.gz	LWQHKGZGOGBBCD-UHFFFAOYSA-N	-1	0	215.592	2.255	10	5		BEBERM
C[C@H]1C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000052293665	350980253	/nfs/dbraw/zinc/98/02/53/350980253.db2.gz	JOPCXVLMWXBRFS-RCOVLWMOSA-N	-1	0	236.227	2.113	10	5		BEBERM
Cc1ccc([N+](=O)[O-])c(Br)c1[O-]	ZINC000307622022	352692495	/nfs/dbraw/zinc/69/24/95/352692495.db2.gz	CGLWXLJOBQNJCQ-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
O=c1c2c([n-]n1-c1ccc([N+](=O)[O-])cc1)CCC2	ZINC000104707148	358351292	/nfs/dbraw/zinc/35/12/92/358351292.db2.gz	WZWXUVHUNKTQSG-JTQLQIEISA-N	-1	0	245.238	2.098	10	5		BEBERM
Cc1ccc(Cl)c(C(=O)[O-])c1[N+](=O)[O-]	ZINC000306216940	359330699	/nfs/dbraw/zinc/33/06/99/359330699.db2.gz	JLGQDJVNHWLGBR-UHFFFAOYSA-N	-1	0	215.592	2.255	10	5		BEBERM
Cc1c(Cl)ccc([N+](=O)[O-])c1CC(=O)[O-]	ZINC000306531096	360393587	/nfs/dbraw/zinc/39/35/87/360393587.db2.gz	HWQJBMKMYNONOK-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
Cc1c(SCC(=O)[O-])cccc1[N+](=O)[O-]	ZINC000039111033	372872455	/nfs/dbraw/zinc/87/24/55/372872455.db2.gz	FKEMRFNHNDDPBP-UHFFFAOYSA-N	-1	0	227.241	2.080	10	5		BEBERM
O=[N+]([O-])c1cc(F)c(OC(F)F)cc1[O-]	ZINC000575661082	384414250	/nfs/dbraw/zinc/41/42/50/384414250.db2.gz	IHLPVCIPTXKMCM-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
O=[N+]([O-])c1c(F)cc([O-])cc1OC(F)F	ZINC000575662020	384417783	/nfs/dbraw/zinc/41/77/83/384417783.db2.gz	ZOYILHLENOSPFO-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
O=[N+]([O-])c1c([O-])ccc(OC(F)F)c1F	ZINC000575661931	384418766	/nfs/dbraw/zinc/41/87/66/384418766.db2.gz	WFEDEPCMHVWNFS-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
O=[N+]([O-])c1ccc(OC(F)F)c(O)c1F	ZINC000575662017	387162665	/nfs/dbraw/zinc/16/26/65/387162665.db2.gz	ZONJGFRAGACGKG-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
CC(=O)c1c(OC(F)F)cc([O-])cc1[N+](=O)[O-]	ZINC000575662572	387195034	/nfs/dbraw/zinc/19/50/34/387195034.db2.gz	BEORKPQFLCXPFS-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
Cc1cc(OC(F)F)cc([O-])c1[N+](=O)[O-]	ZINC000575666295	387316751	/nfs/dbraw/zinc/31/67/51/387316751.db2.gz	IAERFYOALQLBMQ-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
CCOc1cc([N+](=O)[O-])c(C(=O)[O-])cc1CC	ZINC000575694301	387384228	/nfs/dbraw/zinc/38/42/28/387384228.db2.gz	BLXYDLOUDMIZCS-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
COc1cc([N+](=O)[O-])cc([O-])c1Br	ZINC000575691218	387379775	/nfs/dbraw/zinc/37/97/75/387379775.db2.gz	KEBNJWNHRXAGOG-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
CC(=O)c1cc([O-])c([N+](=O)[O-])c(C(F)F)c1	ZINC000575667454	387320053	/nfs/dbraw/zinc/32/00/53/387320053.db2.gz	FMCQTJYLVDUTRW-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
O=Cc1c([O-])cc([N+](=O)[O-])cc1C(F)F	ZINC000575666983	387321937	/nfs/dbraw/zinc/32/19/37/387321937.db2.gz	BVENXSMOBNZDIH-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
Cc1cc(C(=O)[O-])c(OC(F)F)c([N+](=O)[O-])c1	ZINC000575669006	387325379	/nfs/dbraw/zinc/32/53/79/387325379.db2.gz	WYLFRIMKVSWDOH-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
O=C([O-])c1cc(F)cc([N+](=O)[O-])c1C(F)F	ZINC000575669615	387329899	/nfs/dbraw/zinc/32/98/99/387329899.db2.gz	FWPLUBXQCSONPS-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=C([O-])c1cc([N+](=O)[O-])c(F)cc1C(F)F	ZINC000575669818	387331249	/nfs/dbraw/zinc/33/12/49/387331249.db2.gz	PNARDPQZHPYKGU-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
Cc1cc(OC(F)F)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575669168	387333289	/nfs/dbraw/zinc/33/32/89/387333289.db2.gz	ZFYBUDBCXNQQAG-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
COc1cc(C(F)F)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575670882	387336080	/nfs/dbraw/zinc/33/60/80/387336080.db2.gz	DMEUFSDBGVHOGS-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1cc(C)c(/C=C/C(=O)[O-])c([N+](=O)[O-])c1	ZINC000575673072	387341041	/nfs/dbraw/zinc/34/10/41/387341041.db2.gz	BMFQXSHDYXQCOB-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
COc1cc(/C=C/C(=O)[O-])c([N+](=O)[O-])cc1C	ZINC000575673255	387341461	/nfs/dbraw/zinc/34/14/61/387341461.db2.gz	HBPDERSIQUEYAG-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
COc1cc(C(=O)[O-])c(C(F)F)cc1[N+](=O)[O-]	ZINC000575672139	387342338	/nfs/dbraw/zinc/34/23/38/387342338.db2.gz	QNBMGCQKMFNZFI-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
CCOc1c([N+](=O)[O-])ccc(C)c1C(=O)[O-]	ZINC000575698763	387391356	/nfs/dbraw/zinc/39/13/56/387391356.db2.gz	IYYQZYRYNSXCOI-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CC1(C)[C@H](C(=O)[O-])[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000075491241	168003060	/nfs/dbraw/zinc/00/30/60/168003060.db2.gz	HDPBGCMAHQVYBD-UWVGGRQHSA-N	-1	0	235.239	2.419	10	5		BEBERM
C[C@H](Oc1ccc([N+](=O)[O-])c(Cl)c1)C(=O)[O-]	ZINC000035359205	177023473	/nfs/dbraw/zinc/02/34/73/177023473.db2.gz	IDOUEYSSONORNZ-YFKPBYRVSA-N	-1	0	245.618	2.100	10	5		BEBERM
O=C([O-])CSCc1ccc(F)cc1[N+](=O)[O-]	ZINC000692678653	976533958	/nfs/dbraw/zinc/53/39/58/976533958.db2.gz	OBZQCFCMEBCWPG-UHFFFAOYSA-N	-1	0	245.231	2.052	10	5		BEBERM
CC(C)(CC(=O)[O-])Nc1ccccc1[N+](=O)[O-]	ZINC000084147991	343982816	/nfs/dbraw/zinc/98/28/16/343982816.db2.gz	BPYLIBIDCPDMGC-UHFFFAOYSA-N	-1	0	238.243	2.260	10	5		BEBERM
Cc1cc([N+](=O)[O-])ccc1/C=C/C(=O)[O-]	ZINC000085343003	178271803	/nfs/dbraw/zinc/27/18/03/178271803.db2.gz	ASXBDGZPWKAWPV-HWKANZROSA-N	-1	0	207.185	2.001	10	5		BEBERM
O=C([O-])c1cc([N+](=O)[O-])cc(F)c1Cl	ZINC000165052083	342872120	/nfs/dbraw/zinc/87/21/20/342872120.db2.gz	WPOKJSFDNYLZGJ-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
CC(C)N(C)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000019844976	187252482	/nfs/dbraw/zinc/25/24/82/187252482.db2.gz	MHEQRUIVKHGEFT-UHFFFAOYSA-N	-1	0	238.243	2.138	10	5		BEBERM
Cc1c(F)c(C(=O)[O-])c(F)c([N+](=O)[O-])c1F	ZINC000396117252	344607000	/nfs/dbraw/zinc/60/70/00/344607000.db2.gz	KNZBLBBGLCLVQG-UHFFFAOYSA-N	-1	0	235.117	2.019	10	5		BEBERM
Cc1cc([N+](=O)[O-])cc(CC(=O)[O-])c1Cl	ZINC000396152723	344625210	/nfs/dbraw/zinc/62/52/10/344625210.db2.gz	BTDXSRVRFFFNGO-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
CSc1c(C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000158745914	344737852	/nfs/dbraw/zinc/73/78/52/344737852.db2.gz	WXHFPMYLQUZYBR-UHFFFAOYSA-N	-1	0	213.214	2.015	10	5		BEBERM
O=C([O-])c1cc2ccoc2cc1[N+](=O)[O-]	ZINC000039086998	344756076	/nfs/dbraw/zinc/75/60/76/344756076.db2.gz	UZHBOKBUTPBKAF-UHFFFAOYSA-N	-1	0	207.141	2.039	10	5		BEBERM
Cc1[n-]n(C)c(=O)c1-c1ccc([N+](=O)[O-])cc1	ZINC000675054803	537975427	/nfs/dbraw/zinc/97/54/27/537975427.db2.gz	UEFSDSWLYNKUSK-UHFFFAOYSA-N	-1	0	233.227	2.009	10	5		BEBERM
Cc1ccc(Br)c([O-])c1[N+](=O)[O-]	ZINC000306988376	351405403	/nfs/dbraw/zinc/40/54/03/351405403.db2.gz	AVXIUGSDVMBBGD-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
Cc1ccc(Br)c([N+](=O)[O-])c1[O-]	ZINC000307264536	351811834	/nfs/dbraw/zinc/81/18/34/351811834.db2.gz	BZRSFXIWEOIEPG-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
CC(C)C(=O)C=C([O-])c1cccc([N+](=O)[O-])c1	ZINC000071398198	188305919	/nfs/dbraw/zinc/30/59/19/188305919.db2.gz	MALLDFNXBOWQHU-UHFFFAOYSA-N	-1	0	235.239	2.393	10	5		BEBERM
Cc1c(Cl)cc([S@](=O)[O-])cc1[N+](=O)[O-]	ZINC000675060222	538486154	/nfs/dbraw/zinc/48/61/54/538486154.db2.gz	UQNOHDTWMDIFIC-UHFFFAOYSA-N	-1	0	235.648	2.137	10	5		BEBERM
Cc1cc2[nH]c3ccccc3c([O-])c-2c(=O)n1	ZINC000584596814	358254543	/nfs/dbraw/zinc/25/45/43/358254543.db2.gz	ITUSDPCIPIEZTK-UHFFFAOYSA-N	-1	0	226.235	2.090	10	5		BEBERM
O=C([O-])c1nc2ccc(F)cc2c2nccnc12	ZINC000003881120	219812740	/nfs/dbraw/zinc/81/27/40/219812740.db2.gz	POJAUWWMPNPVLC-UHFFFAOYSA-N	-1	0	243.197	2.015	10	5		BEBERM
O=C([O-])c1cc([N+](=O)[O-])ccc1NCC1CC1	ZINC000019844688	182558912	/nfs/dbraw/zinc/55/89/12/182558912.db2.gz	UNQNVKYLCWCQSM-UHFFFAOYSA-N	-1	0	236.227	2.115	10	5		BEBERM
CCCNc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000013277124	169294666	/nfs/dbraw/zinc/29/46/66/169294666.db2.gz	LGIWIXFOYHGHFW-UHFFFAOYSA-N	-1	0	224.216	2.115	10	5		BEBERM
O=[N+]([O-])c1ccc(OC(F)F)c(F)c1[O-]	ZINC000575661626	384417944	/nfs/dbraw/zinc/41/79/44/384417944.db2.gz	QOKUUSSQJQSNMU-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
O=C([O-])c1cc(F)c(Cl)c([N+](=O)[O-])c1	ZINC000306705466	386741050	/nfs/dbraw/zinc/74/10/50/386741050.db2.gz	OTJZEAGZIMBMFE-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
CCOc1cc([O-])c(OC(F)F)cc1[N+](=O)[O-]	ZINC000575656028	387037485	/nfs/dbraw/zinc/03/74/85/387037485.db2.gz	BQORKUVYMSTBBT-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
CCc1c([O-])c([N+](=O)[O-])ccc1OC(F)F	ZINC000575659488	387048140	/nfs/dbraw/zinc/04/81/40/387048140.db2.gz	HGBPOFDSQBLMMY-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
O=[N+]([O-])c1cc(OC(F)F)cc([O-])c1F	ZINC000575660957	387050747	/nfs/dbraw/zinc/05/07/47/387050747.db2.gz	FCPLHHHFSIQYGP-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
CCc1ccc(OC(F)F)c([O-])c1[N+](=O)[O-]	ZINC000575660118	387052192	/nfs/dbraw/zinc/05/21/92/387052192.db2.gz	MQPLWCKQJCFATG-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
O=Cc1cc(C(F)F)c([O-])cc1[N+](=O)[O-]	ZINC000575669282	387310278	/nfs/dbraw/zinc/31/02/78/387310278.db2.gz	QZDIGVZIEHJGPJ-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
Cc1cc(OC(F)F)c([N+](=O)[O-])cc1C(=O)[O-]	ZINC000575665972	387311593	/nfs/dbraw/zinc/31/15/93/387311593.db2.gz	GELMMRGHOVRJTM-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
Cc1cc(OC(F)F)c(C(=O)[O-])c([N+](=O)[O-])c1	ZINC000575666451	387317394	/nfs/dbraw/zinc/31/73/94/387317394.db2.gz	IXWBRMWAYYGYQT-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
COc1c(Br)ccc([N+](=O)[O-])c1[O-]	ZINC000575692569	387381721	/nfs/dbraw/zinc/38/17/21/387381721.db2.gz	YZLONMBHIZKEQR-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
Cc1cc([N+](=O)[O-])c(OC(F)F)cc1C(=O)[O-]	ZINC000575668989	387325705	/nfs/dbraw/zinc/32/57/05/387325705.db2.gz	WNXIYDGFMWXZLJ-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
O=Cc1cc(C(F)F)c([N+](=O)[O-])cc1[O-]	ZINC000575668780	387328061	/nfs/dbraw/zinc/32/80/61/387328061.db2.gz	NYLQUSQXCKSYBV-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
O=Cc1cc([N+](=O)[O-])cc(C(F)F)c1C(=O)[O-]	ZINC000575669621	387329133	/nfs/dbraw/zinc/32/91/33/387329133.db2.gz	GICNIWSXSXMYNR-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
O=C([O-])c1cc(F)c(C(F)F)cc1[N+](=O)[O-]	ZINC000575670151	387329164	/nfs/dbraw/zinc/32/91/64/387329164.db2.gz	WIRSTBBWHYIHRL-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=Cc1cc(C(F)F)cc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575669764	387330456	/nfs/dbraw/zinc/33/04/56/387330456.db2.gz	NCBDAPQXCSKRCV-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
O=C([O-])c1c(C(F)F)cc(F)cc1[N+](=O)[O-]	ZINC000575670300	387331303	/nfs/dbraw/zinc/33/13/03/387331303.db2.gz	ZIDSHBICCFZENL-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
COc1c(C(=O)[O-])cc(C(F)F)cc1[N+](=O)[O-]	ZINC000575670745	387335813	/nfs/dbraw/zinc/33/58/13/387335813.db2.gz	AYKWHOYJZNIZIO-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1cc([N+](=O)[O-])c(C(=O)[O-])cc1C(F)F	ZINC000575670912	387336951	/nfs/dbraw/zinc/33/69/51/387336951.db2.gz	FKHRYBVXEUXNPL-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
CCOc1cc([O-])c(CC)cc1[N+](=O)[O-]	ZINC000575697497	387391466	/nfs/dbraw/zinc/39/14/66/387391466.db2.gz	XFUSIONWEXVNKK-UHFFFAOYSA-N	-1	0	211.217	2.262	10	5		BEBERM
CCOc1cc(C)c([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000575699113	387401671	/nfs/dbraw/zinc/40/16/71/387401671.db2.gz	PSPNZVDQSJDSDU-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCOC(=O)c1c([O-])ccc([N+](=O)[O-])c1Cl	ZINC000575700461	387403251	/nfs/dbraw/zinc/40/32/51/387403251.db2.gz	LFXANUPJOXQFRY-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
CCOC(=O)c1cc([O-])c([N+](=O)[O-])c(Cl)c1	ZINC000575700459	387403978	/nfs/dbraw/zinc/40/39/78/387403978.db2.gz	LFRKQWSGQAAFQA-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
CC[C@H](C)c1cc([N+](=O)[O-])cc(N)c1O	ZINC000038171356	388401667	/nfs/dbraw/zinc/40/16/67/388401667.db2.gz	CIMKCSKJNMVQAL-LURJTMIESA-N	-1	0	210.233	2.396	10	5		BEBERM
CCOC(=O)c1ccc([S-])c([N+](=O)[O-])c1	ZINC000115633563	170298179	/nfs/dbraw/zinc/29/81/79/170298179.db2.gz	VYDLIVGDTQTYCZ-UHFFFAOYSA-N	-1	0	227.241	2.060	10	5		BEBERM
C[C@@H](Sc1cccc(F)c1[N+](=O)[O-])C(=O)[O-]	ZINC000037419421	176009524	/nfs/dbraw/zinc/00/95/24/176009524.db2.gz	ZNOXECODBVYICX-RXMQYKEDSA-N	-1	0	245.231	2.299	10	5		BEBERM
Cc1c([O-])c([N+](=O)[O-])cc([N+](=O)[O-])c1Cl	ZINC000390824103	525878220	/nfs/dbraw/zinc/87/82/20/525878220.db2.gz	IWXOKGBLUVSBSO-UHFFFAOYSA-N	-1	0	232.579	2.170	10	5		BEBERM
Cc1cc2cc(C(=O)[O-])[nH]c2c([N+](=O)[O-])c1	ZINC000037632499	178269817	/nfs/dbraw/zinc/26/98/17/178269817.db2.gz	QDUDZZYFDPINJW-UHFFFAOYSA-N	-1	0	220.184	2.083	10	5		BEBERM
CSc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C	ZINC000043387301	343061662	/nfs/dbraw/zinc/06/16/62/343061662.db2.gz	XMLGROOGLYKQEG-UHFFFAOYSA-N	-1	0	227.241	2.323	10	5		BEBERM
Cc1ccc(/C=C/C(=O)[O-])c(C)c1[N+](=O)[O-]	ZINC000396109245	344605126	/nfs/dbraw/zinc/60/51/26/344605126.db2.gz	CYQYPWVNMNSYAE-AATRIKPKSA-N	-1	0	221.212	2.309	10	5		BEBERM
Cc1ccc([N+](=O)[O-])c(Cl)c1CC(=O)[O-]	ZINC000396153489	344625650	/nfs/dbraw/zinc/62/56/50/344625650.db2.gz	CLEZCZOVLFURNN-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
Cc1ccc(CC(=O)[O-])c(Cl)c1[N+](=O)[O-]	ZINC000396159952	344632906	/nfs/dbraw/zinc/63/29/06/344632906.db2.gz	NAOFCLBLGDRWIR-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
Cc1[n-]n(C)c(=O)c1-c1ccc(C)c([N+](=O)[O-])c1	ZINC000675053529	537881770	/nfs/dbraw/zinc/88/17/70/537881770.db2.gz	IBSOTKJFNBOFGY-UHFFFAOYSA-N	-1	0	247.254	2.318	10	5		BEBERM
O=[N+]([O-])c1cccc2c1ccc([O-])c2[N+](=O)[O-]	ZINC000039277415	347188402	/nfs/dbraw/zinc/18/84/02/347188402.db2.gz	FKKAUKDPTFKSHH-UHFFFAOYSA-N	-1	0	234.167	2.362	10	5		BEBERM
CCOc1c(Cl)ccc([O-])c1[N+](=O)[O-]	ZINC000306990106	351398260	/nfs/dbraw/zinc/39/82/60/351398260.db2.gz	SUCOOBGYAIYSJB-UHFFFAOYSA-N	-1	0	217.608	2.353	10	5		BEBERM
O=C([O-])C1(c2ccsc2[N+](=O)[O-])CCC1	ZINC000307249699	351755720	/nfs/dbraw/zinc/75/57/20/351755720.db2.gz	ORFVVMUTRAFNFZ-UHFFFAOYSA-N	-1	0	227.241	2.163	10	5		BEBERM
Cc1cc([N+](=O)[O-])c(Cl)cc1CC(=O)[O-]	ZINC000138496366	360771194	/nfs/dbraw/zinc/77/11/94/360771194.db2.gz	FWOQGZNBWIYADX-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
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O=C([O-])c1c(Cl)cc(F)cc1[N+](=O)[O-]	ZINC000306603947	372044982	/nfs/dbraw/zinc/04/49/82/372044982.db2.gz	NDJDDDGEEUHKDY-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
O=C([O-])c1ccc2c(c1)[nH]c1ccccc1c2=O	ZINC000034519725	182572276	/nfs/dbraw/zinc/57/22/76/182572276.db2.gz	QHFBFNJLQANQCF-UHFFFAOYSA-N	-1	0	239.230	2.380	10	5		BEBERM
Cc1ccc(C(=O)[O-])c([N+](=O)[O-])c1OC(F)F	ZINC000575666283	384435773	/nfs/dbraw/zinc/43/57/73/384435773.db2.gz	HWQBCPAHRNFXQV-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
C[C@H](C(=O)C1CC1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000584616366	385642080	/nfs/dbraw/zinc/64/20/80/385642080.db2.gz	CBNLNUXHGYVCDY-ZETCQYMHSA-N	-1	0	235.239	2.383	10	5		BEBERM
COc1cc([O-])c([N+](=O)[O-])cc1Br	ZINC000307079781	385892087	/nfs/dbraw/zinc/89/20/87/385892087.db2.gz	NYOZWCXZNLOVBB-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
O=[N+]([O-])c1ccc([O-])c(F)c1Br	ZINC000299889903	386498163	/nfs/dbraw/zinc/49/81/63/386498163.db2.gz	QPOLYTZHRDEONX-UHFFFAOYSA-N	-1	0	235.996	2.202	10	5		BEBERM
CCOc1cc([N+](=O)[O-])cc(OC(F)F)c1[O-]	ZINC000575657112	387044478	/nfs/dbraw/zinc/04/44/78/387044478.db2.gz	JIPZJKUWZZIYRL-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
Cc1ccc(OC(F)F)c(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575665440	387314310	/nfs/dbraw/zinc/31/43/10/387314310.db2.gz	DRXNDIGEMHWTCJ-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
CC(=O)c1cc([O-])cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575663223	387267383	/nfs/dbraw/zinc/26/73/83/387267383.db2.gz	UFCGEDUEMQMMDQ-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
COc1ccc([O-])c([N+](=O)[O-])c1Br	ZINC000575690751	387380800	/nfs/dbraw/zinc/38/08/00/387380800.db2.gz	AKQQFTZTOPOLQS-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
CC(=O)c1cc([N+](=O)[O-])c([O-])cc1C(F)F	ZINC000575667994	387323455	/nfs/dbraw/zinc/32/34/55/387323455.db2.gz	ICGPWQFSHLYRLR-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
CC(=O)c1cc([N+](=O)[O-])c(C(F)F)cc1[O-]	ZINC000575667890	387323552	/nfs/dbraw/zinc/32/35/52/387323552.db2.gz	HAYPCBVIUWHRPD-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
O=Cc1cc(C(F)F)cc([N+](=O)[O-])c1[O-]	ZINC000575667907	387323768	/nfs/dbraw/zinc/32/37/68/387323768.db2.gz	HKNFIJZZMANECE-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
Cc1ccc([N+](=O)[O-])c(C(=O)[O-])c1OC(F)F	ZINC000575669047	387324572	/nfs/dbraw/zinc/32/45/72/387324572.db2.gz	XNRPSKLTCCXJNA-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
COc1cc([O-])c(C(F)F)cc1[N+](=O)[O-]	ZINC000575669472	387328477	/nfs/dbraw/zinc/32/84/77/387328477.db2.gz	WWNQQOUHPREPRC-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
O=C([O-])c1cc(F)c([N+](=O)[O-])c(C(F)F)c1	ZINC000575669558	387328898	/nfs/dbraw/zinc/32/88/98/387328898.db2.gz	CBSHKJAGEOSTIG-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=Cc1c(C(=O)[O-])cc([N+](=O)[O-])cc1C(F)F	ZINC000575669951	387333309	/nfs/dbraw/zinc/33/33/09/387333309.db2.gz	TWJGDTWBOMGJLV-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
COc1c(C(=O)[O-])cc([N+](=O)[O-])cc1C(F)F	ZINC000575672219	387338053	/nfs/dbraw/zinc/33/80/53/387338053.db2.gz	UBSHKONJIHMXNX-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1cc([N+](=O)[O-])c(/C=C/C(=O)[O-])cc1C	ZINC000575673143	387339891	/nfs/dbraw/zinc/33/98/91/387339891.db2.gz	DHUFCDGSLQHYPJ-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
CCOc1cc(CC)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575697513	387391060	/nfs/dbraw/zinc/39/10/60/387391060.db2.gz	XMBGLVIWTOJCGZ-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1cc([O-])cc(CC)c1[N+](=O)[O-]	ZINC000575697557	387391648	/nfs/dbraw/zinc/39/16/48/387391648.db2.gz	YUOBNCJCXFDJCV-UHFFFAOYSA-N	-1	0	211.217	2.262	10	5		BEBERM
COc1c(F)cc([N+](=O)[O-])cc1[S-]	ZINC000575707926	387411591	/nfs/dbraw/zinc/41/15/91/387411591.db2.gz	HZHQXYTWAPUQFD-UHFFFAOYSA-N	-1	0	203.194	2.031	10	5		BEBERM
COc1ccc([S-])c(F)c1[N+](=O)[O-]	ZINC000575708229	387412789	/nfs/dbraw/zinc/41/27/89/387412789.db2.gz	LLPJGOKHOLGFKI-UHFFFAOYSA-N	-1	0	203.194	2.031	10	5		BEBERM
CC1(C)[C@H](C(=O)[O-])[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000075491237	168005144	/nfs/dbraw/zinc/00/51/44/168005144.db2.gz	HDPBGCMAHQVYBD-ZJUUUORDSA-N	-1	0	235.239	2.419	10	5		BEBERM
C[C@@H](Oc1cc(Cl)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000051608709	176004336	/nfs/dbraw/zinc/00/43/36/176004336.db2.gz	RTHRZRBBZYKAKE-RXMQYKEDSA-N	-1	0	245.618	2.100	10	5		BEBERM
O=[N+]([O-])c1c([O-])cccc1OC(F)(F)F	ZINC000238725356	344992730	/nfs/dbraw/zinc/99/27/30/344992730.db2.gz	BFLGAEGSMLQWFF-UHFFFAOYSA-N	-1	0	223.106	2.199	10	5		BEBERM
COc1c(F)cc([S-])cc1[N+](=O)[O-]	ZINC000238407149	345044107	/nfs/dbraw/zinc/04/41/07/345044107.db2.gz	LDTHCBKTRBZHBD-UHFFFAOYSA-N	-1	0	203.194	2.031	10	5		BEBERM
O=C([O-])c1c(F)ccc(Cl)c1[N+](=O)[O-]	ZINC000247289611	345293046	/nfs/dbraw/zinc/29/30/46/345293046.db2.gz	AOLVEUVFRPEETA-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
O=[N+]([O-])c1c[n-]c(C(F)(F)F)cc1=S	ZINC000236143083	346197983	/nfs/dbraw/zinc/19/79/83/346197983.db2.gz	FBDLKNPZIRUJOR-UHFFFAOYSA-N	-1	0	224.163	2.297	10	5		BEBERM
O=C([O-])c1ccc(Cl)c(F)c1[N+](=O)[O-]	ZINC000307057007	351457360	/nfs/dbraw/zinc/45/73/60/351457360.db2.gz	WTPBJWWPZZXDEX-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
CC(C)(C)OC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000115435525	370663133	/nfs/dbraw/zinc/66/31/33/370663133.db2.gz	JKYDHFYJXXKXQD-UHFFFAOYSA-N	-1	0	239.227	2.256	10	5		BEBERM
CO[C@H](C)c1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000584635087	358319342	/nfs/dbraw/zinc/31/93/42/358319342.db2.gz	PZWRYYARRGRLSF-ZCFIWIBFSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCCCOc1ccc(C(=O)[O-])c([N+](=O)[O-])c1	ZINC000116995095	370861819	/nfs/dbraw/zinc/86/18/19/370861819.db2.gz	DXFCZUAEGSRXAA-UHFFFAOYSA-N	-1	0	239.227	2.472	10	5		BEBERM
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CCc1ccc(OC(F)F)c([N+](=O)[O-])c1[O-]	ZINC000575659353	387045779	/nfs/dbraw/zinc/04/57/79/387045779.db2.gz	GBGDIXWHPGGJJG-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
CCOc1c(OC(F)F)ccc([O-])c1[N+](=O)[O-]	ZINC000575658912	387047944	/nfs/dbraw/zinc/04/79/44/387047944.db2.gz	TZEJRXKCFPXLBB-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
O=[N+]([O-])c1cc([O-])cc(F)c1OC(F)F	ZINC000575660998	387052267	/nfs/dbraw/zinc/05/22/67/387052267.db2.gz	GBGRGDLKWRAIRZ-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
O=[N+]([O-])c1cc(F)cc(OC(F)F)c1[O-]	ZINC000575661703	387112999	/nfs/dbraw/zinc/11/29/99/387112999.db2.gz	UPZPCIPUMNIKHD-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
COc1ccc(Br)c([N+](=O)[O-])c1[O-]	ZINC000575690865	387380701	/nfs/dbraw/zinc/38/07/01/387380701.db2.gz	DQJLGRPHIPCLHP-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
CC(=O)c1cc([O-])c(C(F)F)cc1[N+](=O)[O-]	ZINC000575667542	387321264	/nfs/dbraw/zinc/32/12/64/387321264.db2.gz	GRLZWZWGYAYNAG-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
CC(=O)c1cc(C(F)F)cc([O-])c1[N+](=O)[O-]	ZINC000575667019	387321763	/nfs/dbraw/zinc/32/17/63/387321763.db2.gz	BVWIDMDKNFKERW-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
COc1cc([O-])c([N+](=O)[O-])cc1C(F)F	ZINC000575668699	387326176	/nfs/dbraw/zinc/32/61/76/387326176.db2.gz	MOUNQHWGKDFHHS-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
O=Cc1c(C(F)F)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575669681	387328867	/nfs/dbraw/zinc/32/88/67/387328867.db2.gz	JKTOSHNMQSYBPW-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
CC(=O)c1cc([N+](=O)[O-])cc([O-])c1C(F)F	ZINC000575669510	387329059	/nfs/dbraw/zinc/32/90/59/387329059.db2.gz	YUUXPEOFDQPAHZ-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
COc1cc(C(=O)[O-])c([N+](=O)[O-])c(C(F)F)c1	ZINC000575670766	387336866	/nfs/dbraw/zinc/33/68/66/387336866.db2.gz	BGMBYPLEMLCIGY-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1cc(C(=O)[O-])cc(C(F)F)c1[N+](=O)[O-]	ZINC000575672328	387337637	/nfs/dbraw/zinc/33/76/37/387337637.db2.gz	YTGHJSFHVJLRQN-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1cc(/C=C/C(=O)[O-])c(C)cc1[N+](=O)[O-]	ZINC000575673371	387343316	/nfs/dbraw/zinc/34/33/16/387343316.db2.gz	JSUADVPYGDEJHL-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
CCOc1cc(C(=O)[O-])cc(CC)c1[N+](=O)[O-]	ZINC000575697572	387392712	/nfs/dbraw/zinc/39/27/12/387392712.db2.gz	ZGKCPABPKSBMBU-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1c(C(=O)[O-])cc(CC)cc1[N+](=O)[O-]	ZINC000575697585	387392915	/nfs/dbraw/zinc/39/29/15/387392915.db2.gz	ZSCDWEARLHYPRJ-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1c([N+](=O)[O-])ccc(CC)c1C(=O)[O-]	ZINC000575695524	387395955	/nfs/dbraw/zinc/39/59/55/387395955.db2.gz	JVOXDXLNVOEWRP-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1cc([N+](=O)[O-])cc(C)c1C(=O)[O-]	ZINC000575699949	387403911	/nfs/dbraw/zinc/40/39/11/387403911.db2.gz	YTTDTSOBTDNKQY-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCOC(=O)c1cc([O-])cc(Cl)c1[N+](=O)[O-]	ZINC000575701413	387404779	/nfs/dbraw/zinc/40/47/79/387404779.db2.gz	YEMWKUJZJQNRHZ-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
COc1cc([S-])c(F)cc1[N+](=O)[O-]	ZINC000575708395	387412215	/nfs/dbraw/zinc/41/22/15/387412215.db2.gz	OLBGJALBDRXHAR-UHFFFAOYSA-N	-1	0	203.194	2.031	10	5		BEBERM
COc1ccc([N+](=O)[O-])c(F)c1[S-]	ZINC000575709303	387413556	/nfs/dbraw/zinc/41/35/56/387413556.db2.gz	VJHZDUUIPVLNQJ-UHFFFAOYSA-N	-1	0	203.194	2.031	10	5		BEBERM
CC1(C)[C@H](C(=O)[O-])[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000075490952	168002642	/nfs/dbraw/zinc/00/26/42/168002642.db2.gz	RVZUUUCWHZZLRJ-UWVGGRQHSA-N	-1	0	235.239	2.419	10	5		BEBERM
O=C([O-])c1cc([N+](=O)[O-])c2ccccc2c1O	ZINC000022520873	344084340	/nfs/dbraw/zinc/08/43/40/344084340.db2.gz	VXGFCNFXGCAXIB-UHFFFAOYSA-N	-1	0	233.179	2.152	10	5		BEBERM
Cc1c(C(=O)[O-])ccc(Cl)c1[N+](=O)[O-]	ZINC000039186450	346194035	/nfs/dbraw/zinc/19/40/35/346194035.db2.gz	LRBGMTZLMIMKLP-UHFFFAOYSA-N	-1	0	215.592	2.255	10	5		BEBERM
C[C@@H]1C[C@H]1Nc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000052293667	350980813	/nfs/dbraw/zinc/98/08/13/350980813.db2.gz	JOPCXVLMWXBRFS-HZGVNTEJSA-N	-1	0	236.227	2.113	10	5		BEBERM
O=C([O-])c1c(F)cc([N+](=O)[O-])cc1Cl	ZINC000306845339	351157600	/nfs/dbraw/zinc/15/76/00/351157600.db2.gz	GKYNCVBRHNVPRE-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
O=C([O-])c1c(F)c(Cl)ccc1[N+](=O)[O-]	ZINC000306911310	351323789	/nfs/dbraw/zinc/32/37/89/351323789.db2.gz	KNSGQKITJYPGQB-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
O=[N+]([O-])c1cc(Cl)c(F)c(F)c1[O-]	ZINC000307528294	352634722	/nfs/dbraw/zinc/63/47/22/352634722.db2.gz	MJMZMIXROBZVLW-UHFFFAOYSA-N	-1	0	209.535	2.232	10	5		BEBERM
CC(C)(COc1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000011959448	188105422	/nfs/dbraw/zinc/10/54/22/188105422.db2.gz	QSVVLRLFYQXAJJ-UHFFFAOYSA-N	-1	0	239.227	2.084	10	5		BEBERM
O=[N+]([O-])c1cc(F)cc([O-])c1Br	ZINC000306224956	359354798	/nfs/dbraw/zinc/35/47/98/359354798.db2.gz	BMKNJVQGXQQKMY-UHFFFAOYSA-N	-1	0	235.996	2.202	10	5		BEBERM
O=[N+]([O-])c1c(F)cc([O-])cc1Br	ZINC000306369216	359698998	/nfs/dbraw/zinc/69/89/98/359698998.db2.gz	LAIARYRXAOTAEK-UHFFFAOYSA-N	-1	0	235.996	2.202	10	5		BEBERM
Cc1cc([C@H](C)C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000140436595	372671037	/nfs/dbraw/zinc/67/10/37/372671037.db2.gz	VXEOJYKDIYIGBW-ZETCQYMHSA-N	-1	0	209.201	2.091	10	5		BEBERM
O=C([O-])/C=C\c1cc2cc([N+](=O)[O-])ccc2o1	ZINC000098089182	182415516	/nfs/dbraw/zinc/41/55/16/182415516.db2.gz	JMNMWGHQIABWLM-RQOWECAXSA-N	-1	0	233.179	2.439	10	5		BEBERM
O=C([O-])c1cccc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000039298770	182575537	/nfs/dbraw/zinc/57/55/37/182575537.db2.gz	HMXVHAISMVRGLV-UHFFFAOYSA-N	-1	0	244.206	2.355	10	5		BEBERM
O=[N+]([O-])c1cccc2sc(=S)[n-]c21	ZINC000059174016	182947699	/nfs/dbraw/zinc/94/76/99/182947699.db2.gz	TYDJDZZUZHLFFN-UHFFFAOYSA-N	-1	0	212.255	2.493	10	5		BEBERM
CC(C)(Cc1ccc([N+](=O)[O-])cc1)C(=O)[O-]	ZINC000049804132	384569815	/nfs/dbraw/zinc/56/98/15/384569815.db2.gz	LPECYPCBIIJVFC-UHFFFAOYSA-N	-1	0	223.228	2.248	10	5		BEBERM
O=C([O-])Cc1cccc([N+](=O)[O-])c1C(F)(F)F	ZINC000575338388	386686270	/nfs/dbraw/zinc/68/62/70/386686270.db2.gz	QFKDCLKQYCQLTM-UHFFFAOYSA-N	-1	0	249.144	2.241	10	5		BEBERM
CCOc1cc([O-])cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575655533	387039155	/nfs/dbraw/zinc/03/91/55/387039155.db2.gz	ADYSKBJATNSKNE-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
CCc1cc(OC(F)F)cc([O-])c1[N+](=O)[O-]	ZINC000575660087	387052670	/nfs/dbraw/zinc/05/26/70/387052670.db2.gz	LUQGSPLFTKNMNV-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
O=C([O-])Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1	ZINC000049834946	387152423	/nfs/dbraw/zinc/15/24/23/387152423.db2.gz	PSRIKGNIXGDHMH-UHFFFAOYSA-N	-1	0	247.206	2.482	10	5		BEBERM
CC(=O)c1cc(OC(F)F)cc([O-])c1[N+](=O)[O-]	ZINC000575663037	387270123	/nfs/dbraw/zinc/27/01/23/387270123.db2.gz	PZRDIKIRNHJUEM-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
CC(=O)c1cc([O-])c([N+](=O)[O-])c(OC(F)F)c1	ZINC000575663394	387287559	/nfs/dbraw/zinc/28/75/59/387287559.db2.gz	YIVVKFRGMOTHRZ-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
COc1c(Br)c([O-])ccc1[N+](=O)[O-]	ZINC000575691254	387379075	/nfs/dbraw/zinc/37/90/75/387379075.db2.gz	LUVUBWSPYMDBJC-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
COc1ccc([O-])c(Br)c1[N+](=O)[O-]	ZINC000575692587	387380972	/nfs/dbraw/zinc/38/09/72/387380972.db2.gz	ZMDSNYCVSICUIE-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
CC(=O)c1c(C(F)F)cc([O-])cc1[N+](=O)[O-]	ZINC000575666792	387320044	/nfs/dbraw/zinc/32/00/44/387320044.db2.gz	AXYPRHVQPYRDHW-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
CC(=O)c1ccc(C(F)F)c([O-])c1[N+](=O)[O-]	ZINC000575668911	387323395	/nfs/dbraw/zinc/32/33/95/387323395.db2.gz	PVQQGUNLXRGSNA-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
COc1cc([O-])c(C(F)F)c([N+](=O)[O-])c1	ZINC000575668900	387323720	/nfs/dbraw/zinc/32/37/20/387323720.db2.gz	POISEGFLJFXDBW-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
O=C([O-])c1c(F)cc(C(F)F)cc1[N+](=O)[O-]	ZINC000575670138	387329666	/nfs/dbraw/zinc/32/96/66/387329666.db2.gz	VZMMWDOEQGNGID-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=C([O-])c1cc(F)c([N+](=O)[O-])cc1C(F)F	ZINC000575669765	387330935	/nfs/dbraw/zinc/33/09/35/387330935.db2.gz	NCIVRUIPOQAYJO-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=Cc1c(C(F)F)ccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575670000	387332811	/nfs/dbraw/zinc/33/28/11/387332811.db2.gz	VAQYYHWYXZLIEN-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
COc1cc(C(F)F)cc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575670932	387335961	/nfs/dbraw/zinc/33/59/61/387335961.db2.gz	FSFPUWUPTHXKDT-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1c(C(F)F)ccc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575671362	387337921	/nfs/dbraw/zinc/33/79/21/387337921.db2.gz	JSSAEARWHWKFCL-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1cc(C)cc(/C=C/C(=O)[O-])c1[N+](=O)[O-]	ZINC000575673170	387339609	/nfs/dbraw/zinc/33/96/09/387339609.db2.gz	DYEIWKVGZKCFCA-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
O=C([O-])c1ccc([N+](=O)[O-])cc1-n1cccc1	ZINC000001768172	322810764	/nfs/dbraw/zinc/81/07/64/322810764.db2.gz	NNVIDGFTONEVTH-UHFFFAOYSA-N	-1	0	232.195	2.084	10	5		BEBERM
CCOc1cc(C)c([N+](=O)[O-])cc1C(=O)[O-]	ZINC000575698745	387390840	/nfs/dbraw/zinc/39/08/40/387390840.db2.gz	ICGQKBHSFOAVGQ-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCOc1cc([N+](=O)[O-])c(C)cc1C(=O)[O-]	ZINC000575699333	387402592	/nfs/dbraw/zinc/40/25/92/387402592.db2.gz	UJRFIBUVDVVIDA-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
COc1cc(F)c([N+](=O)[O-])c([S-])c1	ZINC000575708840	387414058	/nfs/dbraw/zinc/41/40/58/387414058.db2.gz	RVWAJLPFDRAHMN-UHFFFAOYSA-N	-1	0	203.194	2.031	10	5		BEBERM
CC[C@H](Cc1cccc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000040452082	388416800	/nfs/dbraw/zinc/41/68/00/388416800.db2.gz	WZRVLOGQNMKHFK-SECBINFHSA-N	-1	0	223.228	2.248	10	5		BEBERM
CC[C@H](C)Oc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000050517708	171356471	/nfs/dbraw/zinc/35/64/71/171356471.db2.gz	GNFRRZVOYMEDMF-ZETCQYMHSA-N	-1	0	239.227	2.470	10	5		BEBERM
CC[C@H](Cc1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000040377743	171471770	/nfs/dbraw/zinc/47/17/70/171471770.db2.gz	LOMPHOSQUBPVRP-MRVPVSSYSA-N	-1	0	223.228	2.248	10	5		BEBERM
Cc1c(NCCCC(=O)[O-])cccc1[N+](=O)[O-]	ZINC000019410138	177617754	/nfs/dbraw/zinc/61/77/54/177617754.db2.gz	MBBOIIGNDLPVSP-UHFFFAOYSA-N	-1	0	238.243	2.180	10	5		BEBERM
O=C([O-])c1cc2c(ccc3cccnc32)oc1=O	ZINC000057346881	526356859	/nfs/dbraw/zinc/35/68/59/526356859.db2.gz	WFLSEDAAHKHTDQ-UHFFFAOYSA-N	-1	0	241.202	2.039	10	5		BEBERM
Cc1ccc(CSCC(=O)[O-])cc1[N+](=O)[O-]	ZINC000714029448	977659009	/nfs/dbraw/zinc/65/90/09/977659009.db2.gz	NOQUPTTWAYZZAH-UHFFFAOYSA-N	-1	0	241.268	2.221	10	5		BEBERM
O=C([O-])c1cc2ccc(Cl)c([N+](=O)[O-])c2[nH]1	ZINC000536956871	343652440	/nfs/dbraw/zinc/65/24/40/343652440.db2.gz	ALBACSSULXRNRH-UHFFFAOYSA-N	-1	0	240.602	2.428	10	5		BEBERM
Cc1c(Cl)c(CC(=O)[O-])ccc1[N+](=O)[O-]	ZINC000396158396	344632020	/nfs/dbraw/zinc/63/20/20/344632020.db2.gz	JYBZVXCVZHDZBM-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
Cc1cc(C(=O)[O-])c(Cl)c([N+](=O)[O-])c1	ZINC000247853238	345317695	/nfs/dbraw/zinc/31/76/95/345317695.db2.gz	BMICAFREIACJRU-UHFFFAOYSA-N	-1	0	215.592	2.255	10	5		BEBERM
Cc1nc2cc([N+](=O)[O-])c([O-])cc2s1	ZINC000090412029	180087916	/nfs/dbraw/zinc/08/79/16/180087916.db2.gz	DBLFCBGFWMDGEV-UHFFFAOYSA-N	-1	0	210.214	2.219	10	5		BEBERM
Cc1c(Cl)c([N+](=O)[O-])ccc1C(=O)[O-]	ZINC000307033237	351432975	/nfs/dbraw/zinc/43/29/75/351432975.db2.gz	RJMARZWXNSJTPR-UHFFFAOYSA-N	-1	0	215.592	2.255	10	5		BEBERM
O=[N+]([O-])c1cc([O-])cc(F)c1Br	ZINC000307466049	352616303	/nfs/dbraw/zinc/61/63/03/352616303.db2.gz	NKFDEWZESIHZBC-UHFFFAOYSA-N	-1	0	235.996	2.202	10	5		BEBERM
CC(C)COc1ccc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000019270758	188107433	/nfs/dbraw/zinc/10/74/33/188107433.db2.gz	QQWBFLNMQGCNCO-UHFFFAOYSA-N	-1	0	239.227	2.328	10	5		BEBERM
O=C([O-])c1cc(F)cc(Cl)c1[N+](=O)[O-]	ZINC000137713013	357246552	/nfs/dbraw/zinc/24/65/52/357246552.db2.gz	QJDZMNBCWDVFOE-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
O=[N+]([O-])c1c(F)c([O-])ccc1Br	ZINC000306199376	359027217	/nfs/dbraw/zinc/02/72/17/359027217.db2.gz	SPHBRVIRUKILRH-UHFFFAOYSA-N	-1	0	235.996	2.202	10	5		BEBERM
O=[N+]([O-])c1ccc(Br)c([O-])c1F	ZINC000306220128	359338937	/nfs/dbraw/zinc/33/89/37/359338937.db2.gz	RFRZBJAINLPAOB-UHFFFAOYSA-N	-1	0	235.996	2.202	10	5		BEBERM
O=[N+]([O-])c1c[nH]c(Br)cc1=S	ZINC000306294343	372007690	/nfs/dbraw/zinc/00/76/90/372007690.db2.gz	AEASYMAGJXMPJH-UHFFFAOYSA-N	-1	0	235.062	2.041	10	5		BEBERM
O=C([O-])c1ccc2[nH]c(=O)c3ccccc3c2c1	ZINC000028645733	182571858	/nfs/dbraw/zinc/57/18/58/182571858.db2.gz	UQJFJMGMOGWAFO-UHFFFAOYSA-N	-1	0	239.230	2.380	10	5		BEBERM
O=Cc1cc(C(F)F)c([O-])c([N+](=O)[O-])c1	ZINC000575669434	384451794	/nfs/dbraw/zinc/45/17/94/384451794.db2.gz	VIAAFHXASYSOBS-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
CCc1c2cccc([N+](=O)[O-])c2[nH]c1C(=O)[O-]	ZINC000103244202	387155028	/nfs/dbraw/zinc/15/50/28/387155028.db2.gz	XBKSEZSINQHZPF-UHFFFAOYSA-N	-1	0	234.211	2.337	10	5		BEBERM
Cc1cc([O-])c([N+](=O)[O-])c(OC(F)F)c1	ZINC000575666044	387311943	/nfs/dbraw/zinc/31/19/43/387311943.db2.gz	GKZNLWDWYDHYHA-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
COc1cc(C)cc([N+](=O)[O-])c1/C=C/C(=O)[O-]	ZINC000575675939	387358297	/nfs/dbraw/zinc/35/82/97/387358297.db2.gz	ZQBYFCFKSAQVIN-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
COc1cc([O-])cc(Br)c1[N+](=O)[O-]	ZINC000575691764	387379610	/nfs/dbraw/zinc/37/96/10/387379610.db2.gz	QSMDFJGUYGZYQD-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
Cc1ccc(OC(F)F)c([O-])c1[N+](=O)[O-]	ZINC000575669018	387325747	/nfs/dbraw/zinc/32/57/47/387325747.db2.gz	XFAAHLBKMKERQY-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
Cc1cc([N+](=O)[O-])c(OC(F)F)cc1[O-]	ZINC000575668102	387325811	/nfs/dbraw/zinc/32/58/11/387325811.db2.gz	QYGGFTCVINZVGE-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
O=C([O-])c1cc(C(F)F)c(F)cc1[N+](=O)[O-]	ZINC000575669555	387328637	/nfs/dbraw/zinc/32/86/37/387328637.db2.gz	BQAUGFFGXJVELT-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=Cc1cc([O-])c([N+](=O)[O-])cc1C(F)F	ZINC000575669441	387329622	/nfs/dbraw/zinc/32/96/22/387329622.db2.gz	VOPZHXBWPZPXKJ-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
O=C([O-])c1cc(C(F)F)c([N+](=O)[O-])cc1F	ZINC000575669902	387330476	/nfs/dbraw/zinc/33/04/76/387330476.db2.gz	SBIUKXGXYNPOBW-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=Cc1cc([N+](=O)[O-])c(C(=O)[O-])cc1C(F)F	ZINC000575669759	387330625	/nfs/dbraw/zinc/33/06/25/387330625.db2.gz	MWFKCOZLQNGLKS-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
O=Cc1c(C(=O)[O-])cc(C(F)F)cc1[N+](=O)[O-]	ZINC000575669780	387330674	/nfs/dbraw/zinc/33/06/74/387330674.db2.gz	NVQWUMWFBPSRRI-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
O=Cc1cc(C(F)F)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575669760	387330848	/nfs/dbraw/zinc/33/08/48/387330848.db2.gz	MXAQMGPCBQZSNJ-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
COc1cc(C(F)F)c(C(=O)[O-])c([N+](=O)[O-])c1	ZINC000575670813	387336138	/nfs/dbraw/zinc/33/61/38/387336138.db2.gz	CLSCNTCYXYYQFU-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
CCOc1cc(C(=O)[O-])c(C)cc1[N+](=O)[O-]	ZINC000575698747	387391028	/nfs/dbraw/zinc/39/10/28/387391028.db2.gz	IDKJPOIRMTZITB-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCOc1cc(CC)c(C(=O)[O-])c([N+](=O)[O-])c1	ZINC000575695294	387395720	/nfs/dbraw/zinc/39/57/20/387395720.db2.gz	HODVVCQUFWDPPI-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1cc([N+](=O)[O-])cc(C(=O)[O-])c1CC	ZINC000575696406	387397325	/nfs/dbraw/zinc/39/73/25/387397325.db2.gz	NINRCPZEBVTVEN-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1cc(C(=O)[O-])c(CC)c([N+](=O)[O-])c1	ZINC000575696365	387397683	/nfs/dbraw/zinc/39/76/83/387397683.db2.gz	MJLVTPNREBCAOO-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1cc([N+](=O)[O-])c(C(=O)[O-])cc1C	ZINC000575699137	387402311	/nfs/dbraw/zinc/40/23/11/387402311.db2.gz	QEXZXWBHPUEXOZ-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCOC(=O)c1cc([O-])c([N+](=O)[O-])cc1Cl	ZINC000575699525	387403628	/nfs/dbraw/zinc/40/36/28/387403628.db2.gz	AVFSZYJJUJFDAW-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
CCc1ccc([C@H](CC(=O)[O-])C[N+](=O)[O-])cc1	ZINC000057528388	171841606	/nfs/dbraw/zinc/84/16/06/171841606.db2.gz	FQRHRWPKKAPLEM-LLVKDONJSA-N	-1	0	237.255	2.084	10	5		BEBERM
Cc1cc([N+](=O)[O-])c(Cl)cc1[S@](=O)[O-]	ZINC000675062125	640948207	/nfs/dbraw/zinc/94/82/07/640948207.db2.gz	GMBVXCLGEBWERV-UHFFFAOYSA-N	-1	0	235.648	2.137	10	5		BEBERM
Cc1cc(NC2CC2)c(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000721042054	978093355	/nfs/dbraw/zinc/09/33/55/978093355.db2.gz	IBLZXPISZODCRQ-UHFFFAOYSA-N	-1	0	236.227	2.176	10	5		BEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(Cl)c1F	ZINC000306654028	361861709	/nfs/dbraw/zinc/86/17/09/361861709.db2.gz	VYBMSULMDAUPKZ-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
COc1cc(Br)cc([N+](=O)[O-])c1[O-]	ZINC000095080312	191053634	/nfs/dbraw/zinc/05/36/34/191053634.db2.gz	RPYBYIOJISGHNI-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
C[C@@H]1C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000052293662	350980775	/nfs/dbraw/zinc/98/07/75/350980775.db2.gz	JOPCXVLMWXBRFS-MUWHJKNJSA-N	-1	0	236.227	2.113	10	5		BEBERM
Cc1cc([N+](=O)[O-])c(Br)cc1[O-]	ZINC000307421936	352591449	/nfs/dbraw/zinc/59/14/49/352591449.db2.gz	OGFANKVKUKCMBK-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
Cc1c(C[C@@H](C)C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000040377503	188128489	/nfs/dbraw/zinc/12/84/89/188128489.db2.gz	TZSZEEKTCYPWRX-SSDOTTSWSA-N	-1	0	223.228	2.166	10	5		BEBERM
CCCOc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000036225928	169314115	/nfs/dbraw/zinc/31/41/15/169314115.db2.gz	HSHJFGFSWFBHEO-UHFFFAOYSA-N	-1	0	225.200	2.082	10	5		BEBERM
O=Cc1cc(C(F)F)cc([O-])c1[N+](=O)[O-]	ZINC000575668639	384446454	/nfs/dbraw/zinc/44/64/54/384446454.db2.gz	LVVAMQNJLRVXKU-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
Cc1c(OC(F)F)cc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000575666261	384439414	/nfs/dbraw/zinc/43/94/14/384439414.db2.gz	HPJJBGLDDUXXKK-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
O=C([O-])Cc1cc([N+](=O)[O-])ccc1C(F)(F)F	ZINC000575338351	386684757	/nfs/dbraw/zinc/68/47/57/386684757.db2.gz	MWPXSMVHJONWDI-UHFFFAOYSA-N	-1	0	249.144	2.241	10	5		BEBERM
CCc1cc([O-])c([N+](=O)[O-])c(OC(F)F)c1	ZINC000575658592	387047703	/nfs/dbraw/zinc/04/77/03/387047703.db2.gz	CPSQAXBESXVXDA-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
CCc1ccc([O-])c([N+](=O)[O-])c1OC(F)F	ZINC000575658361	387047794	/nfs/dbraw/zinc/04/77/94/387047794.db2.gz	AXNZCFSJAVXPOS-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
O=[N+]([O-])c1ccc([O-])c(OC(F)F)c1F	ZINC000575660863	387054460	/nfs/dbraw/zinc/05/44/60/387054460.db2.gz	BKWQWFBACXKYGN-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
Cc1cc([O-])c([N+](=O)[O-])cc1OC(F)F	ZINC000575664849	387312357	/nfs/dbraw/zinc/31/23/57/387312357.db2.gz	ABUCSNTYTCYPDD-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
Cc1ccc(C(=O)[O-])c(OC(F)F)c1[N+](=O)[O-]	ZINC000575665462	387313456	/nfs/dbraw/zinc/31/34/56/387313456.db2.gz	DXUUQZMTSMCMCP-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
Cc1cc([N+](=O)[O-])c(C(=O)[O-])cc1OC(F)F	ZINC000575667222	387315377	/nfs/dbraw/zinc/31/53/77/387315377.db2.gz	LDCAHGCFFIAALE-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
Cc1cc(OC(F)F)cc([N+](=O)[O-])c1[O-]	ZINC000575666275	387317312	/nfs/dbraw/zinc/31/73/12/387317312.db2.gz	HVHFFUSRMYNYJQ-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
Cc1c(OC(F)F)ccc([O-])c1[N+](=O)[O-]	ZINC000575666272	387317944	/nfs/dbraw/zinc/31/79/44/387317944.db2.gz	HVABLZLVMZRURW-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
COc1c(Br)ccc([O-])c1[N+](=O)[O-]	ZINC000575690817	387380726	/nfs/dbraw/zinc/38/07/26/387380726.db2.gz	CBMHXKUVONRZOB-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
COc1c([O-])ccc([N+](=O)[O-])c1Br	ZINC000575692598	387381551	/nfs/dbraw/zinc/38/15/51/387381551.db2.gz	ZRGATMXAPAZQSK-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
COc1cc([O-])c(Br)c([N+](=O)[O-])c1	ZINC000575690852	387381817	/nfs/dbraw/zinc/38/18/17/387381817.db2.gz	DAEMCEBPHQWDCG-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
COc1cc([O-])cc(C(F)F)c1[N+](=O)[O-]	ZINC000575669423	387328783	/nfs/dbraw/zinc/32/87/83/387328783.db2.gz	UZIUZZAPRCYMAH-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
O=Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(C(F)F)c1	ZINC000575669637	387329393	/nfs/dbraw/zinc/32/93/93/387329393.db2.gz	GYFASBLSGFOOHE-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
O=Cc1cc(C(=O)[O-])cc([N+](=O)[O-])c1C(F)F	ZINC000575669789	387330680	/nfs/dbraw/zinc/33/06/80/387330680.db2.gz	NZTPERWWBZBIBN-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
O=Cc1cc([O-])c([N+](=O)[O-])c(C(F)F)c1	ZINC000575669276	387332466	/nfs/dbraw/zinc/33/24/66/387332466.db2.gz	QUUUAHHOJBAOHY-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
Cc1cc(OC(F)F)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575669192	387333044	/nfs/dbraw/zinc/33/30/44/387333044.db2.gz	ZVFUBUJBPMKESD-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
CCOc1cc([N+](=O)[O-])cc(C(=O)[O-])c1C	ZINC000575698791	387391512	/nfs/dbraw/zinc/39/15/12/387391512.db2.gz	KHOKWJVSCFPXAA-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CC(C)[C@@H](Oc1cccc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000011885546	167461015	/nfs/dbraw/zinc/46/10/15/167461015.db2.gz	OZLCDNCTPFGECZ-SNVBAGLBSA-N	-1	0	239.227	2.083	10	5		BEBERM
C[C@H](Sc1cccc(F)c1[N+](=O)[O-])C(=O)[O-]	ZINC000037419419	177029396	/nfs/dbraw/zinc/02/93/96/177029396.db2.gz	ZNOXECODBVYICX-YFKPBYRVSA-N	-1	0	245.231	2.299	10	5		BEBERM
O=[N+]([O-])c1cnc(Br)c([S-])c1	ZINC000306813816	398206349	/nfs/dbraw/zinc/20/63/49/398206349.db2.gz	CDSLLLONMFGPRQ-UHFFFAOYSA-N	-1	0	235.062	2.041	10	5		BEBERM
O=C([O-])c1ccc2c(c1)[nH]c(=O)c1ccccc12	ZINC000003602080	342735013	/nfs/dbraw/zinc/73/50/13/342735013.db2.gz	QCZYYHNRVZRTGW-UHFFFAOYSA-N	-1	0	239.230	2.380	10	5		BEBERM
Cc1cc(C)c(/C=C/C(=O)[O-])c([N+](=O)[O-])c1	ZINC000396109222	344605137	/nfs/dbraw/zinc/60/51/37/344605137.db2.gz	CTBSHIYPGSOALQ-ONEGZZNKSA-N	-1	0	221.212	2.309	10	5		BEBERM
Cc1cc([N+](=O)[O-])cc(/C=C/C(=O)[O-])c1C	ZINC000396110714	344605459	/nfs/dbraw/zinc/60/54/59/344605459.db2.gz	HGDVNGKNTILXHF-ONEGZZNKSA-N	-1	0	221.212	2.309	10	5		BEBERM
Cc1cc(CC(=O)[O-])c(Cl)c([N+](=O)[O-])c1	ZINC000396160781	344633749	/nfs/dbraw/zinc/63/37/49/344633749.db2.gz	OPYAZQGZTNXMPF-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
Cc1cc(Cl)c(CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000396163250	344635071	/nfs/dbraw/zinc/63/50/71/344635071.db2.gz	ROCBOZYBOCHGLB-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
CCc1cc(=O)n(-c2ccccc2[N+](=O)[O-])[n-]1	ZINC000101835289	168508916	/nfs/dbraw/zinc/50/89/16/168508916.db2.gz	WSYBIPGFEOZFHS-UHFFFAOYSA-N	-1	0	233.227	2.098	10	5		BEBERM
C[C@H](CC(=O)[O-])Cc1ccc([N+](=O)[O-])cc1	ZINC000146273469	537894932	/nfs/dbraw/zinc/89/49/32/537894932.db2.gz	YWAAKYFVGRTFHX-QMMMGPOBSA-N	-1	0	223.228	2.248	10	5		BEBERM
C[C@@H](CC(=O)[O-])Cc1ccc([N+](=O)[O-])cc1	ZINC000215664254	537968795	/nfs/dbraw/zinc/96/87/95/537968795.db2.gz	YWAAKYFVGRTFHX-MRVPVSSYSA-N	-1	0	223.228	2.248	10	5		BEBERM
CCCc1cc(=O)n(-c2ccccc2[N+](=O)[O-])[n-]1	ZINC000100862731	168604927	/nfs/dbraw/zinc/60/49/27/168604927.db2.gz	ORWQIFRKUAFMLF-UHFFFAOYSA-N	-1	0	247.254	2.488	10	5		BEBERM
O=C([O-])c1cc(F)cc([N+](=O)[O-])c1Cl	ZINC000307425082	352592750	/nfs/dbraw/zinc/59/27/50/352592750.db2.gz	FBSJHLNNZUVISQ-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
Cc1c(C[C@H](C)C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000040377504	188128595	/nfs/dbraw/zinc/12/85/95/188128595.db2.gz	TZSZEEKTCYPWRX-ZETCQYMHSA-N	-1	0	223.228	2.166	10	5		BEBERM
Cc1cc([O-])cc(Br)c1[N+](=O)[O-]	ZINC000223368004	355774720	/nfs/dbraw/zinc/77/47/20/355774720.db2.gz	DUMFMUBYZZUHTG-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
Cc1cc([N+](=O)[O-])c(Cl)c([S@](=O)[O-])c1	ZINC000675060549	541463804	/nfs/dbraw/zinc/46/38/04/541463804.db2.gz	CAGGMRPHSLFVPE-UHFFFAOYSA-N	-1	0	235.648	2.137	10	5		BEBERM
O=C([O-])c1cccc(C2CC2)c1[N+](=O)[O-]	ZINC000039086994	372861917	/nfs/dbraw/zinc/86/19/17/372861917.db2.gz	RYQCJNNQJAYVKM-UHFFFAOYSA-N	-1	0	207.185	2.170	10	5		BEBERM
O=C([O-])CSc1c(F)c(F)ccc1[N+](=O)[O-]	ZINC000053162561	182473636	/nfs/dbraw/zinc/47/36/36/182473636.db2.gz	AFBTWYPFUQELNI-UHFFFAOYSA-N	-1	0	249.194	2.050	10	5		BEBERM
O=Cc1cc(C(F)F)c(C(=O)[O-])c([N+](=O)[O-])c1	ZINC000575670258	384459698	/nfs/dbraw/zinc/45/96/98/384459698.db2.gz	YNINMRLZTXZJSL-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
COc1c(F)ccc([N+](=O)[O-])c1[S-]	ZINC000575708289	384815903	/nfs/dbraw/zinc/81/59/03/384815903.db2.gz	LZRLNBLHTZCJBB-UHFFFAOYSA-N	-1	0	203.194	2.031	10	5		BEBERM
CCc1cc(OC(F)F)cc([N+](=O)[O-])c1[O-]	ZINC000575660431	387054192	/nfs/dbraw/zinc/05/41/92/387054192.db2.gz	PUGMVQFRKXQKKR-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
Cc1cc([O-])cc(OC(F)F)c1[N+](=O)[O-]	ZINC000575665066	387313422	/nfs/dbraw/zinc/31/34/22/387313422.db2.gz	AXWPVFDPDCUIIC-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
Cc1c(OC(F)F)ccc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575666551	387317470	/nfs/dbraw/zinc/31/74/70/387317470.db2.gz	JMNBTHDLZGHIST-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
COc1cc([N+](=O)[O-])cc(C)c1/C=C/C(=O)[O-]	ZINC000575675741	387359730	/nfs/dbraw/zinc/35/97/30/387359730.db2.gz	XUEFMUQNYCVIDU-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
COc1cc(Br)cc([O-])c1[N+](=O)[O-]	ZINC000575692584	387381680	/nfs/dbraw/zinc/38/16/80/387381680.db2.gz	ZKFUTNUCZLCGIJ-UHFFFAOYSA-N	-1	0	248.032	2.072	10	5		BEBERM
O=Cc1cc(C(=O)[O-])cc(C(F)F)c1[N+](=O)[O-]	ZINC000575670133	387328839	/nfs/dbraw/zinc/32/88/39/387328839.db2.gz	VVLHCSYOARGORM-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
O=C([O-])c1cc([N+](=O)[O-])cc(C(F)F)c1F	ZINC000575669627	387329907	/nfs/dbraw/zinc/32/99/07/387329907.db2.gz	GOROHSNWTUVHLN-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=C([O-])c1cc(F)c(C(F)F)c([N+](=O)[O-])c1	ZINC000575669846	387330804	/nfs/dbraw/zinc/33/08/04/387330804.db2.gz	PZBMSTBGYIACKR-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
CCOc1cc(C)c(C(=O)[O-])c([N+](=O)[O-])c1	ZINC000575699692	387403231	/nfs/dbraw/zinc/40/32/31/387403231.db2.gz	WGLNITYLCZBFMI-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCCN(C)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000211979986	387505569	/nfs/dbraw/zinc/50/55/69/387505569.db2.gz	FZNKFZKXOYFZCX-UHFFFAOYSA-N	-1	0	238.243	2.139	10	5		BEBERM
CC[C@@H](Cc1cccc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000040452081	388417064	/nfs/dbraw/zinc/41/70/64/388417064.db2.gz	WZRVLOGQNMKHFK-VIFPVBQESA-N	-1	0	223.228	2.248	10	5		BEBERM
CC(C)c1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000019801469	167568613	/nfs/dbraw/zinc/56/86/13/167568613.db2.gz	GNAZUFIMDZAFDU-UHFFFAOYSA-N	-1	0	209.201	2.416	10	5		BEBERM
CC[C@H](C(=O)[O-])c1ccccc1[N+](=O)[O-]	ZINC000037593998	171238400	/nfs/dbraw/zinc/23/84/00/171238400.db2.gz	ZAQJJAIJSZCNLQ-ZETCQYMHSA-N	-1	0	209.201	2.173	10	5		BEBERM
CCc1ccc([C@@H](CC(=O)[O-])C[N+](=O)[O-])cc1	ZINC000057528386	171832367	/nfs/dbraw/zinc/83/23/67/171832367.db2.gz	FQRHRWPKKAPLEM-NSHDSACASA-N	-1	0	237.255	2.084	10	5		BEBERM
CC1(C)C=Cc2c([O-])c([N+](=O)[O-])ccc2O1	ZINC000205137144	343618268	/nfs/dbraw/zinc/61/82/68/343618268.db2.gz	XLYUSOBESMLNEJ-UHFFFAOYSA-N	-1	0	221.212	2.485	10	5		BEBERM
Cc1c(Cl)cc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000089064073	344243853	/nfs/dbraw/zinc/24/38/53/344243853.db2.gz	SSIJDUSQILUHCN-UHFFFAOYSA-N	-1	0	215.592	2.255	10	5		BEBERM
CCO[P@](=O)([O-])Oc1ccc([N+](=O)[O-])cc1	ZINC000033505980	362470184	/nfs/dbraw/zinc/47/01/84/362470184.db2.gz	YTFMVJUJFNLWIE-UHFFFAOYSA-N	-1	0	247.143	2.111	10	5		BEBERM
O=C([O-])c1ccc(-c2ccncc2[N+](=O)[O-])cc1	ZINC000616570511	348067666	/nfs/dbraw/zinc/06/76/66/348067666.db2.gz	SNKUNOOXWFQZTQ-UHFFFAOYSA-N	-1	0	244.206	2.355	10	5		BEBERM
Cc1nc2cc([N+](=O)[O-])ccc2cc1C(=O)[O-]	ZINC000015015286	180086563	/nfs/dbraw/zinc/08/65/63/180086563.db2.gz	ULYADMVRHLXGAP-UHFFFAOYSA-N	-1	0	232.195	2.150	10	5		BEBERM
C[C@H]1C[C@H]1Nc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000052293668	350980312	/nfs/dbraw/zinc/98/03/12/350980312.db2.gz	JOPCXVLMWXBRFS-IMTBSYHQSA-N	-1	0	236.227	2.113	10	5		BEBERM
O=C([O-])c1ccc(F)c(Cl)c1[N+](=O)[O-]	ZINC000306909768	351322885	/nfs/dbraw/zinc/32/28/85/351322885.db2.gz	HSDIHNPMJRMNIY-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
CC(C)(Cc1cccc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000054631458	188178540	/nfs/dbraw/zinc/17/85/40/188178540.db2.gz	ZRKIINKPEYMLIM-UHFFFAOYSA-N	-1	0	223.228	2.248	10	5		BEBERM
O=[N+]([O-])c1cc2[n-]nc(Cl)c2c([N+](=O)[O-])c1	ZINC000014983666	363366543	/nfs/dbraw/zinc/36/65/43/363366543.db2.gz	ZCDNYPKXWMOUJV-UHFFFAOYSA-N	-1	0	242.578	2.033	10	5		BEBERM
O=C([O-])c1c(Cl)c(F)ccc1[N+](=O)[O-]	ZINC000306223637	359348549	/nfs/dbraw/zinc/34/85/49/359348549.db2.gz	SIHIQTGCFIZTHN-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
Cc1ccc([N+](=O)[O-])c(/C=C/C(=O)[O-])c1C	ZINC000396112422	359807544	/nfs/dbraw/zinc/80/75/44/359807544.db2.gz	MBXHTNBIZWOSSA-GQCTYLIASA-N	-1	0	221.212	2.309	10	5		BEBERM
CCO[P@](=O)([O-])Cc1ccc([N+](=O)[O-])cc1	ZINC000114838401	368942420	/nfs/dbraw/zinc/94/24/20/368942420.db2.gz	CCSDDMRYRITCDV-UHFFFAOYSA-N	-1	0	245.171	2.317	10	5		BEBERM
O=C([O-])c1c(F)c(Cl)cc([N+](=O)[O-])c1F	ZINC000162715716	371827952	/nfs/dbraw/zinc/82/79/52/371827952.db2.gz	LGPIMHXDLNMXTE-UHFFFAOYSA-N	-1	0	237.545	2.225	10	5		BEBERM
Cc1c(Cl)ccc(CC(=O)[O-])c1[N+](=O)[O-]	ZINC000230527549	371925189	/nfs/dbraw/zinc/92/51/89/371925189.db2.gz	UBBRZCSYEGYHOZ-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
O=C([O-])c1ccc2c(ccc3ncccc32)n1	ZINC000008435696	372714743	/nfs/dbraw/zinc/71/47/43/372714743.db2.gz	NGXJHLJRNSBKPV-UHFFFAOYSA-N	-1	0	224.219	2.481	10	5		BEBERM
O=[N+]([O-])c1c([O-])ccc(F)c1OC(F)F	ZINC000575661052	387050936	/nfs/dbraw/zinc/05/09/36/387050936.db2.gz	HBQNUJAASGGPMK-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
Cc1c(C(=O)[O-])cc(OC(F)F)cc1[N+](=O)[O-]	ZINC000575665218	387314029	/nfs/dbraw/zinc/31/40/29/387314029.db2.gz	CBSRTZJOAZLNBJ-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
O=Cc1c(C(F)F)cc([O-])cc1[N+](=O)[O-]	ZINC000575666659	387318828	/nfs/dbraw/zinc/31/88/28/387318828.db2.gz	ABCDNAQHUJDCFD-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
COc1cc([N+](=O)[O-])c(C(F)F)cc1[O-]	ZINC000575669439	387328625	/nfs/dbraw/zinc/32/86/25/387328625.db2.gz	VLXOESDNVPDDKF-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
COc1cc(C(=O)[O-])c([N+](=O)[O-])cc1C(F)F	ZINC000575672297	387337441	/nfs/dbraw/zinc/33/74/41/387337441.db2.gz	XOSIAJRMUJZEIX-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1cc(C(=O)[O-])c(C(F)F)c([N+](=O)[O-])c1	ZINC000575672185	387338130	/nfs/dbraw/zinc/33/81/30/387338130.db2.gz	RZVBPGXNMMGNGQ-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1c(/C=C/C(=O)[O-])cc(C)cc1[N+](=O)[O-]	ZINC000575673384	387342284	/nfs/dbraw/zinc/34/22/84/387342284.db2.gz	KJUCPLHNOUHXSW-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
CCOc1cc([O-])c([N+](=O)[O-])c(CC)c1	ZINC000575696446	387397834	/nfs/dbraw/zinc/39/78/34/387397834.db2.gz	PAEHRZMSKBZBIW-UHFFFAOYSA-N	-1	0	211.217	2.262	10	5		BEBERM
CCOc1c(C(=O)[O-])cc(C)cc1[N+](=O)[O-]	ZINC000575699304	387401602	/nfs/dbraw/zinc/40/16/02/387401602.db2.gz	SRMBAYIERMZJCW-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCOC(=O)c1cc(Cl)c([O-])cc1[N+](=O)[O-]	ZINC000575699671	387403844	/nfs/dbraw/zinc/40/38/44/387403844.db2.gz	BTLSUHLFUYYOAZ-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
CCSc1ccc([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000019869578	170656350	/nfs/dbraw/zinc/65/63/50/170656350.db2.gz	YNSNMEYQKOPLDR-UHFFFAOYSA-N	-1	0	227.241	2.405	10	5		BEBERM
O=C([O-])c1cc2c(ccc3ncccc32)oc1=O	ZINC000057346906	526357135	/nfs/dbraw/zinc/35/71/35/526357135.db2.gz	SRIVJFPYQPZYMK-UHFFFAOYSA-N	-1	0	241.202	2.039	10	5		BEBERM
Cc1cc([N+](=O)[O-])cc(C)c1/C=C/C(=O)[O-]	ZINC000396116319	344606883	/nfs/dbraw/zinc/60/68/83/344606883.db2.gz	UWEHITLZLNYVKA-ONEGZZNKSA-N	-1	0	221.212	2.309	10	5		BEBERM
Cc1cc([N+](=O)[O-])cc(Cl)c1CC(=O)[O-]	ZINC000396155054	344626925	/nfs/dbraw/zinc/62/69/25/344626925.db2.gz	FROKFMVKOJGBFU-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
Cc1nc(-c2ccc([N+](=O)[O-])cc2)oc1C(=O)[O-]	ZINC000051943896	179864580	/nfs/dbraw/zinc/86/45/80/179864580.db2.gz	XFNBEWPOCVXOFL-UHFFFAOYSA-N	-1	0	248.194	2.256	10	5		BEBERM
Cc1ccc2c(Cl)n[nH]c2c1[N+](=O)[O-]	ZINC000014986279	350228845	/nfs/dbraw/zinc/22/88/45/350228845.db2.gz	GVLQTPUQQONAER-UHFFFAOYSA-N	-1	0	211.608	2.433	10	5		BEBERM
Cc1ccc([O-])c(Br)c1[N+](=O)[O-]	ZINC000307326372	352018462	/nfs/dbraw/zinc/01/84/62/352018462.db2.gz	HNGHXWWKEPQTME-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
O=[N+]([O-])c1ccc(F)c([O-])c1Br	ZINC000307543998	352644761	/nfs/dbraw/zinc/64/47/61/352644761.db2.gz	FXQLPBYNRSVJHT-UHFFFAOYSA-N	-1	0	235.996	2.202	10	5		BEBERM
CC(C)(Cc1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000054631468	188177867	/nfs/dbraw/zinc/17/78/67/188177867.db2.gz	HINCZXNBBATEJJ-UHFFFAOYSA-N	-1	0	223.228	2.248	10	5		BEBERM
O=C([O-])c1ccc2oc3ncccc3c(=O)c2c1	ZINC000038887038	358206707	/nfs/dbraw/zinc/20/67/07/358206707.db2.gz	WCTUPXVVWLQAEE-UHFFFAOYSA-N	-1	0	241.202	2.039	10	5		BEBERM
O=C([O-])C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000584630020	358299013	/nfs/dbraw/zinc/29/90/13/358299013.db2.gz	XTMIQEAFVYHRQO-YWEYNIOJSA-N	-1	0	243.602	2.232	10	5		BEBERM
O=[N+]([O-])c1c([O-])cc(OC(F)F)cc1F	ZINC000575661363	384415601	/nfs/dbraw/zinc/41/56/01/384415601.db2.gz	MPGPHPHPXZYQFZ-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
O=C([O-])c1ccc(C(F)F)c(F)c1[N+](=O)[O-]	ZINC000575669538	384455685	/nfs/dbraw/zinc/45/56/85/384455685.db2.gz	AQKNCTVZUBHCPO-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=C([O-])CCc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000034463245	385241058	/nfs/dbraw/zinc/24/10/58/385241058.db2.gz	DCZHPRKSZMGJPB-UHFFFAOYSA-N	-1	0	229.619	2.265	10	5		BEBERM
CCc1cc([N+](=O)[O-])c([O-])cc1OC(F)F	ZINC000575658157	387046127	/nfs/dbraw/zinc/04/61/27/387046127.db2.gz	AAABWWVFVWWYQU-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
CCOc1ccc(OC(F)F)c([O-])c1[N+](=O)[O-]	ZINC000575657948	387050340	/nfs/dbraw/zinc/05/03/40/387050340.db2.gz	NSNJQZNVVLDRJI-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
O=Cc1cc([N+](=O)[O-])c([O-])cc1C(F)F	ZINC000575667417	387316782	/nfs/dbraw/zinc/31/67/82/387316782.db2.gz	DLSFGTKIVPEIJD-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
CC(=O)c1cc([O-])c(OC(F)F)cc1[N+](=O)[O-]	ZINC000575663004	387269748	/nfs/dbraw/zinc/26/97/48/387269748.db2.gz	OHKGZHPHCUFQJY-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
CC(=O)c1cc([O-])c(C(F)F)c([N+](=O)[O-])c1	ZINC000575668904	387323582	/nfs/dbraw/zinc/32/35/82/387323582.db2.gz	PTSCRAXOWPXQLN-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
O=Cc1cc([O-])cc([N+](=O)[O-])c1C(F)F	ZINC000575668168	387325541	/nfs/dbraw/zinc/32/55/41/387325541.db2.gz	LBMYXTLXVPAJDO-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
Cc1c(OC(F)F)c(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC000575669016	387325906	/nfs/dbraw/zinc/32/59/06/387325906.db2.gz	XBARRFCZPJFFBT-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
O=Cc1cc([N+](=O)[O-])cc(C(F)F)c1[O-]	ZINC000575668767	387326763	/nfs/dbraw/zinc/32/67/63/387326763.db2.gz	NMQKAUUQUWSBIJ-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
O=Cc1cc(C(=O)[O-])c(C(F)F)c([N+](=O)[O-])c1	ZINC000575669633	387328833	/nfs/dbraw/zinc/32/88/33/387328833.db2.gz	GWHKSXRLJAQTNO-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
O=C([O-])c1cc(C(F)F)cc(F)c1[N+](=O)[O-]	ZINC000575669566	387329721	/nfs/dbraw/zinc/32/97/21/387329721.db2.gz	CJSWXTJNIPJITP-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=Cc1cc([N+](=O)[O-])cc(C(=O)[O-])c1C(F)F	ZINC000575669999	387332995	/nfs/dbraw/zinc/33/29/95/387332995.db2.gz	UYCAWTNRNPYPLG-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
COc1cc([N+](=O)[O-])c(C(F)F)cc1C(=O)[O-]	ZINC000575671749	387337759	/nfs/dbraw/zinc/33/77/59/387337759.db2.gz	MDDFZMYGLXVCLJ-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
CCOc1cc([N+](=O)[O-])c([O-])cc1CC	ZINC000575694531	387386740	/nfs/dbraw/zinc/38/67/40/387386740.db2.gz	DVLTVUYQFMAANQ-UHFFFAOYSA-N	-1	0	211.217	2.262	10	5		BEBERM
CCOc1cc(C(=O)[O-])c(C)c([N+](=O)[O-])c1	ZINC000575698612	387397024	/nfs/dbraw/zinc/39/70/24/387397024.db2.gz	APMWUHRHHGVORD-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCOc1cc(CC)c([N+](=O)[O-])cc1C(=O)[O-]	ZINC000575696422	387397310	/nfs/dbraw/zinc/39/73/10/387397310.db2.gz	NTAUPIAIQJQASU-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1c(CC)cc([N+](=O)[O-])cc1C(=O)[O-]	ZINC000575696441	387397661	/nfs/dbraw/zinc/39/76/61/387397661.db2.gz	OSYRITHGVADIPQ-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1cc(C(=O)[O-])cc(C)c1[N+](=O)[O-]	ZINC000575698988	387402436	/nfs/dbraw/zinc/40/24/36/387402436.db2.gz	PQCFAVNXRBRPPU-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
Cc1c(S[C@H](C)C(=O)[O-])cccc1[N+](=O)[O-]	ZINC000062723619	177626966	/nfs/dbraw/zinc/62/69/66/177626966.db2.gz	LFCACWIWZYFZRI-SSDOTTSWSA-N	-1	0	241.268	2.468	10	5		BEBERM
CC[C@@H](C(=O)[O-])c1ccccc1[N+](=O)[O-]	ZINC000037593999	170671016	/nfs/dbraw/zinc/67/10/16/170671016.db2.gz	ZAQJJAIJSZCNLQ-SSDOTTSWSA-N	-1	0	209.201	2.173	10	5		BEBERM
C[C@H](Oc1cc(Cl)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000051608707	177022349	/nfs/dbraw/zinc/02/23/49/177022349.db2.gz	RTHRZRBBZYKAKE-YFKPBYRVSA-N	-1	0	245.618	2.100	10	5		BEBERM
Cc1cc([N+](=O)[O-])ccc1S[C@H](C)C(=O)[O-]	ZINC000036950006	178273816	/nfs/dbraw/zinc/27/38/16/178273816.db2.gz	GAZNWSOBLAYVEN-SSDOTTSWSA-N	-1	0	241.268	2.468	10	5		BEBERM
Cc1ccc(OCCCC(=O)[O-])c([N+](=O)[O-])c1	ZINC000020329169	178811386	/nfs/dbraw/zinc/81/13/86/178811386.db2.gz	NGJRAVBNRRIMPH-UHFFFAOYSA-N	-1	0	239.227	2.147	10	5		BEBERM
Cc1nc2c(s1)c([O-])ccc2[N+](=O)[O-]	ZINC000045236725	180068578	/nfs/dbraw/zinc/06/85/78/180068578.db2.gz	OUWUPELKCOPLQI-UHFFFAOYSA-N	-1	0	210.214	2.219	10	5		BEBERM
Cc1nc2ccc([N+](=O)[O-])cc2cc1C(=O)[O-]	ZINC000015015285	180099364	/nfs/dbraw/zinc/09/93/64/180099364.db2.gz	PGENVWVGQZMNRW-UHFFFAOYSA-N	-1	0	232.195	2.150	10	5		BEBERM
Cc1ccc(Cl)c([N+](=O)[O-])c1C(=O)[O-]	ZINC000306899567	351309749	/nfs/dbraw/zinc/30/97/49/351309749.db2.gz	KBODWEIFTCJCCM-UHFFFAOYSA-N	-1	0	215.592	2.255	10	5		BEBERM
COC(=O)c1ccc2c(ccc([O-])c2[N+](=O)[O-])c1	ZINC000034147425	351277525	/nfs/dbraw/zinc/27/75/25/351277525.db2.gz	AVCYAFWDASFXER-UHFFFAOYSA-N	-1	0	247.206	2.240	10	5		BEBERM
Cc1c([O-])c(Br)ccc1[N+](=O)[O-]	ZINC000307054003	351454457	/nfs/dbraw/zinc/45/44/57/351454457.db2.gz	QRVBWZYLEPYWPO-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
Cc1cc(Cl)c([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000307165055	351528056	/nfs/dbraw/zinc/52/80/56/351528056.db2.gz	MUFQIPCMJZAZLH-UHFFFAOYSA-N	-1	0	215.592	2.255	10	5		BEBERM
CC(C)[C@H](Oc1ccccc1[N+](=O)[O-])C(=O)[O-]	ZINC000011958574	188104990	/nfs/dbraw/zinc/10/49/90/188104990.db2.gz	FUWZCZQYRLSCTG-JTQLQIEISA-N	-1	0	239.227	2.083	10	5		BEBERM
Cc1cc([N+](=O)[O-])cc([S@](=O)[O-])c1Cl	ZINC000675062477	538488653	/nfs/dbraw/zinc/48/86/53/538488653.db2.gz	UPHAKYHYXVDPEJ-UHFFFAOYSA-N	-1	0	235.648	2.137	10	5		BEBERM
O=c1[n-]c(Cl)c(Cl)cc1[N+](=O)[O-]	ZINC000584621691	358289493	/nfs/dbraw/zinc/28/94/93/358289493.db2.gz	CDJOMYOUJJUGLD-UHFFFAOYSA-N	-1	0	208.988	2.002	10	5		BEBERM
O=c1c2c([n-]n1-c1ccc([N+](=O)[O-])cc1)CCC2	ZINC000104707142	358351848	/nfs/dbraw/zinc/35/18/48/358351848.db2.gz	WZWXUVHUNKTQSG-SNVBAGLBSA-N	-1	0	245.238	2.098	10	5		BEBERM
O=C([O-])c1cc(F)c([N+](=O)[O-])c(Cl)c1	ZINC000306582564	360483387	/nfs/dbraw/zinc/48/33/87/360483387.db2.gz	CHVIWMROFWGWEL-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(F)c1Cl	ZINC000306605920	372045590	/nfs/dbraw/zinc/04/55/90/372045590.db2.gz	QNCFHPWARUOCOY-UHFFFAOYSA-N	-1	0	219.555	2.086	10	5		BEBERM
O=C([O-])c1cc2ncccc2c2cccnc12	ZINC000008435697	372715045	/nfs/dbraw/zinc/71/50/45/372715045.db2.gz	XXKFSJUAPOFMSY-UHFFFAOYSA-N	-1	0	224.219	2.481	10	5		BEBERM
O=C([O-])c1ccc(-c2cccc([N+](=O)[O-])c2)nc1	ZINC000035630079	182562500	/nfs/dbraw/zinc/56/25/00/182562500.db2.gz	QSABSMZRFLSDMP-UHFFFAOYSA-N	-1	0	244.206	2.355	10	5		BEBERM
O=C([O-])c1ccc([N+](=O)[O-])c(C2CC2)c1	ZINC000004424178	384355815	/nfs/dbraw/zinc/35/58/15/384355815.db2.gz	RPTVRFKNWBDUKG-UHFFFAOYSA-N	-1	0	207.185	2.170	10	5		BEBERM
Cc1c([O-])c([N+](=O)[O-])ccc1OC(F)F	ZINC000575667545	384443397	/nfs/dbraw/zinc/44/33/97/384443397.db2.gz	PDTLJAMGZJVMPS-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
Cc1c(C(=O)[O-])ccc(OC(F)F)c1[N+](=O)[O-]	ZINC000575668158	384443795	/nfs/dbraw/zinc/44/37/95/384443795.db2.gz	RKXCMUVTKINLCQ-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
C[C@@H](C(=O)C1CC1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000584616356	385624331	/nfs/dbraw/zinc/62/43/31/385624331.db2.gz	CBNLNUXHGYVCDY-SSDOTTSWSA-N	-1	0	235.239	2.383	10	5		BEBERM
CCOc1ccc([N+](=O)[O-])c([O-])c1OC(F)F	ZINC000575655933	387040737	/nfs/dbraw/zinc/04/07/37/387040737.db2.gz	BFEXWXPTALJAMC-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
CCc1ccc([N+](=O)[O-])c([O-])c1OC(F)F	ZINC000575658491	387047586	/nfs/dbraw/zinc/04/75/86/387047586.db2.gz	FZGZJNWTWOULPZ-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
O=[N+]([O-])c1cc([O-])c(F)cc1OC(F)F	ZINC000575660992	387052835	/nfs/dbraw/zinc/05/28/35/387052835.db2.gz	GBAFNAVSJUBKQC-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
CCOc1cc([N+](=O)[O-])c([O-])cc1OC(F)F	ZINC000575659725	387053248	/nfs/dbraw/zinc/05/32/48/387053248.db2.gz	XQALJGJKXFXTMM-UHFFFAOYSA-N	-1	0	249.169	2.301	10	5		BEBERM
O=[N+]([O-])c1cc([O-])c(F)c(OC(F)F)c1	ZINC000575660841	387053829	/nfs/dbraw/zinc/05/38/29/387053829.db2.gz	AIKZFKZNXITUIC-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
O=[N+]([O-])c1c([O-])cc(F)cc1OC(F)F	ZINC000575661443	387062178	/nfs/dbraw/zinc/06/21/78/387062178.db2.gz	PVEKFGHSKIDLFS-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
CC(=O)c1cc(C(F)F)c([O-])c([N+](=O)[O-])c1	ZINC000575666723	387319388	/nfs/dbraw/zinc/31/93/88/387319388.db2.gz	AMCCYZLSOVENCJ-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
Cc1cc([N+](=O)[O-])c([O-])cc1OC(F)F	ZINC000575667146	387320776	/nfs/dbraw/zinc/32/07/76/387320776.db2.gz	KQNSQQYTVAMRIU-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
CC(=O)c1c([O-])cc([N+](=O)[O-])cc1C(F)F	ZINC000575667537	387320861	/nfs/dbraw/zinc/32/08/61/387320861.db2.gz	GGBSAMGUBNOUQV-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
Cc1ccc([N+](=O)[O-])c(OC(F)F)c1C(=O)[O-]	ZINC000575668235	387324890	/nfs/dbraw/zinc/32/48/90/387324890.db2.gz	SONXSUMEQPSLTB-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
CC(=O)c1cc([N+](=O)[O-])cc(C(F)F)c1[O-]	ZINC000575668113	387325867	/nfs/dbraw/zinc/32/58/67/387325867.db2.gz	JSFJZLGCMOLJOZ-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
O=C([O-])c1cc([N+](=O)[O-])cc(F)c1C(F)F	ZINC000575669684	387330876	/nfs/dbraw/zinc/33/08/76/387330876.db2.gz	JNLRDABADQJBCH-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
O=Cc1cc(C(F)F)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575669737	387330984	/nfs/dbraw/zinc/33/09/84/387330984.db2.gz	MFOCPEDMDVDLCG-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
O=C([O-])c1cc(C(F)F)c(F)c([N+](=O)[O-])c1	ZINC000575669976	387333210	/nfs/dbraw/zinc/33/32/10/387333210.db2.gz	UPRNPQCAUHXZMJ-UHFFFAOYSA-N	-1	0	235.117	2.370	10	5		BEBERM
COc1cc([N+](=O)[O-])cc(C(F)F)c1C(=O)[O-]	ZINC000575671798	387337770	/nfs/dbraw/zinc/33/77/70/387337770.db2.gz	NJMDTEYEWWSKOZ-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
CCOc1cc(C)cc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575698760	387391043	/nfs/dbraw/zinc/39/10/43/387391043.db2.gz	IWBZBSRKSGDLBO-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCOc1cc(C(=O)[O-])c([N+](=O)[O-])cc1CC	ZINC000575696378	387397415	/nfs/dbraw/zinc/39/74/15/387397415.db2.gz	MVFRRJFNVOPOGV-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOC(=O)c1cc([N+](=O)[O-])cc([O-])c1Cl	ZINC000575699885	387403796	/nfs/dbraw/zinc/40/37/96/387403796.db2.gz	DYSCUXUEDKIATF-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
CCOC(=O)c1c(Cl)cc([O-])cc1[N+](=O)[O-]	ZINC000575701042	387405390	/nfs/dbraw/zinc/40/53/90/387405390.db2.gz	QRRNZGROZIUEDJ-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
O=[N+]([O-])c1c([O-])cc(F)cc1OC(F)(F)F	ZINC000575710294	387415661	/nfs/dbraw/zinc/41/56/61/387415661.db2.gz	FZYRTLVLDUEOEY-UHFFFAOYSA-N	-1	0	241.096	2.338	10	5		BEBERM
Cc1ccc([O-])c([N+](=O)[O-])c1Br	ZINC000307168016	397999659	/nfs/dbraw/zinc/99/96/59/397999659.db2.gz	TXWJFRUUMPHISE-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
Cc1cc([N+](=O)[O-])ccc1S[C@@H](C)C(=O)[O-]	ZINC000036950005	178273951	/nfs/dbraw/zinc/27/39/51/178273951.db2.gz	GAZNWSOBLAYVEN-ZETCQYMHSA-N	-1	0	241.268	2.468	10	5		BEBERM
CCCc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000034577565	347022932	/nfs/dbraw/zinc/02/29/32/347022932.db2.gz	GXRWLPVXYJGNTK-UHFFFAOYSA-N	-1	0	209.201	2.246	10	5		BEBERM
Cc1cc(Cl)c(CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000396156626	344628048	/nfs/dbraw/zinc/62/80/48/344628048.db2.gz	HSEXCGWIDUIWAL-UHFFFAOYSA-N	-1	0	229.619	2.184	10	5		BEBERM
CCOC(=O)c1cc([O-])c(Cl)cc1[N+](=O)[O-]	ZINC000309148721	350106949	/nfs/dbraw/zinc/10/69/49/350106949.db2.gz	DEFJDCUJTRODGQ-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
Cc1cc(C(=O)[O-])cc(Cl)c1[N+](=O)[O-]	ZINC000307166596	351535048	/nfs/dbraw/zinc/53/50/48/351535048.db2.gz	PIIHAZABJQOUJY-UHFFFAOYSA-N	-1	0	215.592	2.255	10	5		BEBERM
Cc1cc(Br)cc([O-])c1[N+](=O)[O-]	ZINC000223368395	355775717	/nfs/dbraw/zinc/77/57/17/355775717.db2.gz	FXIHHDSOSXEMHM-UHFFFAOYSA-N	-1	0	232.033	2.371	10	5		BEBERM
Cc1cc(Cl)c([S@](=O)[O-])cc1[N+](=O)[O-]	ZINC000675061461	538487747	/nfs/dbraw/zinc/48/77/47/538487747.db2.gz	XFSGOFPLSWVMRS-UHFFFAOYSA-N	-1	0	235.648	2.137	10	5		BEBERM
Cc1nc(-c2cc([N+](=O)[O-])ccc2[O-])[nH]c1C	ZINC000584622755	358290601	/nfs/dbraw/zinc/29/06/01/358290601.db2.gz	AGNJCILXCMALHF-UHFFFAOYSA-N	-1	0	233.227	2.307	10	5		BEBERM
O=[N+]([O-])c1cccc2[n-]c(=S)sc21	ZINC000095761143	182947905	/nfs/dbraw/zinc/94/79/05/182947905.db2.gz	FDEQWUDLNKAUKP-UHFFFAOYSA-N	-1	0	212.255	2.493	10	5		BEBERM
O=C([O-])c1cc(=O)c2ccc3ccccc3c2[nH]1	ZINC000005974951	384139970	/nfs/dbraw/zinc/13/99/70/384139970.db2.gz	GJLHLPQWVBWHJS-UHFFFAOYSA-N	-1	0	239.230	2.380	10	5		BEBERM
CCc1cc(O)cc([N+](=O)[O-])c1OC(F)F	ZINC000575660527	384409826	/nfs/dbraw/zinc/40/98/26/384409826.db2.gz	RDDAQRFFNFPFCS-UHFFFAOYSA-N	-1	0	233.170	2.464	10	5		BEBERM
Cc1ccc([O-])c([N+](=O)[O-])c1OC(F)F	ZINC000575668951	384450378	/nfs/dbraw/zinc/45/03/78/384450378.db2.gz	WBKUYAWKNYXWMV-UHFFFAOYSA-N	-1	0	219.143	2.210	10	5		BEBERM
Cc1c2[nH]c(C(=O)[O-])cc2ccc1[N+](=O)[O-]	ZINC000536958606	384806277	/nfs/dbraw/zinc/80/62/77/384806277.db2.gz	JCZDDNBVRSANQY-UHFFFAOYSA-N	-1	0	220.184	2.083	10	5		BEBERM
COc1ccc([N+](=O)[O-])c([O-])c1C(F)(F)F	ZINC000205065020	387003101	/nfs/dbraw/zinc/00/31/01/387003101.db2.gz	WABJJVZRNAEMSV-UHFFFAOYSA-N	-1	0	237.133	2.328	10	5		BEBERM
O=[N+]([O-])c1cc(OC(F)F)c([O-])cc1F	ZINC000575661685	387112767	/nfs/dbraw/zinc/11/27/67/387112767.db2.gz	TXPIRGOPEIIGTP-UHFFFAOYSA-N	-1	0	223.106	2.041	10	5		BEBERM
CC(=O)c1cc(OC(F)F)c([O-])cc1[N+](=O)[O-]	ZINC000575662783	387200688	/nfs/dbraw/zinc/20/06/88/387200688.db2.gz	HXWDBDNTCIZNHB-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
Cc1ccc(OC(F)F)c([N+](=O)[O-])c1C(=O)[O-]	ZINC000575665006	387311781	/nfs/dbraw/zinc/31/17/81/387311781.db2.gz	AURSKUCJAXQSAY-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
Cc1cc(OC(F)F)c([N+](=O)[O-])c(C(=O)[O-])c1	ZINC000575665496	387312947	/nfs/dbraw/zinc/31/29/47/387312947.db2.gz	FLLMPVZUVIFCDT-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
O=Cc1cc([O-])c(C(F)F)cc1[N+](=O)[O-]	ZINC000575667075	387315329	/nfs/dbraw/zinc/31/53/29/387315329.db2.gz	BZALFLKXGHFAGF-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
Cc1cc(C(=O)[O-])c(OC(F)F)cc1[N+](=O)[O-]	ZINC000575666536	387316767	/nfs/dbraw/zinc/31/67/67/387316767.db2.gz	JLBCLXHEUDDWQM-UHFFFAOYSA-N	-1	0	247.153	2.203	10	5		BEBERM
CC(=O)c1cc(OC(F)F)cc([N+](=O)[O-])c1[O-]	ZINC000575663027	387269515	/nfs/dbraw/zinc/26/95/15/387269515.db2.gz	PMOPYEMTRZTCLT-UHFFFAOYSA-N	-1	0	247.153	2.104	10	5		BEBERM
COc1cc([N+](=O)[O-])cc(/C=C/C(=O)[O-])c1C	ZINC000575675892	387357476	/nfs/dbraw/zinc/35/74/76/387357476.db2.gz	ZJYXCHYNKMKXFC-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
COc1cc(C(F)F)cc([O-])c1[N+](=O)[O-]	ZINC000575668931	387323236	/nfs/dbraw/zinc/32/32/36/387323236.db2.gz	QCTXKCUBNGPTGP-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
COc1ccc(C(F)F)c([O-])c1[N+](=O)[O-]	ZINC000575668790	387327291	/nfs/dbraw/zinc/32/72/91/387327291.db2.gz	ODIYNBKNVSTUIT-UHFFFAOYSA-N	-1	0	219.143	2.247	10	5		BEBERM
CC(=O)c1cc(C(F)F)c([O-])cc1[N+](=O)[O-]	ZINC000575668779	387327963	/nfs/dbraw/zinc/32/79/63/387327963.db2.gz	NXZMSIGVIQRUNR-UHFFFAOYSA-N	-1	0	231.154	2.441	10	5		BEBERM
O=Cc1c([O-])cc(C(F)F)cc1[N+](=O)[O-]	ZINC000575669424	387329549	/nfs/dbraw/zinc/32/95/49/387329549.db2.gz	UZRDXAAYSACQTO-UHFFFAOYSA-N	-1	0	217.127	2.051	10	5		BEBERM
O=Cc1cc(C(F)F)c([N+](=O)[O-])cc1C(=O)[O-]	ZINC000575669535	387330009	/nfs/dbraw/zinc/33/00/09/387330009.db2.gz	AKWHKWIPRAJKCU-UHFFFAOYSA-N	-1	0	245.137	2.043	10	5		BEBERM
COc1c(C(F)F)cc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000575672225	387338108	/nfs/dbraw/zinc/33/81/08/387338108.db2.gz	UHZGOWUIJBUELB-UHFFFAOYSA-N	-1	0	247.153	2.239	10	5		BEBERM
COc1cc(/C=C/C(=O)[O-])cc(C)c1[N+](=O)[O-]	ZINC000575673343	387341704	/nfs/dbraw/zinc/34/17/04/387341704.db2.gz	JDUWUZZOHFLABH-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
COc1cc(C)c([N+](=O)[O-])cc1/C=C/C(=O)[O-]	ZINC000575674521	387342950	/nfs/dbraw/zinc/34/29/50/387342950.db2.gz	RJIXTFCZPOWKGN-ONEGZZNKSA-N	-1	0	237.211	2.010	10	5		BEBERM
CCOc1cc(CC)cc([O-])c1[N+](=O)[O-]	ZINC000575694519	387387118	/nfs/dbraw/zinc/38/71/18/387387118.db2.gz	DUHXDPFSPZCZAS-UHFFFAOYSA-N	-1	0	211.217	2.262	10	5		BEBERM
CCOc1cc(CC)cc([N+](=O)[O-])c1C(=O)[O-]	ZINC000575697558	387390845	/nfs/dbraw/zinc/39/08/45/387390845.db2.gz	YUXSKNFAZIZRSZ-UHFFFAOYSA-N	-1	0	239.227	2.254	10	5		BEBERM
CCOc1cc(C)cc(C(=O)[O-])c1[N+](=O)[O-]	ZINC000575698773	387390858	/nfs/dbraw/zinc/39/08/58/387390858.db2.gz	JNNUWAVDXXQPRP-UHFFFAOYSA-N	-1	0	225.200	2.000	10	5		BEBERM
CCOC(=O)c1cc([O-])cc([N+](=O)[O-])c1Cl	ZINC000575699518	387403926	/nfs/dbraw/zinc/40/39/26/387403926.db2.gz	APOHNGNBXHNPBQ-UHFFFAOYSA-N	-1	0	245.618	2.131	10	5		BEBERM
CCOC(=O)c1ccc([N+](=O)[O-])c([S-])c1F	ZINC000575701458	387404738	/nfs/dbraw/zinc/40/47/38/387404738.db2.gz	PBKOKJCNNPNGBE-UHFFFAOYSA-N	-1	0	245.231	2.199	10	5		BEBERM
CC(C)c1cc(=O)n(-c2ccccc2[N+](=O)[O-])[n-]1	ZINC000100862729	166755465	/nfs/dbraw/zinc/75/54/65/166755465.db2.gz	FZTYAGUCZOQXED-UHFFFAOYSA-N	-1	0	247.254	2.344	10	5		BEBERM
CC(C)Oc1cc(C(=O)[O-])c([N+](=O)[O-])cc1F	ZINC000050019007	167283984	/nfs/dbraw/zinc/28/39/84/167283984.db2.gz	YDKQYRMMDBBGPP-UHFFFAOYSA-N	-1	0	243.190	2.219	10	5		BEBERM
C[C@@H](Oc1ccc([N+](=O)[O-])c(Cl)c1)C(=O)[O-]	ZINC000035359206	176004670	/nfs/dbraw/zinc/00/46/70/176004670.db2.gz	IDOUEYSSONORNZ-RXMQYKEDSA-N	-1	0	245.618	2.100	10	5		BEBERM
C[C@@H](Sc1cc(F)cc([N+](=O)[O-])c1)C(=O)[O-]	ZINC000037666428	176009522	/nfs/dbraw/zinc/00/95/22/176009522.db2.gz	IBWWVKJAWALOKJ-RXMQYKEDSA-N	-1	0	245.231	2.299	10	5		BEBERM
C[C@@H]1C[C@@H]1Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000052293621	176404883	/nfs/dbraw/zinc/40/48/83/176404883.db2.gz	RZYMPWWPLGJZLC-MUWHJKNJSA-N	-1	0	236.227	2.113	10	5		BEBERM
C[C@H](Sc1cc(F)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC000052118856	177029423	/nfs/dbraw/zinc/02/94/23/177029423.db2.gz	PTNMJAWAVKTMLH-YFKPBYRVSA-N	-1	0	245.231	2.299	10	5		BEBERM
C[C@H]1C[C@H]1Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000052293629	177386406	/nfs/dbraw/zinc/38/64/06/177386406.db2.gz	RZYMPWWPLGJZLC-IMTBSYHQSA-N	-1	0	236.227	2.113	10	5		BEBERM