smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=C(C)Cn1c(COc2cccc(C)c2)n[n-]c1=S	ZINC000006556994	170213485	/nfs/dbraw/zinc/21/34/85/170213485.db2.gz	VNUUUUGBSXTLKE-UHFFFAOYSA-N	-1	1	275.377	3.404	50	30		CGEAMM
Cc1ccc(NC(=O)c2cc([O-])cc(C#N)c2)cc1Cl	ZINC000225412716	376307635	/nfs/dbraw/zinc/30/76/35/376307635.db2.gz	YSNUAGOUAFVOTA-UHFFFAOYSA-N	-1	1	286.718	3.478	50	30		CGEAMM
Cc1ccc(/C=C2/Oc3cc([O-])ccc3C2=O)s1	ZINC000096401392	278778836	/nfs/dbraw/zinc/77/88/36/278778836.db2.gz	JWGPARFFLIKAAV-NTUHNPAUSA-N	-1	1	258.298	3.378	50	30		CGEAMM
CCCCCCCCc1c([O-])nc2n(c1=O)CCCS2	ZINC000100369631	327213969	/nfs/dbraw/zinc/21/39/69/327213969.db2.gz	PKZTWOWVJJTCLE-UHFFFAOYSA-N	-1	1	296.436	3.348	50	30		CGEAMM
Cc1nn(C)c(C)c1C(=O)/C=C\c1ccc([O-])c(Cl)c1	ZINC000096180105	392245170	/nfs/dbraw/zinc/24/51/70/392245170.db2.gz	WOOLXBDXWBWKOH-ALCCZGGFSA-N	-1	1	290.750	3.292	50	30		CGEAMM
[O-]C1=CC(c2ccco2)C=C(O)C1c1nc2ccccc2[nH]1	ZINC000009287748	170370565	/nfs/dbraw/zinc/37/05/65/170370565.db2.gz	QDMDJBKKSLZJLA-UHFFFAOYSA-N	-1	1	294.310	3.044	50	30		CGEAMM
COc1ccc(/C=C\C(=O)c2ccc([O-])cc2)cc1O	ZINC000096766229	185112541	/nfs/dbraw/zinc/11/25/41/185112541.db2.gz	IRCOHSKVGOLJCA-WAPJZHGLSA-N	-1	1	270.284	3.003	50	30		CGEAMM
N#Cc1ccccc1-c1ccc(C=C2SC(=O)[N-]C2=O)o1	ZINC000001012986	368400328	/nfs/dbraw/zinc/40/03/28/368400328.db2.gz	QCIKYCWPOCVLKW-NTUHNPAUSA-N	-1	1	296.307	3.142	50	30		CGEAMM
O=C1C=CC(=O)c2c(Cl)c3ccccc3c([O-])c21	ZINC000001576029	368418904	/nfs/dbraw/zinc/41/89/04/368418904.db2.gz	GFQCSFCTDHAHOM-UHFFFAOYSA-N	-1	1	258.660	3.134	50	30		CGEAMM
C=CCn1c([C@@H](CCCC)C[C@@H](C)O)n[n-]c1=S	ZINC000002285340	391915611	/nfs/dbraw/zinc/91/56/11/391915611.db2.gz	QMSQBJMZVDKFJC-MNOVXSKESA-N	-1	1	269.414	3.171	50	30		CGEAMM
COc1ccc([O-])c(C(=O)/C=C/c2ccc(F)cc2)c1	ZINC000004317029	169957155	/nfs/dbraw/zinc/95/71/55/169957155.db2.gz	QVIJGFSGILDJKE-XBXARRHUSA-N	-1	1	272.275	3.436	50	30		CGEAMM
C=C(C)Cn1c(-c2ccc(OC)cc2)n[n-]c1=S	ZINC000005685827	170129055	/nfs/dbraw/zinc/12/90/55/170129055.db2.gz	WYBSOKBHOSUTJC-UHFFFAOYSA-N	-1	1	261.350	3.192	50	30		CGEAMM
Cc1ccccc1C(=O)Oc1ccc(/C=N/[O-])cc1	ZINC000020418439	171183876	/nfs/dbraw/zinc/18/38/76/171183876.db2.gz	SAIJDQDCCNSXRW-MHWRWJLKSA-N	-1	1	255.273	3.022	50	30		CGEAMM
COCc1cc(C(=O)/C=C/c2cccc(OC)c2)ccc1[O-]	ZINC000006044618	522907400	/nfs/dbraw/zinc/90/74/00/522907400.db2.gz	BDVWQKGIRVKBTP-SOFGYWHQSA-N	-1	1	298.338	3.443	50	30		CGEAMM
COc1ccc(/C=C2/Oc3cc([O-])ccc3C2=O)cc1OC	ZINC000000490673	368379114	/nfs/dbraw/zinc/37/91/14/368379114.db2.gz	YUCCNWHJQXNUQE-LZYBPNLTSA-N	-1	1	298.294	3.026	50	30		CGEAMM
COc1ccc(OC)c(/C=C2\Oc3cc([O-])ccc3C2=O)c1	ZINC000012419792	368613208	/nfs/dbraw/zinc/61/32/08/368613208.db2.gz	ILJGSIJFCUNQRE-PXNMLYILSA-N	-1	1	298.294	3.026	50	30	biogenic	CGEAMM
O=C1c2ccccc2C(=O)C(Cc2ccccc2)=C1[O-]	ZINC000095544267	370201488	/nfs/dbraw/zinc/20/14/88/370201488.db2.gz	DAFZNKDZHABMQJ-UHFFFAOYSA-N	-1	1	264.280	3.120	50	30		CGEAMM
[O-]/N=C1\c2ccccc2-c2c1c(F)c(F)c(F)c2F	ZINC000100314615	370275874	/nfs/dbraw/zinc/27/58/74/370275874.db2.gz	HAIYDSXXHUSMFP-QGOAFFKASA-N	-1	1	267.181	3.450	50	30		CGEAMM
N#Cc1c(=O)[n-]c(=S)[nH]c1-c1ccc(Cl)cc1Cl	ZINC000005238822	170078545	/nfs/dbraw/zinc/07/85/45/170078545.db2.gz	HZAJBIJQIPULCM-UHFFFAOYSA-N	-1	1	298.154	3.278	50	30		CGEAMM
CN(C)c1ccc(/C=C/C(=O)c2ccc([O-])cc2)cc1	ZINC000005549589	170112018	/nfs/dbraw/zinc/11/20/18/170112018.db2.gz	BJWJZTDHDARRCW-LFYBBSHMSA-N	-1	1	267.328	3.354	50	30		CGEAMM
C=C(C)CSc1nc(C)c(CCCC)c(=O)[n-]1	ZINC000008767759	170354846	/nfs/dbraw/zinc/35/48/46/170354846.db2.gz	VHMZWUHTPBPBRP-UHFFFAOYSA-N	-1	1	252.383	3.089	50	30		CGEAMM
[O-]N=C(Cc1nc2ccccc2[nH]1)c1cccs1	ZINC000606355900	348176989	/nfs/dbraw/zinc/17/69/89/348176989.db2.gz	RNXDQPRNNRNWSG-UHFFFAOYSA-N	-1	1	257.318	3.045	50	30		CGEAMM
CC(=O)Nc1nc(SCCCc2ccccc2)n[nH]1	ZINC000006498753	368567791	/nfs/dbraw/zinc/56/77/91/368567791.db2.gz	JJAUBHJBEBPWNB-UHFFFAOYSA-N	-1	1	276.365	3.138	50	30		CGEAMM
O=C(Oc1ccc(/C=N/[O-])cc1)c1ccccc1Cl	ZINC000013111214	368642200	/nfs/dbraw/zinc/64/22/00/368642200.db2.gz	XSVAHGVGAOSTLN-CXUHLZMHSA-N	-1	1	275.691	3.367	50	30		CGEAMM
C=CCc1c(CCC)nc(S[C@@H](C)C=C)[n-]c1=O	ZINC000018120385	368738465	/nfs/dbraw/zinc/73/84/65/368738465.db2.gz	CKWHMVJSCONLKK-JTQLQIEISA-N	-1	1	264.394	3.118	50	30		CGEAMM
COc1ccc(/C=C\C(=O)c2ccc([O-])cc2)cc1OC	ZINC000031500693	368915202	/nfs/dbraw/zinc/91/52/02/368915202.db2.gz	UNWOWTCKYWIPPH-OQFOIZHKSA-N	-1	1	284.311	3.306	50	30		CGEAMM
CC(C=Nn1c(C)n[n-]c1=S)=Cc1ccccc1	ZINC000006056440	170172907	/nfs/dbraw/zinc/17/29/07/170172907.db2.gz	CVGOFVLFLMTLSP-YYTLBARXSA-N	-1	1	258.350	3.187	50	30		CGEAMM
C=C(C)Cc1c(C)nc(SCCCCC)[n-]c1=O	ZINC000008767767	170354866	/nfs/dbraw/zinc/35/48/66/170354866.db2.gz	SIAFYWZXKSFPHY-UHFFFAOYSA-N	-1	1	266.410	3.479	50	30		CGEAMM
C=CCc1c(C)nc(SCc2ccccc2)[n-]c1=O	ZINC000009059295	170362391	/nfs/dbraw/zinc/36/23/91/170362391.db2.gz	AMIJLCIYLOVSIO-UHFFFAOYSA-N	-1	1	272.373	3.099	50	30		CGEAMM
C#CCOc1ccccc1C=C1SC(=S)[N-]C1=O	ZINC000056696241	619711590	/nfs/dbraw/zinc/71/15/90/619711590.db2.gz	KEAJBWBKMDAYLT-DHZHZOJOSA-N	-1	1	275.354	3.028	50	30		CGEAMM
O=C(/C=C/c1cnn(-c2ccccc2)c1)c1ccc([O-])cc1	ZINC000007904128	170306796	/nfs/dbraw/zinc/30/67/96/170306796.db2.gz	CHENZBJCTMLFGG-IZZDOVSWSA-N	-1	1	290.322	3.474	50	30		CGEAMM
N#Cc1cccc(/C=C2\CCc3cc([O-])ccc3C2=O)c1	ZINC000060340103	175637263	/nfs/dbraw/zinc/63/72/63/175637263.db2.gz	RUVVMEKERJDHRL-OQLLNIDSSA-N	-1	1	275.307	3.476	50	30		CGEAMM
Cc1cc(/C=C2\Oc3cc([O-])ccc3C2=O)cc(C)c1O	ZINC000016976102	619461590	/nfs/dbraw/zinc/46/15/90/619461590.db2.gz	ANHXUJFYRUYOHX-CHHVJCJISA-N	-1	1	282.295	3.331	50	30		CGEAMM
CCOc1ccccc1/C=C1\Oc2cc([O-])ccc2C1=O	ZINC000012412415	368613569	/nfs/dbraw/zinc/61/35/69/368613569.db2.gz	UYRWFUSYCUAJGS-SXGWCWSVSA-N	-1	1	282.295	3.407	50	30	biogenic	CGEAMM
C=C[C@H](C)c1c(CCC)nc(-c2ccccn2)[n-]c1=O	ZINC000013468401	368653074	/nfs/dbraw/zinc/65/30/74/368653074.db2.gz	HBVRLPIDRMMZGW-NSHDSACASA-N	-1	1	269.348	3.074	50	30		CGEAMM
C=CCSc1nc([O-])c([C@H](C)CCC)c(=O)n1CC	ZINC000013957297	368671493	/nfs/dbraw/zinc/67/14/93/368671493.db2.gz	DLVAXEMZYAXRRM-SNVBAGLBSA-N	-1	1	282.409	3.151	50	30		CGEAMM
COc1ccc(CC/C(=N\[O-])C2(O)CCCCC2)cc1	ZINC000100841288	370284349	/nfs/dbraw/zinc/28/43/49/370284349.db2.gz	JTPOSKNTTAKMEN-BMRADRMJSA-N	-1	1	277.364	3.153	50	30		CGEAMM
CCCC[C@H]1Oc2c(Cl)cccc2N([O-])C1=O	ZINC000004648855	136394283	/nfs/dbraw/zinc/39/42/83/136394283.db2.gz	BFMVAFNPNMVAEL-SNVBAGLBSA-N	-1	1	255.701	3.013	50	30		CGEAMM
Cc1ccc([N+](=O)[O-])cc1/N=C/c1cccc([O-])c1O	ZINC000000587540	368391436	/nfs/dbraw/zinc/39/14/36/368391436.db2.gz	VTDJZZUBQABKNY-OVCLIPMQSA-N	-1	1	272.260	3.065	50	30		CGEAMM
CCCCOc1ccc(Br)cc1/C=N/[O-]	ZINC000011829303	368597404	/nfs/dbraw/zinc/59/74/04/368597404.db2.gz	WLBXZPRDMVNZQN-MDWZMJQESA-N	-1	1	272.142	3.436	50	30		CGEAMM
C=CCSc1nc([O-])c([C@@H](C)CCC)c(=O)n1CC	ZINC000013957299	368670777	/nfs/dbraw/zinc/67/07/77/368670777.db2.gz	DLVAXEMZYAXRRM-JTQLQIEISA-N	-1	1	282.409	3.151	50	30		CGEAMM
C=C(Cl)COC(=O)c1ccc(Br)c([O-])c1	ZINC000095432686	370192451	/nfs/dbraw/zinc/19/24/51/370192451.db2.gz	ZOXJNUXFGVJGFA-UHFFFAOYSA-N	-1	1	291.528	3.064	50	30		CGEAMM
Cc1csc(C(C#N)=C([O-])c2cccc3cc[nH]c32)n1	ZINC000076764146	541911858	/nfs/dbraw/zinc/91/18/58/541911858.db2.gz	HQMIHPWGZQWDHE-GFCCVEGCSA-N	-1	1	281.340	3.423	50	30		CGEAMM
CC(=O)C1=C([O-])[C@H](Cc2ccccc2)c2ccccc2C1=O	ZINC000253406630	377689079	/nfs/dbraw/zinc/68/90/79/377689079.db2.gz	UUKSDTDSXOYIET-MRXNPFEDSA-N	-1	1	292.334	3.454	50	30		CGEAMM
CC(=O)C1=C([O-])c2ccccc2[C@@H](Cc2ccccc2)C1=O	ZINC000253406630	377689087	/nfs/dbraw/zinc/68/90/87/377689087.db2.gz	UUKSDTDSXOYIET-MRXNPFEDSA-N	-1	1	292.334	3.454	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1Cc1c[nH]c2ccccc12	ZINC000001253399	169692896	/nfs/dbraw/zinc/69/28/96/169692896.db2.gz	YRHWQGUVHXQONU-UHFFFAOYSA-N	-1	1	270.361	3.199	50	30		CGEAMM
[O-]c1cccnc1N=Cc1c(O)ccc2ccccc21	ZINC000253618443	346394869	/nfs/dbraw/zinc/39/48/69/346394869.db2.gz	PSXBXJNLRFGQPO-UHFFFAOYSA-N	-1	1	264.284	3.397	50	30		CGEAMM
Cc1ccccc1NC(=O)N(Cc1ccco1)C([O-])=CC#N	ZINC000000171069	368308254	/nfs/dbraw/zinc/30/82/54/368308254.db2.gz	GLGLEZNFNRTTFD-UHFFFAOYSA-N	-1	1	297.314	3.062	50	30		CGEAMM
Cc1ccc(N=Cc2ccccc2[N+](=O)[O-])c([O-])c1	ZINC000252461641	377624039	/nfs/dbraw/zinc/62/40/39/377624039.db2.gz	NETZPRLPGGTXCV-UHFFFAOYSA-N	-1	1	256.261	3.359	50	30		CGEAMM
[O-]N=C(c1ccc(Br)cc1)c1cccnc1	ZINC000252639565	377645629	/nfs/dbraw/zinc/64/56/29/377645629.db2.gz	YLWYXBQTOOZIRJ-UHFFFAOYSA-N	-1	1	277.121	3.071	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C\c1cc(F)c(F)c(F)c1	ZINC000216619179	285015945	/nfs/dbraw/zinc/01/59/45/285015945.db2.gz	KIAKQPGZWYNNPN-ACAGNQJTSA-N	-1	1	292.212	3.426	50	30		CGEAMM
C=C(C)Cn1c(COc2ccccc2)n[n-]c1=S	ZINC000005685824	170129009	/nfs/dbraw/zinc/12/90/09/170129009.db2.gz	TXNWUQMHKIYXJK-UHFFFAOYSA-N	-1	1	261.350	3.096	50	30		CGEAMM
COc1ccc([O-])c(C(=O)/C=C\c2ccccc2OC)c1	ZINC000035681494	172353527	/nfs/dbraw/zinc/35/35/27/172353527.db2.gz	XYLTVAMWWGAIFM-CLFYSBASSA-N	-1	1	284.311	3.306	50	30		CGEAMM
CCOC(=O)c1cccc2c1-c1ccccc1/C2=N/[O-]	ZINC000013123617	276300221	/nfs/dbraw/zinc/30/02/21/276300221.db2.gz	YPCNWPJSHMBZDB-ICFOKQHNSA-N	-1	1	267.284	3.070	50	30		CGEAMM
O=C1c2ccccc2N[C@@H](c2c(F)cccc2Cl)N1[O-]	ZINC000000374790	280332422	/nfs/dbraw/zinc/33/24/22/280332422.db2.gz	AGKNEUKVRGTQOA-CYBMUJFWSA-N	-1	1	292.697	3.435	50	30		CGEAMM
C[C@]1(C#N)CCCN(Cc2cccc([O-])c2Cl)C1	ZINC000590360045	346844124	/nfs/dbraw/zinc/84/41/24/346844124.db2.gz	OIFQPBGOAXQWEL-CQSZACIVSA-N	-1	1	264.756	3.171	50	30		CGEAMM
C#C[C@@](C)(CC)OC(=O)[N-]C(=O)c1ccccc1Cl	ZINC000002161453	368448053	/nfs/dbraw/zinc/44/80/53/368448053.db2.gz	ALHGPESJTIVKJV-AWEZNQCLSA-N	-1	1	279.723	3.008	50	30		CGEAMM
Cc1cccc(/C=C2\Oc3cc([O-])ccc3C2=O)c1	ZINC000011764554	368596200	/nfs/dbraw/zinc/59/62/00/368596200.db2.gz	JRKOSXIFODBAFH-NVNXTCNLSA-N	-1	1	252.269	3.317	50	30	biogenic	CGEAMM
O=[N+]([O-])c1cccc(/C(=N/[O-])Nc2ccc(Cl)cc2)c1	ZINC000013143224	368645329	/nfs/dbraw/zinc/64/53/29/368645329.db2.gz	NLTBQTWOIHZNBO-UHFFFAOYSA-N	-1	1	291.694	3.496	50	30		CGEAMM
CC(C)(C)OC(=O)n1ccc2ccc(/C=N/[O-])cc21	ZINC000095221258	370177697	/nfs/dbraw/zinc/17/76/97/370177697.db2.gz	ZWLIUPKGGBVTNI-OQLLNIDSSA-N	-1	1	260.293	3.233	50	30		CGEAMM
CC(=Nc1ccccc1[N-]S(C)(=O)=O)c1ccccc1	ZINC000252627245	393126077	/nfs/dbraw/zinc/12/60/77/393126077.db2.gz	RPPJNJTWEXZEBS-UHFFFAOYSA-N	-1	1	288.372	3.199	50	30		CGEAMM
C(=Nc1nnn[n-]1)c1c2ccccc2cc2ccccc21	ZINC000005777175	170139521	/nfs/dbraw/zinc/13/95/21/170139521.db2.gz	BSFKXFGDXMPSFS-LICLKQGHSA-N	-1	1	273.299	3.257	50	30		CGEAMM
C(=Nc1nn[n-]n1)c1c2ccccc2cc2ccccc21	ZINC000005777175	170139523	/nfs/dbraw/zinc/13/95/23/170139523.db2.gz	BSFKXFGDXMPSFS-LICLKQGHSA-N	-1	1	273.299	3.257	50	30		CGEAMM
C=CCn1c([C@H](CC(C)C)C[C@H](C)O)n[n-]c1=S	ZINC000005817359	170142765	/nfs/dbraw/zinc/14/27/65/170142765.db2.gz	LEGLSVUVSHFHNC-WDEREUQCSA-N	-1	1	269.414	3.027	50	30		CGEAMM
C=C(C)CSc1nc(C)c(Cc2ccccc2)c(=O)[n-]1	ZINC000008763100	170354764	/nfs/dbraw/zinc/35/47/64/170354764.db2.gz	AOOKITDNAXCKOX-UHFFFAOYSA-N	-1	1	286.400	3.337	50	30		CGEAMM
COc1cccc(/C=C2\Oc3cc([O-])cc(C)c3C2=O)c1	ZINC000006662507	278007188	/nfs/dbraw/zinc/00/71/88/278007188.db2.gz	WMBYYMTVLZHMSA-NVNXTCNLSA-N	-1	1	282.295	3.325	50	30	biogenic	CGEAMM
CCOc1cccc(-c2c(C#N)c(=O)[n-]c3c2CCCC3)c1	ZINC000041484050	279968028	/nfs/dbraw/zinc/96/80/28/279968028.db2.gz	HVZGYERQNUUNSZ-UHFFFAOYSA-N	-1	1	294.354	3.191	50	30		CGEAMM
CC(=O)Nc1ccc(/C=C\C(=O)c2ccc([O-])cc2)cc1	ZINC000096766220	185111998	/nfs/dbraw/zinc/11/19/98/185111998.db2.gz	JNIDVNRNUMLNNN-WCIBSUBMSA-N	-1	1	281.311	3.247	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1[C@H]1C[C@@H]1c1ccccc1	ZINC000002536728	368461579	/nfs/dbraw/zinc/46/15/79/368461579.db2.gz	CMFMXWPZLFNEKY-NEPJUHHUSA-N	-1	1	257.362	3.398	50	30		CGEAMM
O=C(/C=C/c1ccc2c(c1)OCO2)c1ccc([O-])cc1	ZINC000012338418	368608046	/nfs/dbraw/zinc/60/80/46/368608046.db2.gz	AZEHEBLLFINCCX-LREOWRDNSA-N	-1	1	268.268	3.017	50	30		CGEAMM
CC1(C)CC(=O)C(=C([S-])Nc2ccccc2)C(=O)C1	ZINC000018244340	368743060	/nfs/dbraw/zinc/74/30/60/368743060.db2.gz	HPGBMXCKMLZQNO-UHFFFAOYSA-N	-1	1	275.373	3.198	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1-c1cc(Cl)ccc1OC	ZINC000018115738	368738501	/nfs/dbraw/zinc/73/85/01/368738501.db2.gz	LXQKOJKJTSRPSW-UHFFFAOYSA-N	-1	1	281.768	3.456	50	30		CGEAMM
Cc1ccc(C(=O)C=CNc2cc([N+](=O)[O-])ccc2[O-])cc1	ZINC000033567147	368966496	/nfs/dbraw/zinc/96/64/96/368966496.db2.gz	ZKEFCLXWSUPVOL-HJWRWDBZSA-N	-1	1	298.298	3.417	50	30		CGEAMM
N#Cc1ccc(/C=C\c2ccc([O-])c(Cl)c2)nc1	ZINC000255435883	287867342	/nfs/dbraw/zinc/86/73/42/287867342.db2.gz	SQWZKLICUVTKQR-RJRFIUFISA-N	-1	1	256.692	3.483	50	30		CGEAMM
C=CCc1cccc(C=C2SC(=S)[N-]C2=O)c1O	ZINC000034133330	368972398	/nfs/dbraw/zinc/97/23/98/368972398.db2.gz	CKTLSDZDNUXODW-JXMROGBWSA-N	-1	1	277.370	3.450	50	30		CGEAMM
COc1ccc(/C=C\C(=O)c2ccc([O-])cc2)c(OC)c1	ZINC000033414296	368963938	/nfs/dbraw/zinc/96/39/38/368963938.db2.gz	LNEYYODFMSUKGY-POHAHGRESA-N	-1	1	284.311	3.306	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C\c1c[nH]c2ccccc12	ZINC000002122886	285015900	/nfs/dbraw/zinc/01/59/00/285015900.db2.gz	DJDXGMDUEUZCMA-APSNUPSMSA-N	-1	1	277.279	3.490	50	30	biogenic	CGEAMM
Cc1ccc(/C=C2\Oc3cc([O-])ccc3C2=O)s1	ZINC000022016481	391942792	/nfs/dbraw/zinc/94/27/92/391942792.db2.gz	JWGPARFFLIKAAV-QPEQYQDCSA-N	-1	1	258.298	3.378	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1-c1ccc(Br)o1	ZINC000006492926	170206654	/nfs/dbraw/zinc/20/66/54/170206654.db2.gz	AUSIFCPQANTVLZ-UHFFFAOYSA-N	-1	1	286.154	3.149	50	30		CGEAMM
CN(C)c1ccc(/C=C2/Oc3cc([O-])ccc3C2=O)cc1	ZINC000001448222	282279807	/nfs/dbraw/zinc/27/98/07/282279807.db2.gz	XWVDODMZYGXNEU-CXUHLZMHSA-N	-1	1	281.311	3.074	50	30		CGEAMM
COc1cccc(/C=C2\Oc3cc([O-])ccc3C2=O)c1	ZINC000012862585	368630842	/nfs/dbraw/zinc/63/08/42/368630842.db2.gz	XWRCMPMRAXNWBC-NVNXTCNLSA-N	-1	1	268.268	3.017	50	30	biogenic	CGEAMM
Cc1ccc(NC(=O)C([O-])=CC(=O)c2ccc(F)cc2)cc1	ZINC000101355165	370289264	/nfs/dbraw/zinc/28/92/64/370289264.db2.gz	BSMBKPZAPJOJEH-YBEGLDIGSA-N	-1	1	299.301	3.397	50	30		CGEAMM
C=CCc1cccc([C@@H]2Nc3ccccc3C(=O)N2[O-])c1O	ZINC000000079935	527260703	/nfs/dbraw/zinc/26/07/03/527260703.db2.gz	SBYIHYUUKHOSEH-MRXNPFEDSA-N	-1	1	296.326	3.076	50	30		CGEAMM
CCC12C[C@H]3C[C@@H](C1)CC(C(/C=N/O)=N/[O-])(C3)C2	ZINC000023114757	618677370	/nfs/dbraw/zinc/67/73/70/618677370.db2.gz	PZCIYZZQDKXDNA-SVGFCDNASA-N	-1	1	250.342	3.273	50	30		CGEAMM
CCCOc1ccc(Br)cc1/C=N/[O-]	ZINC000002763665	368476711	/nfs/dbraw/zinc/47/67/11/368476711.db2.gz	BZDKQYSCCPXCDG-KPKJPENVSA-N	-1	1	258.115	3.046	50	30		CGEAMM
COc1ccc(/C=C2\Oc3cc([O-])ccc3C2=O)cc1OC	ZINC000012859513	368630778	/nfs/dbraw/zinc/63/07/78/368630778.db2.gz	YUCCNWHJQXNUQE-PXNMLYILSA-N	-1	1	298.294	3.026	50	30	biogenic	CGEAMM
CCOC(=O)c1c(C)oc(/N=C/c2ccccc2[O-])c1C#N	ZINC000018089307	368739156	/nfs/dbraw/zinc/73/91/56/368739156.db2.gz	ZURFBXTXNWHELK-GIJQJNRQSA-N	-1	1	298.298	3.093	50	30		CGEAMM
Cc1ccccc1NC(=O)C([O-])=CC(=O)c1ccccc1	ZINC000100563514	392267118	/nfs/dbraw/zinc/26/71/18/392267118.db2.gz	MEDHIISACLXRMN-WJDWOHSUSA-N	-1	1	281.311	3.258	50	30		CGEAMM
C=CCCCCCCCCc1n[nH]c(SCC(=O)[O-])n1	ZINC000005830619	170144967	/nfs/dbraw/zinc/14/49/67/170144967.db2.gz	VUNWJGHPLRSQGI-UHFFFAOYSA-N	-1	1	297.424	3.441	50	30		CGEAMM
C=CCCCCCCCCc1nnc(SCC(=O)[O-])[nH]1	ZINC000005830619	170144968	/nfs/dbraw/zinc/14/49/68/170144968.db2.gz	VUNWJGHPLRSQGI-UHFFFAOYSA-N	-1	1	297.424	3.441	50	30		CGEAMM
Cc1cc([O-])cc2c1C(=O)/C(=C/c1cccc(F)c1)O2	ZINC000006719644	280635970	/nfs/dbraw/zinc/63/59/70/280635970.db2.gz	WGNBQSNWRSRMSC-AUWJEWJLSA-N	-1	1	270.259	3.456	50	30		CGEAMM
O=C1c2ccccc2C([O-])=C(NC2CCCCC2)C1=S	ZINC000106578526	619249875	/nfs/dbraw/zinc/24/98/75/619249875.db2.gz	NPJRDHQMUXBOSX-UHFFFAOYSA-N	-1	1	287.384	3.129	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C\c1ccc2[nH]ccc2c1	ZINC000407986239	379987122	/nfs/dbraw/zinc/98/71/22/379987122.db2.gz	IHZNIQMJLCILAJ-PXNMLYILSA-N	-1	1	277.279	3.490	50	30	biogenic	CGEAMM
COc1ccc(/C=C2\Oc3cc([O-])cc(C)c3C2=O)cc1	ZINC000002130508	277868382	/nfs/dbraw/zinc/86/83/82/277868382.db2.gz	NEYOBEMFVXSEFB-NVNXTCNLSA-N	-1	1	282.295	3.325	50	30	biogenic	CGEAMM
Cc1ccsc1[C@H]1Nc2ccccc2C(=O)N1[O-]	ZINC000000374649	292830476	/nfs/dbraw/zinc/83/04/76/292830476.db2.gz	VMHVKYKHUFJZBI-LBPRGKRZSA-N	-1	1	260.318	3.012	50	30		CGEAMM
CCOc1cc(/C=C2\Oc3cc([O-])ccc3C2=O)ccc1O	ZINC000012374245	368609965	/nfs/dbraw/zinc/60/99/65/368609965.db2.gz	RRCYLGNDHXOBFX-PXNMLYILSA-N	-1	1	298.294	3.113	50	30		CGEAMM
Cc1c(=O)[n-]c(SCCCC#N)nc1-c1ccccc1	ZINC000097141238	370230951	/nfs/dbraw/zinc/23/09/51/370230951.db2.gz	NMTFTJBCHDWIHF-UHFFFAOYSA-N	-1	1	285.372	3.141	50	30		CGEAMM
CC(C)(C)c1ccc(C=Nn2cn[n-]c2=S)cc1	ZINC000005685932	170128707	/nfs/dbraw/zinc/12/87/07/170128707.db2.gz	URFQEKLDCFNPBY-OVCLIPMQSA-N	-1	1	260.366	3.120	50	30		CGEAMM
Cc1ccsc1/C=C1\Oc2cc([O-])ccc2C1=O	ZINC000013769394	170591214	/nfs/dbraw/zinc/59/12/14/170591214.db2.gz	SZZAJUGQEAOCBX-GHXNOFRVSA-N	-1	1	258.298	3.378	50	30		CGEAMM
COc1cccc(/C=C\C(=O)c2ccc([O-])cc2)c1	ZINC000034953955	620074604	/nfs/dbraw/zinc/07/46/04/620074604.db2.gz	IMYMKKNFZSJOQW-YHYXMXQVSA-N	-1	1	254.285	3.297	50	30		CGEAMM
CSC(=NC(=O)OC(C)(C)C)[N-]C(=O)OC(C)(C)C	ZINC000002561338	368465219	/nfs/dbraw/zinc/46/52/19/368465219.db2.gz	UQJXXWHAJKRDKY-UHFFFAOYSA-N	-1	1	290.385	3.165	50	30		CGEAMM
C=CCN(Cc1ccco1)Cc1ccccc1C(=O)[O-]	ZINC000065375788	369671291	/nfs/dbraw/zinc/67/12/91/369671291.db2.gz	ZUWSLUWNZURVMC-UHFFFAOYSA-N	-1	1	271.316	3.166	50	30		CGEAMM
COc1cccc(/C=C/C(=O)c2ccc([O-])cc2)c1	ZINC000005128098	170068690	/nfs/dbraw/zinc/06/86/90/170068690.db2.gz	IMYMKKNFZSJOQW-BJMVGYQFSA-N	-1	1	254.285	3.297	50	30		CGEAMM
N#Cc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1	ZINC000007402486	170282704	/nfs/dbraw/zinc/28/27/04/170282704.db2.gz	PJOZGNDNBYTROW-UHFFFAOYSA-N	-1	1	292.747	3.012	50	30		CGEAMM
O=C([O-])c1ccccc1NC1=Nc2ccccc2CC1	ZINC000005687938	391924310	/nfs/dbraw/zinc/92/43/10/391924310.db2.gz	RDGZBHLKTSQBHZ-UHFFFAOYSA-N	-1	1	266.300	3.473	50	30		CGEAMM
CCCCc1ccc(C(C)=NNc2nc(C)cc(=O)[n-]2)cc1	ZINC000016512984	260099848	/nfs/dbraw/zinc/09/98/48/260099848.db2.gz	KHXVSXIMTHTWMM-DEDYPNTBSA-N	-1	1	298.390	3.257	50	30		CGEAMM
Cc1cc(C(C#N)=C([O-])c2cc3c(s2)CCC3)nc(C)n1	ZINC000084114360	570335246	/nfs/dbraw/zinc/33/52/46/570335246.db2.gz	ZPXUNMPIWVXKDM-GFCCVEGCSA-N	-1	1	297.383	3.134	50	30		CGEAMM
C[C@@H]1CCc2c(C#N)c(=O)[n-]c(-c3ccccc3)c2C1	ZINC000170621867	372643254	/nfs/dbraw/zinc/64/32/54/372643254.db2.gz	STMFMZHIVOAQHR-LLVKDONJSA-N	-1	1	264.328	3.038	50	30		CGEAMM
CC(C)(C)C(Cn1cnc(Cl)c1Cl)=N[O-]	ZINC000252427813	377620915	/nfs/dbraw/zinc/62/09/15/377620915.db2.gz	GZGPHHGRJAAMLM-UHFFFAOYSA-N	-1	1	250.129	3.066	50	30		CGEAMM
CC1=Nc2ccccc2C1N=Nc1ccccc1C(=O)[O-]	ZINC000100864100	392268822	/nfs/dbraw/zinc/26/88/22/392268822.db2.gz	IHHIEJRCFVYQSI-XDJHFCHBSA-N	-1	1	279.299	3.307	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1-c1ccc(OC(F)F)cc1	ZINC000005899392	170151929	/nfs/dbraw/zinc/15/19/29/170151929.db2.gz	DHBITUOIEWVGQW-UHFFFAOYSA-N	-1	1	283.303	3.395	50	30		CGEAMM
COC(=O)c1ccc(/C=C/C(=O)c2ccc([O-])cc2)cc1	ZINC000006637991	170220919	/nfs/dbraw/zinc/22/09/19/170220919.db2.gz	ICURPCVKTUIWLY-NYYWCZLTSA-N	-1	1	282.295	3.075	50	30		CGEAMM
COc1cc(/C=C2\Oc3cc([O-])ccc3C2=O)cc(OC)c1	ZINC000022016510	171349598	/nfs/dbraw/zinc/34/95/98/171349598.db2.gz	GSVOFGLOXPEEQI-APSNUPSMSA-N	-1	1	298.294	3.026	50	30		CGEAMM
COc1ccc(C2=C([O-])c3ccccc3C(=O)C2=O)cc1	ZINC000000298517	295114832	/nfs/dbraw/zinc/11/48/32/295114832.db2.gz	LLMWUKJCIBAIJZ-UHFFFAOYSA-N	-1	1	280.279	3.044	50	30		CGEAMM
COc1ccc(C(C)N=Nc2ccc(C(=O)[O-])cc2)cc1	ZINC000254466834	640912168	/nfs/dbraw/zinc/91/21/68/640912168.db2.gz	HRJPCQSVRMZJCM-UHFFFAOYSA-N	-1	1	284.315	3.230	50	30		CGEAMM
Cc1cc(C(=O)[N-]c2ccccc2SCCC#N)on1	ZINC000095953443	185040598	/nfs/dbraw/zinc/04/05/98/185040598.db2.gz	NIIXGOBGUFIUQM-UHFFFAOYSA-N	-1	1	287.344	3.241	50	30		CGEAMM
CCCCCCCCNC(C)=C1SC(=S)[N-]C1=O	ZINC000137102369	346092753	/nfs/dbraw/zinc/09/27/53/346092753.db2.gz	IEKATLVOOMCMTR-KHPPLWFESA-N	-1	1	286.466	3.316	50	30		CGEAMM
N#Cc1ccc(/C=C2\CCc3cc([O-])ccc3C2=O)cc1	ZINC000060340083	283121307	/nfs/dbraw/zinc/12/13/07/283121307.db2.gz	YTNQKHYUCVQRFP-OQLLNIDSSA-N	-1	1	275.307	3.476	50	30		CGEAMM
C=CCn1c([C@@H](CCC(C)C)C[C@@H](C)O)n[n-]c1=S	ZINC000002299828	368451864	/nfs/dbraw/zinc/45/18/64/368451864.db2.gz	WIXCHPJNAUNGIL-NEPJUHHUSA-N	-1	1	283.441	3.417	50	30		CGEAMM
COc1cc(/C=C/C(=O)c2cc(C)ccc2[O-])ccc1O	ZINC000004252577	368539195	/nfs/dbraw/zinc/53/91/95/368539195.db2.gz	WNMAPNHXZFEFDI-QPJJXVBHSA-N	-1	1	284.311	3.311	50	30		CGEAMM
O=C(C=C([O-])C(=O)Nc1cccc(F)c1)c1ccccc1	ZINC000101355143	370288713	/nfs/dbraw/zinc/28/87/13/370288713.db2.gz	DTKKSGGZLSBXRX-GDNBJRDFSA-N	-1	1	285.274	3.089	50	30		CGEAMM
C#Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000003997418	391919422	/nfs/dbraw/zinc/91/94/22/391919422.db2.gz	AGAMYPZKNASINN-UHFFFAOYSA-N	-1	1	291.759	3.122	50	30		CGEAMM
C1CCCCCC(N=Nc2nn[n-]n2)CCCCC1	ZINC000013583598	391931826	/nfs/dbraw/zinc/93/18/26/391931826.db2.gz	MMEMZZTXJSJWHS-UHFFFAOYSA-N	-1	1	264.377	3.272	50	30		CGEAMM
CSc1ccc([C@@H]2Nc3ccccc3C(=O)N2[O-])cc1	ZINC000000374899	368351384	/nfs/dbraw/zinc/35/13/84/368351384.db2.gz	KFAILPSDBLGUTK-CQSZACIVSA-N	-1	1	286.356	3.364	50	30		CGEAMM
CN(C)c1ccc(/C=C2\Oc3cc([O-])ccc3C2=O)cc1	ZINC000012543530	368618167	/nfs/dbraw/zinc/61/81/67/368618167.db2.gz	XWVDODMZYGXNEU-SXGWCWSVSA-N	-1	1	281.311	3.074	50	30	biogenic	CGEAMM
COc1cccc(/C=C2\Oc3cc([O-])ccc3C2=O)c1OC	ZINC000012662315	368622571	/nfs/dbraw/zinc/62/25/71/368622571.db2.gz	GQSYGPPHMQKVOE-NVNXTCNLSA-N	-1	1	298.294	3.026	50	30	biogenic	CGEAMM
O=C([O-])c1ccccc1C=NNc1nc2ccccc2s1	ZINC000252624475	377643075	/nfs/dbraw/zinc/64/30/75/377643075.db2.gz	POLSORPKQCANGR-UHFFFAOYSA-N	-1	1	297.339	3.441	50	30		CGEAMM
CCCCCCCOc1ccc([O-])c(C#N)c1C#N	ZINC000002022887	391913590	/nfs/dbraw/zinc/91/35/90/391913590.db2.gz	GGRHBZPQLRFEOU-UHFFFAOYSA-N	-1	1	258.321	3.485	50	30		CGEAMM
[O-]c1cccnc1/N=C/c1c(O)ccc2ccccc21	ZINC000095976419	185050910	/nfs/dbraw/zinc/05/09/10/185050910.db2.gz	PSXBXJNLRFGQPO-VCHYOVAHSA-N	-1	1	264.284	3.397	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C/c1c[nH]c2ccccc12	ZINC000002122885	368447504	/nfs/dbraw/zinc/44/75/04/368447504.db2.gz	DJDXGMDUEUZCMA-FRKPEAEDSA-N	-1	1	277.279	3.490	50	30		CGEAMM
C=CCn1c(COc2cc(C)ccc2C)n[n-]c1=S	ZINC000002522266	368460010	/nfs/dbraw/zinc/46/00/10/368460010.db2.gz	OWWUMHLFMGHBCB-UHFFFAOYSA-N	-1	1	275.377	3.323	50	30		CGEAMM
CCCCCCCCSc1nc([O-])cc(=O)n1CC	ZINC000102505811	397646530	/nfs/dbraw/zinc/64/65/30/397646530.db2.gz	QDCJFYIRGOAPQE-UHFFFAOYSA-N	-1	1	284.425	3.421	50	30		CGEAMM
O=C([O-])C(=NNc1cccc2cccnc21)c1ccccc1	ZINC000006659260	619276250	/nfs/dbraw/zinc/27/62/50/619276250.db2.gz	UPTTUNAKDGMUAT-SILNSSARSA-N	-1	1	291.310	3.136	50	30		CGEAMM
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)c1ccc([O-])cc1	ZINC000033472142	624333399	/nfs/dbraw/zinc/33/33/99/624333399.db2.gz	DATNNMBFPMYEKO-KMKOMSMNSA-N	-1	1	269.256	3.197	50	30		CGEAMM
Cc1n[n-]c(=S)c(C#N)c1C=Cc1ccccc1	ZINC000004648843	344860335	/nfs/dbraw/zinc/86/03/35/344860335.db2.gz	GUKNVPRFGJIRNA-BQYQJAHWSA-N	-1	1	253.330	3.490	50	30		CGEAMM
O=C1C(=O)C(c2ccc(F)cc2)=C([O-])c2ccccc21	ZINC000000290978	368334757	/nfs/dbraw/zinc/33/47/57/368334757.db2.gz	AGPOUOXBOMMBII-UHFFFAOYSA-N	-1	1	268.243	3.174	50	30		CGEAMM
C=CCn1c(COc2ccc(F)c(Cl)c2)n[n-]c1=S	ZINC000002536736	368462330	/nfs/dbraw/zinc/46/23/30/368462330.db2.gz	NGRXDJPGWPGISQ-UHFFFAOYSA-N	-1	1	299.758	3.498	50	30		CGEAMM
COc1ccc(/C=C/C(=O)c2cccc(OC)c2[O-])cc1	ZINC000095100013	370176284	/nfs/dbraw/zinc/17/62/84/370176284.db2.gz	BVKPRMYQBQPMLS-DHZHZOJOSA-N	-1	1	284.311	3.306	50	30		CGEAMM
Cc1cc([O-])cc2c1C(=O)/C(=C/c1cccs1)O2	ZINC000006669911	397603336	/nfs/dbraw/zinc/60/33/36/397603336.db2.gz	NUNSVCCALSYRDO-GHXNOFRVSA-N	-1	1	258.298	3.378	50	30		CGEAMM
[O-]/N=C/c1ccc(OCc2cnc(Cl)s2)cc1	ZINC000005750220	170137079	/nfs/dbraw/zinc/13/70/79/170137079.db2.gz	IBEJWNDJLWORGZ-LHHJGKSTSA-N	-1	1	268.725	3.184	50	30		CGEAMM
N#Cc1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2)c1	ZINC000007402254	170282709	/nfs/dbraw/zinc/28/27/09/170282709.db2.gz	KCLPWNGWXQLXFD-UHFFFAOYSA-N	-1	1	292.747	3.012	50	30		CGEAMM
Cc1cc([O-])cc2c1C(=O)/C(=C/c1ccc(F)cc1)O2	ZINC000006669733	280635975	/nfs/dbraw/zinc/63/59/75/280635975.db2.gz	NKBDFAYAGPENTL-AUWJEWJLSA-N	-1	1	270.259	3.456	50	30		CGEAMM
O=C([O-])c1ccccc1C=NN=c1ccc2ccccc2[nH]1	ZINC000058144743	369555505	/nfs/dbraw/zinc/55/55/05/369555505.db2.gz	MCAJXYDDRYYUDN-WOJGMQOQSA-N	-1	1	291.310	3.379	50	30		CGEAMM
C=CCn1c([C@@H](CC(C)C)C[C@H](C)O)n[n-]c1=S	ZINC000005817343	170142806	/nfs/dbraw/zinc/14/28/06/170142806.db2.gz	LEGLSVUVSHFHNC-QWRGUYRKSA-N	-1	1	269.414	3.027	50	30		CGEAMM
N#Cc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2)cc1	ZINC000007402255	170282685	/nfs/dbraw/zinc/28/26/85/170282685.db2.gz	GBWXOSLYEWYDCT-UHFFFAOYSA-N	-1	1	292.747	3.012	50	30		CGEAMM
COc1ccc(/C=C2\Oc3cc([O-])ccc3C2=O)c(OC)c1	ZINC000012419920	170487224	/nfs/dbraw/zinc/48/72/24/170487224.db2.gz	SUKDSSOVVTVBDK-APSNUPSMSA-N	-1	1	298.294	3.026	50	30	biogenic	CGEAMM
COc1ccc(/C=C2/Oc3cc([O-])ccc3C2=O)c(OC)c1	ZINC000000491271	368378997	/nfs/dbraw/zinc/37/89/97/368378997.db2.gz	SUKDSSOVVTVBDK-FRKPEAEDSA-N	-1	1	298.294	3.026	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C/c1ccc(F)cc1	ZINC000000539424	368385645	/nfs/dbraw/zinc/38/56/45/368385645.db2.gz	LRUJRAQGJJEHMX-VGOFMYFVSA-N	-1	1	256.232	3.148	50	30		CGEAMM
COc1ccc(C(=O)/C=C/c2ccccc2)c([O-])c1OC	ZINC000004252587	368539906	/nfs/dbraw/zinc/53/99/06/368539906.db2.gz	DQPDCCTVAXUNSG-CSKARUKUSA-N	-1	1	284.311	3.306	50	30		CGEAMM
COc1ccccc1/C=C1\Oc2cc([O-])cc(C)c2C1=O	ZINC000006755479	368568975	/nfs/dbraw/zinc/56/89/75/368568975.db2.gz	NKUASJVKMGJTGL-NVNXTCNLSA-N	-1	1	282.295	3.325	50	30	biogenic	CGEAMM
O=C1C(=O)C(c2ccccc2F)=C([O-])c2ccccc21	ZINC000005687455	368564804	/nfs/dbraw/zinc/56/48/04/368564804.db2.gz	XBAWNIHNOMTKBG-UHFFFAOYSA-N	-1	1	268.243	3.174	50	30		CGEAMM
COc1ccc(/C=C2\Oc3cc([O-])ccc3C2=O)cc1	ZINC000012420267	368613591	/nfs/dbraw/zinc/61/35/91/368613591.db2.gz	CVEOFOQULTXCSE-NVNXTCNLSA-N	-1	1	268.268	3.017	50	30	biogenic,in-vitro	CGEAMM
CCOc1ccc(/C=C2\Oc3cc([O-])ccc3C2=O)cc1	ZINC000012636976	368622459	/nfs/dbraw/zinc/62/24/59/368622459.db2.gz	AGXCGBRUCXUNAZ-SXGWCWSVSA-N	-1	1	282.295	3.407	50	30	biogenic	CGEAMM
S=c1[n-]ncn1N=Cc1c(Cl)cccc1Cl	ZINC000252477742	377625607	/nfs/dbraw/zinc/62/56/07/377625607.db2.gz	VACXXBHLAVIARN-UHFFFAOYSA-N	-1	1	273.148	3.130	50	30		CGEAMM
CCOc1ccc(/C=C2/Oc3cc([O-])ccc3C2=O)cc1	ZINC000000490727	279950678	/nfs/dbraw/zinc/95/06/78/279950678.db2.gz	AGXCGBRUCXUNAZ-CXUHLZMHSA-N	-1	1	282.295	3.407	50	30		CGEAMM
O=C1c2ccc([O-])c(O)c2C/C1=C\c1ccc(F)cc1	ZINC000089780946	620253567	/nfs/dbraw/zinc/25/35/67/620253567.db2.gz	HNDZONHRFCFVDU-JXMROGBWSA-N	-1	1	270.259	3.059	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1[C@H](C)Oc1ccccc1	ZINC000002526663	368460521	/nfs/dbraw/zinc/46/05/21/368460521.db2.gz	OHROLIMVKIAXAR-JTQLQIEISA-N	-1	1	261.350	3.267	50	30		CGEAMM
COc1ccc(/C=C/C(=O)c2cc(O)ccc2[O-])cc1	ZINC000004252724	368539266	/nfs/dbraw/zinc/53/92/66/368539266.db2.gz	FUQGIYDZGLORRC-XBXARRHUSA-N	-1	1	270.284	3.003	50	30	in-vitro	CGEAMM
C[C@H]1CCc2c(C#N)c(=O)[n-]c(-c3ccccc3)c2C1	ZINC000170621868	372644082	/nfs/dbraw/zinc/64/40/82/372644082.db2.gz	STMFMZHIVOAQHR-NSHDSACASA-N	-1	1	264.328	3.038	50	30		CGEAMM
CC(N=Nc1ccc(C(=O)[O-])cc1)c1ccc(C#N)cc1	ZINC000254486495	640911985	/nfs/dbraw/zinc/91/19/85/640911985.db2.gz	DHYUUYWRXCDRCV-UHFFFAOYSA-N	-1	1	279.299	3.093	50	30		CGEAMM
C#C[C@@](C)(CC)OC(=O)[N-]C(=O)c1c(F)cccc1Cl	ZINC000002161446	368447767	/nfs/dbraw/zinc/44/77/67/368447767.db2.gz	XPGREMAKFZMOLC-AWEZNQCLSA-N	-1	1	297.713	3.147	50	30		CGEAMM
Cc1ccc(C(=O)C=CNc2cc([N+](=O)[O-])ccc2[O-])cc1	ZINC000102645557	397647112	/nfs/dbraw/zinc/64/71/12/397647112.db2.gz	ZKEFCLXWSUPVOL-CMDGGOBGSA-N	-1	1	298.298	3.417	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1-c1csc(C)c1C	ZINC000006556492	170212829	/nfs/dbraw/zinc/21/28/29/170212829.db2.gz	ZCJCQQGBQCJTQN-UHFFFAOYSA-N	-1	1	251.380	3.472	50	30		CGEAMM
COc1ccc([O-])c(C(=O)/C=C/c2ccccc2OC)c1	ZINC000004252729	368539416	/nfs/dbraw/zinc/53/94/16/368539416.db2.gz	XYLTVAMWWGAIFM-VQHVLOKHSA-N	-1	1	284.311	3.306	50	30		CGEAMM
CCCCc1[n-]c(=O)c(C#N)c2c1CSC(C)(C)C2	ZINC000008681735	368573845	/nfs/dbraw/zinc/57/38/45/368573845.db2.gz	BVNPGFWERSPEDX-UHFFFAOYSA-N	-1	1	276.405	3.157	50	30		CGEAMM
C=C(C)Cc1c(C)nc(SCCC(C)C)[n-]c1=O	ZINC000018085395	368738157	/nfs/dbraw/zinc/73/81/57/368738157.db2.gz	SSIHGXJMLNYWOK-UHFFFAOYSA-N	-1	1	266.410	3.335	50	30		CGEAMM
O=[N+]([O-])c1cccc(/C(=N\O)c2cc(Cl)ccc2[O-])c1	ZINC000170626175	372645190	/nfs/dbraw/zinc/64/51/90/372645190.db2.gz	YEJOPSNQORLBNN-FYWRMAATSA-N	-1	1	292.678	3.180	50	30		CGEAMM
Cc1ccc(C=CC([O-])=C(C#N)C(=O)c2cccs2)o1	ZINC000103503181	397649106	/nfs/dbraw/zinc/64/91/06/397649106.db2.gz	FAFDTASHERKPPG-SYTKJHMZSA-N	-1	1	285.324	3.255	50	30		CGEAMM
Cc1cccc(NC(=O)COc2cccc(/C=N\[O-])c2)c1C	ZINC000004705221	170002449	/nfs/dbraw/zinc/00/24/49/170002449.db2.gz	NHLZEWWNPUCYQK-ZDLGFXPLSA-N	-1	1	298.342	3.129	50	30		CGEAMM
Cc1ccc(C(=O)C=C([O-])C(=O)Nc2ccccc2)cc1	ZINC000100223196	370273858	/nfs/dbraw/zinc/27/38/58/370273858.db2.gz	ORNOYARPQPNKBV-WJDWOHSUSA-N	-1	1	281.311	3.258	50	30		CGEAMM
COc1ccc(/C=C2/Oc3cc([O-])ccc3C2=O)cc1	ZINC000000145973	169553465	/nfs/dbraw/zinc/55/34/65/169553465.db2.gz	CVEOFOQULTXCSE-OVCLIPMQSA-N	-1	1	268.268	3.017	50	30		CGEAMM
Cc1n[n-]c(=S)c(C#N)c1C=Cc1ccccc1	ZINC000105054701	397650934	/nfs/dbraw/zinc/65/09/34/397650934.db2.gz	GUKNVPRFGJIRNA-FPLPWBNLSA-N	-1	1	253.330	3.490	50	30		CGEAMM
O=C(/C=C/c1cccc([N+](=O)[O-])c1)c1ccc([O-])cc1	ZINC000005128079	170068917	/nfs/dbraw/zinc/06/89/17/170068917.db2.gz	WYQHZANXMKJOBP-RUDMXATFSA-N	-1	1	269.256	3.197	50	30		CGEAMM
Cc1ccc([O-])c(C(=O)/C=C/c2ccc3c(c2)OCCO3)c1	ZINC000005175293	170073606	/nfs/dbraw/zinc/07/36/06/170073606.db2.gz	JTRSQAFGGRNZFJ-ZZXKWVIFSA-N	-1	1	296.322	3.368	50	30	biogenic	CGEAMM
CC1(C)Cc2c(sc3[n-]c(N=[N+]=[N-])nc(=O)c23)CS1	ZINC000017250009	278394965	/nfs/dbraw/zinc/39/49/65/278394965.db2.gz	PCIPQOCJJMIAJN-UHFFFAOYSA-N	-1	1	293.377	3.494	50	30		CGEAMM
CCCc1cc(=O)[n-]c(NN=CC(C)=Cc2ccccc2)n1	ZINC000005884019	521349002	/nfs/dbraw/zinc/34/90/02/521349002.db2.gz	UYROEAQKZVXPBB-XDSYSLTGSA-N	-1	1	296.374	3.224	50	30		CGEAMM
COc1cccc(C(C)N=Nc2ccc(C(=O)[O-])cc2)c1	ZINC000254410725	619397171	/nfs/dbraw/zinc/39/71/71/619397171.db2.gz	GMPFYTXSMLAFDL-UHFFFAOYSA-N	-1	1	284.315	3.230	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1-c1ccc(OCC)cc1	ZINC000000535902	368385222	/nfs/dbraw/zinc/38/52/22/368385222.db2.gz	NOHJFBRWEMJMOT-UHFFFAOYSA-N	-1	1	261.350	3.192	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C\c1ccccc1F	ZINC000000543820	368385395	/nfs/dbraw/zinc/38/53/95/368385395.db2.gz	PODGEZBGTVIQRN-AUWJEWJLSA-N	-1	1	256.232	3.148	50	30	biogenic	CGEAMM
COc1ccc(C2=C([O-])[C@H](c3ccc(OC)cc3)C2=O)cc1	ZINC000096190118	370206769	/nfs/dbraw/zinc/20/67/69/370206769.db2.gz	IYHNRHFFUKXAGJ-HNNXBMFYSA-N	-1	1	296.322	3.339	50	30		CGEAMM
COc1ccc(C2=C([O-])[C@@H](c3ccc(OC)cc3)C2=O)cc1	ZINC000096190118	370206778	/nfs/dbraw/zinc/20/67/78/370206778.db2.gz	IYHNRHFFUKXAGJ-HNNXBMFYSA-N	-1	1	296.322	3.339	50	30		CGEAMM
Cc1ccccc1NC=CC(=O)C1=C([O-])CC(C)(C)CC1=O	ZINC000100668770	370281782	/nfs/dbraw/zinc/28/17/82/370281782.db2.gz	GBTYJZQHRQVOIW-CMDGGOBGSA-N	-1	1	299.370	3.064	50	30		CGEAMM
CC1=Nc2ccccc2C1N=Nc1ccccc1C(=O)[O-]	ZINC000252444352	377621664	/nfs/dbraw/zinc/62/16/64/377621664.db2.gz	IHHIEJRCFVYQSI-UHFFFAOYSA-N	-1	1	279.299	3.307	50	30		CGEAMM
O=C(/C=C/c1ccc2c(c1)OCCO2)c1ccc([O-])cc1	ZINC000004834760	170026453	/nfs/dbraw/zinc/02/64/53/170026453.db2.gz	FEEYXEFILMOOBD-LREOWRDNSA-N	-1	1	282.295	3.060	50	30		CGEAMM
N#Cc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2)c1	ZINC000007057220	170265009	/nfs/dbraw/zinc/26/50/09/170265009.db2.gz	XFMJDENMVOQYPC-UHFFFAOYSA-N	-1	1	292.747	3.012	50	30		CGEAMM
C#Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000014849681	368685906	/nfs/dbraw/zinc/68/59/06/368685906.db2.gz	NISKPCSTYMKNSA-UHFFFAOYSA-N	-1	1	291.759	3.122	50	30		CGEAMM
C=CCc1c(CCC)nc(S[C@H](C)C=C)[n-]c1=O	ZINC000017949260	368736264	/nfs/dbraw/zinc/73/62/64/368736264.db2.gz	CKWHMVJSCONLKK-SNVBAGLBSA-N	-1	1	264.394	3.118	50	30		CGEAMM
CCCCCCCCc1nc(S[C@@H](C)C(=O)[O-])n[nH]1	ZINC000017357255	368732199	/nfs/dbraw/zinc/73/21/99/368732199.db2.gz	OTTGZMFFWIHQPC-JTQLQIEISA-N	-1	1	285.413	3.273	50	30		CGEAMM
CCCCCCCCc1nnc(S[C@@H](C)C(=O)[O-])[nH]1	ZINC000017357255	368732204	/nfs/dbraw/zinc/73/22/04/368732204.db2.gz	OTTGZMFFWIHQPC-JTQLQIEISA-N	-1	1	285.413	3.273	50	30		CGEAMM
O=C(CC(c1ccccc1)c1ccccc1)Nc1nnn[n-]1	ZINC000033384767	368964137	/nfs/dbraw/zinc/96/41/37/368964137.db2.gz	YCVQVTALQCFVCU-UHFFFAOYSA-N	-1	1	293.330	3.010	50	30		CGEAMM
O=C(CC(c1ccccc1)c1ccccc1)Nc1nn[n-]n1	ZINC000033384767	368964142	/nfs/dbraw/zinc/96/41/42/368964142.db2.gz	YCVQVTALQCFVCU-UHFFFAOYSA-N	-1	1	293.330	3.010	50	30		CGEAMM
O=C(Nc1n[n-]c(C(F)(F)F)n1)c1cc2ccccc2o1	ZINC000036714153	369025811	/nfs/dbraw/zinc/02/58/11/369025811.db2.gz	LRKKQUXRFCRODX-UHFFFAOYSA-N	-1	1	296.208	3.206	50	30		CGEAMM
N#Cc1cc([O-])cc(C(=O)N2CCC[C@@H]2C2CCCC2)c1	ZINC000225413866	376308492	/nfs/dbraw/zinc/30/84/92/376308492.db2.gz	DWWXKPUQRXTRPS-MRXNPFEDSA-N	-1	1	284.359	3.059	50	30		CGEAMM
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)c1ccc([O-])cc1	ZINC000007718004	170299046	/nfs/dbraw/zinc/29/90/46/170299046.db2.gz	DATNNMBFPMYEKO-XCVCLJGOSA-N	-1	1	269.256	3.197	50	30		CGEAMM
N#Cc1cnccc1/C=C\c1ccc([O-])c(Cl)c1	ZINC000527054073	270124772	/nfs/dbraw/zinc/12/47/72/270124772.db2.gz	WCGCXKNVGWFDGD-IWQZZHSRSA-N	-1	1	256.692	3.483	50	30		CGEAMM
O=C([O-])c1ccc(N=NCc2c[nH]c3ccccc23)cc1	ZINC000003909720	368524872	/nfs/dbraw/zinc/52/48/72/368524872.db2.gz	DAXYZVVAVPRWNS-VCHYOVAHSA-N	-1	1	279.299	3.312	50	30		CGEAMM
C=CCn1c([C@H](CCC(C)C)C[C@H](C)O)n[n-]c1=S	ZINC000004507327	368548626	/nfs/dbraw/zinc/54/86/26/368548626.db2.gz	WIXCHPJNAUNGIL-NWDGAFQWSA-N	-1	1	283.441	3.417	50	30		CGEAMM
O=[N+]([O-])c1cccc(/C(=N/[O-])Nc2ccccc2Cl)c1	ZINC000013144198	368645116	/nfs/dbraw/zinc/64/51/16/368645116.db2.gz	WLCFCFUIWCXGKJ-UHFFFAOYSA-N	-1	1	291.694	3.496	50	30		CGEAMM
C=C[C@@H](C)c1c(CCC)nc(-c2ccccn2)[n-]c1=O	ZINC000013468405	368653041	/nfs/dbraw/zinc/65/30/41/368653041.db2.gz	HBVRLPIDRMMZGW-LLVKDONJSA-N	-1	1	269.348	3.074	50	30		CGEAMM
Cc1[n-]n(-c2ccccc2)c(=O)c1C=Nc1ccccc1O	ZINC000100193799	370273985	/nfs/dbraw/zinc/27/39/85/370273985.db2.gz	SHLBEFQZTCGKJE-XWAFYUISSA-N	-1	1	293.326	3.133	50	30		CGEAMM
Cc1nc2ccc(N=Cc3cc([N+](=O)[O-])ccc3[O-])cc2[nH]1	ZINC000252629192	377644642	/nfs/dbraw/zinc/64/46/42/377644642.db2.gz	UAUBZSPEJRGUIV-UHFFFAOYSA-N	-1	1	296.286	3.236	50	30		CGEAMM
N#Cc1cccc(/C=C2/CCc3cc([O-])ccc3C2=O)c1	ZINC000096402688	392249496	/nfs/dbraw/zinc/24/94/96/392249496.db2.gz	RUVVMEKERJDHRL-DHDCSXOGSA-N	-1	1	275.307	3.476	50	30		CGEAMM
COc1cccc(/C=C/C(=O)c2ccc([O-])cc2)c1OC	ZINC000006338448	170193671	/nfs/dbraw/zinc/19/36/71/170193671.db2.gz	RFNQYABMSQEIHT-DHZHZOJOSA-N	-1	1	284.311	3.306	50	30		CGEAMM
O=C1c2ccccc2N[C@H](c2c(F)cccc2Cl)N1[O-]	ZINC000000374786	304722525	/nfs/dbraw/zinc/72/25/25/304722525.db2.gz	AGKNEUKVRGTQOA-ZDUSSCGKSA-N	-1	1	292.697	3.435	50	30		CGEAMM
O=C([O-])C(=NNc1ccccc1Cl)c1ccccc1	ZINC000109978358	620346922	/nfs/dbraw/zinc/34/69/22/620346922.db2.gz	PYFLMYJIORKFMV-GHRIWEEISA-N	-1	1	274.707	3.241	50	30		CGEAMM
Cc1ccc(NC=CC(=O)C2=C([O-])CC(C)(C)CC2=O)cc1	ZINC000100142925	185706693	/nfs/dbraw/zinc/70/66/93/185706693.db2.gz	WLZFCGHZFXJZHX-HJWRWDBZSA-N	-1	1	299.370	3.064	50	30	aggregator	CGEAMM
Cc1ccc(/N=C/c2ccccc2[N+](=O)[O-])c([O-])c1	ZINC000000065450	368282063	/nfs/dbraw/zinc/28/20/63/368282063.db2.gz	NETZPRLPGGTXCV-OQLLNIDSSA-N	-1	1	256.261	3.359	50	30		CGEAMM
COc1ccc(/C=C/C(=O)c2ccc([O-])cc2)c(OC)c1	ZINC000004311891	368542524	/nfs/dbraw/zinc/54/25/24/368542524.db2.gz	LNEYYODFMSUKGY-UXBLZVDNSA-N	-1	1	284.311	3.306	50	30	biogenic	CGEAMM
N#Cc1cc([O-])cc(C(=O)N2CCC[C@H]2C2CCCC2)c1	ZINC000225413907	376308521	/nfs/dbraw/zinc/30/85/21/376308521.db2.gz	DWWXKPUQRXTRPS-INIZCTEOSA-N	-1	1	284.359	3.059	50	30		CGEAMM
O=C([O-])c1ccccc1C=NNc1nc2ccccc2s1	ZINC000004419356	304267138	/nfs/dbraw/zinc/26/71/38/304267138.db2.gz	POLSORPKQCANGR-CXUHLZMHSA-N	-1	1	297.339	3.441	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1-c1csc(CC)c1	ZINC000006519548	170208812	/nfs/dbraw/zinc/20/88/12/170208812.db2.gz	YQUDNPYVWJPBCM-UHFFFAOYSA-N	-1	1	251.380	3.418	50	30		CGEAMM
CCn1cc(C(=O)/C=C/c2ccc([O-])c(Cl)c2)cn1	ZINC000049372117	416471506	/nfs/dbraw/zinc/47/15/06/416471506.db2.gz	XTOGOYBHBXFUTN-HWKANZROSA-N	-1	1	276.723	3.158	50	30		CGEAMM
N#CC([N-]c1ccccc1)(C(F)(F)F)C(F)(F)F	ZINC000003075295	618738699	/nfs/dbraw/zinc/73/86/99/618738699.db2.gz	ZQTJHIIXOPUIKQ-UHFFFAOYSA-N	-1	1	268.160	3.485	50	30		CGEAMM
N#Cc1c(=O)[n-]c(=S)[nH]c1-c1ccc(Cl)c(Cl)c1	ZINC000019651582	283072235	/nfs/dbraw/zinc/07/22/35/283072235.db2.gz	QUWUGGYTDQWUTM-UHFFFAOYSA-N	-1	1	298.154	3.278	50	30		CGEAMM
N#Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000000150507	368304243	/nfs/dbraw/zinc/30/42/43/368304243.db2.gz	QESKZYFZAUOUNA-UHFFFAOYSA-N	-1	1	292.747	3.012	50	30		CGEAMM
O=[N+]([O-])c1cc(/N=C/c2cccc([O-])c2O)ccc1Cl	ZINC000000566857	368387479	/nfs/dbraw/zinc/38/74/79/368387479.db2.gz	NWWNPQXZXBTLIY-VIZOYTHASA-N	-1	1	292.678	3.410	50	30		CGEAMM
COc1ccc(C2=C([O-])[C@@H](c3ccc(OC)cc3)C2=O)cc1	ZINC000004051743	368528671	/nfs/dbraw/zinc/52/86/71/368528671.db2.gz	IYHNRHFFUKXAGJ-OAHLLOKOSA-N	-1	1	296.322	3.339	50	30		CGEAMM
COc1ccc(C2=C([O-])[C@H](c3ccc(OC)cc3)C2=O)cc1	ZINC000004051743	368528674	/nfs/dbraw/zinc/52/86/74/368528674.db2.gz	IYHNRHFFUKXAGJ-OAHLLOKOSA-N	-1	1	296.322	3.339	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C\c1cccc(F)c1	ZINC000000534633	285015871	/nfs/dbraw/zinc/01/58/71/285015871.db2.gz	CISJJIPWRRRGMU-AUWJEWJLSA-N	-1	1	256.232	3.148	50	30	biogenic	CGEAMM
C=CCn1c(CCCc2ccc(OC)cc2)n[n-]c1=S	ZINC000004739047	170008152	/nfs/dbraw/zinc/00/81/52/170008152.db2.gz	XMZWNVWILBAZKD-UHFFFAOYSA-N	-1	1	289.404	3.311	50	30		CGEAMM
C=C(C)Cn1c(-c2ccccc2OC)n[n-]c1=S	ZINC000005685831	170128888	/nfs/dbraw/zinc/12/88/88/170128888.db2.gz	HAHSPNKVPCFHDF-UHFFFAOYSA-N	-1	1	261.350	3.192	50	30		CGEAMM
COc1ccc([O-])c(C(=O)/C=C\c2ccc(F)cc2)c1	ZINC000035681495	172353316	/nfs/dbraw/zinc/35/33/16/172353316.db2.gz	QVIJGFSGILDJKE-YWEYNIOJSA-N	-1	1	272.275	3.436	50	30		CGEAMM
O=C1C(=O)C(c2cccc(F)c2)=C([O-])c2ccccc21	ZINC000000344632	368344827	/nfs/dbraw/zinc/34/48/27/368344827.db2.gz	HUHLIAHKSFAYJO-UHFFFAOYSA-N	-1	1	268.243	3.174	50	30		CGEAMM
CSc1ccc([C@H]2Nc3ccccc3C(=O)N2[O-])cc1	ZINC000000374897	368351959	/nfs/dbraw/zinc/35/19/59/368351959.db2.gz	KFAILPSDBLGUTK-AWEZNQCLSA-N	-1	1	286.356	3.364	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C\C1=Cc2ccccc2OC1	ZINC000002131263	285015969	/nfs/dbraw/zinc/01/59/69/285015969.db2.gz	QLINXRAKJDXUOL-IUXPMGMMSA-N	-1	1	292.290	3.327	50	30	biogenic	CGEAMM
CC(C)Oc1ccc(Br)cc1/C=N/[O-]	ZINC000005727357	170133828	/nfs/dbraw/zinc/13/38/28/170133828.db2.gz	GULIYOQSYUIHLE-WUXMJOGZSA-N	-1	1	258.115	3.044	50	30		CGEAMM
Cc1cc([O-])cc2c1C(=O)/C(=C/c1ccccc1F)O2	ZINC000006756565	170241412	/nfs/dbraw/zinc/24/14/12/170241412.db2.gz	YRINKJBYZKNWGR-AUWJEWJLSA-N	-1	1	270.259	3.456	50	30		CGEAMM
O=C(C1=C([O-])c2ccccc2C1=O)C1CCCCC1	ZINC000002561501	368464703	/nfs/dbraw/zinc/46/47/03/368464703.db2.gz	UYDTYCGXFJRLBX-UHFFFAOYSA-N	-1	1	256.301	3.301	50	30		CGEAMM
C=C(C)Cc1c(C)nc(SCc2ccccc2)[n-]c1=O	ZINC000016844308	368721522	/nfs/dbraw/zinc/72/15/22/368721522.db2.gz	JDWLPEKQDVVUKY-UHFFFAOYSA-N	-1	1	286.400	3.489	50	30		CGEAMM
CCCCCCCCc1nc(S[C@H](C)C(=O)[O-])n[nH]1	ZINC000017357257	368732609	/nfs/dbraw/zinc/73/26/09/368732609.db2.gz	OTTGZMFFWIHQPC-SNVBAGLBSA-N	-1	1	285.413	3.273	50	30		CGEAMM
CCCCCCCCc1nnc(S[C@H](C)C(=O)[O-])[nH]1	ZINC000017357257	368732615	/nfs/dbraw/zinc/73/26/15/368732615.db2.gz	OTTGZMFFWIHQPC-SNVBAGLBSA-N	-1	1	285.413	3.273	50	30		CGEAMM
Cc1cc(=O)[n-]c(NN=C2CCCCc3ccccc32)n1	ZINC000606346864	348176435	/nfs/dbraw/zinc/17/64/35/348176435.db2.gz	JSCBDROKGJUYHK-UHFFFAOYSA-N	-1	1	282.347	3.033	50	30		CGEAMM
N#Cc1ccc([N-]S(=O)(=O)c2ccccc2)cc1Cl	ZINC000000030306	368272299	/nfs/dbraw/zinc/27/22/99/368272299.db2.gz	ZIEDTINTAWGJJS-UHFFFAOYSA-N	-1	1	292.747	3.012	50	30		CGEAMM
COc1ccc(-c2c(C#N)c(=O)[n-]c3c2CCCCC3)cc1	ZINC000012370967	368609930	/nfs/dbraw/zinc/60/99/30/368609930.db2.gz	KSTOTXNRZNKINJ-UHFFFAOYSA-N	-1	1	294.354	3.191	50	30		CGEAMM
C=C(C)Cc1c(C)nc(SCCCC)[n-]c1=O	ZINC000008767766	170354609	/nfs/dbraw/zinc/35/46/09/170354609.db2.gz	YJNJQVBDBSVLGC-UHFFFAOYSA-N	-1	1	252.383	3.089	50	30		CGEAMM
O=C(CC1=C([O-])C(=O)c2ccccc2C1=O)c1cccs1	ZINC000000478411	368376828	/nfs/dbraw/zinc/37/68/28/368376828.db2.gz	YAEFGOUYMNZEED-UHFFFAOYSA-N	-1	1	298.319	3.212	50	30	biogenic	CGEAMM
COc1ccc(/C=C/C(=O)c2ccc([O-])cc2)cc1OC	ZINC000003881970	368522594	/nfs/dbraw/zinc/52/25/94/368522594.db2.gz	UNWOWTCKYWIPPH-YCRREMRBSA-N	-1	1	284.311	3.306	50	30	biogenic	CGEAMM
COc1ccc(/C=C/C(=O)c2ccc([O-])cc2)cc1	ZINC000004042308	368528566	/nfs/dbraw/zinc/52/85/66/368528566.db2.gz	RTCVAWRRHHSOCC-NYYWCZLTSA-N	-1	1	254.285	3.297	50	30	biogenic,in-vitro	CGEAMM
C#Cc1cccc([N-]S(=O)(=O)c2cc(C)ccc2C)c1	ZINC000014849696	368685521	/nfs/dbraw/zinc/68/55/21/368685521.db2.gz	RIOAUFQKAVGSFP-UHFFFAOYSA-N	-1	1	285.368	3.086	50	30		CGEAMM
O=C([O-])c1ccc(C=NNc2nc3ccccc3s2)cc1	ZINC000004474739	391921264	/nfs/dbraw/zinc/92/12/64/391921264.db2.gz	RTAGAKOFXYCGPO-CXUHLZMHSA-N	-1	1	297.339	3.441	50	30		CGEAMM
C=C(Cl)CN1CCC(C(=O)c2ccc([O-])cc2)CC1	ZINC000096483268	526884900	/nfs/dbraw/zinc/88/49/00/526884900.db2.gz	TYEDJIWZHFGNRM-UHFFFAOYSA-N	-1	1	279.767	3.039	50	30		CGEAMM
COc1cc(/C=N/[O-])ccc1Oc1ccc([N+](=O)[O-])cc1	ZINC000000295741	368334844	/nfs/dbraw/zinc/33/48/44/368334844.db2.gz	NTFZRACHOZRZAT-OQLLNIDSSA-N	-1	1	288.259	3.204	50	30		CGEAMM
C#C[C@](C)(CC)OC(=O)[N-]C(=O)c1c(F)cccc1Cl	ZINC000002161444	368447992	/nfs/dbraw/zinc/44/79/92/368447992.db2.gz	XPGREMAKFZMOLC-CQSZACIVSA-N	-1	1	297.713	3.147	50	30		CGEAMM
Cc1cc([O-])c(C(=O)C=Cc2ccc(C(C)C)cc2)c(=O)o1	ZINC000003582012	368515670	/nfs/dbraw/zinc/51/56/70/368515670.db2.gz	PAIDIMCPHCRYGD-RCMYXZNBSA-N	-1	1	298.338	3.038	50	30		CGEAMM
O=C(/C=C\c1ccc2c(c1)OCCO2)c1ccc([O-])cc1	ZINC000034718623	368978313	/nfs/dbraw/zinc/97/83/13/368978313.db2.gz	FEEYXEFILMOOBD-XFSBKJJWSA-N	-1	1	282.295	3.060	50	30		CGEAMM
Cc1ccc(C=CC([O-])=C(C#N)C(=O)c2cccs2)o1	ZINC000104257696	397650077	/nfs/dbraw/zinc/65/00/77/397650077.db2.gz	FAFDTASHERKPPG-DGMVEKRQSA-N	-1	1	285.324	3.255	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1COc1cccc(Cl)c1	ZINC000005817011	170142944	/nfs/dbraw/zinc/14/29/44/170142944.db2.gz	OTSLKVBBEXNIDL-UHFFFAOYSA-N	-1	1	281.768	3.359	50	30		CGEAMM
C=CCn1c(Cc2ccc(OC)c(Cl)c2)n[n-]c1=S	ZINC000005911095	170154508	/nfs/dbraw/zinc/15/45/08/170154508.db2.gz	RWTUMRNMWKJWRU-UHFFFAOYSA-N	-1	1	295.795	3.379	50	30		CGEAMM
Cc1nn(C)c(C)c1C(=O)/C=C/c1ccc([O-])c(Cl)c1	ZINC000049372114	416470974	/nfs/dbraw/zinc/47/09/74/416470974.db2.gz	WOOLXBDXWBWKOH-FNORWQNLSA-N	-1	1	290.750	3.292	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C/c1cccc2[nH]ccc21	ZINC000575438546	329120010	/nfs/dbraw/zinc/12/00/10/329120010.db2.gz	KFVHDJSQDSWMCB-LZYBPNLTSA-N	-1	1	277.279	3.490	50	30		CGEAMM
Cc1cc(-c2ccc(/C=N/[O-])o2)c([N+](=O)[O-])cc1C	ZINC000000444423	368367556	/nfs/dbraw/zinc/36/75/56/368367556.db2.gz	XINIHIVMLDWCNZ-VGOFMYFVSA-N	-1	1	260.249	3.280	50	30		CGEAMM
Cc1ccc(N=Cc2c([O-])c3ccccc3oc2=O)c(C)c1	ZINC000100642440	370281821	/nfs/dbraw/zinc/28/18/21/370281821.db2.gz	QPJSCGCYCXVKPC-UVTDQMKNSA-N	-1	1	293.322	3.401	50	30	biogenic,in-vitro	CGEAMM
CC(C)=CCC1(CC=C(C)C)C(=O)C([O-])=C(O)C1=O	ZINC000100772750	370283432	/nfs/dbraw/zinc/28/34/32/370283432.db2.gz	KKNXLCGOZLVUHL-UHFFFAOYSA-N	-1	1	264.321	3.165	50	30	endogenous,in-man	CGEAMM
O=C(C=C([O-])C(=O)Nc1ccc(F)cc1)c1ccccc1	ZINC000101355150	370289005	/nfs/dbraw/zinc/28/90/05/370289005.db2.gz	CPFVHVUUUDMFPG-GDNBJRDFSA-N	-1	1	285.274	3.089	50	30		CGEAMM
COc1cc(/C=N/[O-])ccc1OC(=O)c1ccc(C)cc1	ZINC000020366783	171165133	/nfs/dbraw/zinc/16/51/33/171165133.db2.gz	QJVXHNQLOWHJEZ-LICLKQGHSA-N	-1	1	285.299	3.031	50	30		CGEAMM
CCOC(=O)c1cccc2c1-c1ccccc1/C2=N\[O-]	ZINC000095393419	276300208	/nfs/dbraw/zinc/30/02/08/276300208.db2.gz	YPCNWPJSHMBZDB-BMRADRMJSA-N	-1	1	267.284	3.070	50	30		CGEAMM
C=CCc1cccc([C@H]2Nc3ccccc3C(=O)N2[O-])c1O	ZINC000000079934	527260865	/nfs/dbraw/zinc/26/08/65/527260865.db2.gz	SBYIHYUUKHOSEH-INIZCTEOSA-N	-1	1	296.326	3.076	50	30		CGEAMM
C=C(C)Cn1c(-c2ccc(OC)c(OC)c2)n[n-]c1=S	ZINC000000336131	368343433	/nfs/dbraw/zinc/34/34/33/368343433.db2.gz	IGKMPKWOXNYUHY-UHFFFAOYSA-N	-1	1	291.376	3.201	50	30		CGEAMM
C/C(=N\c1ccccc1[N-]S(C)(=O)=O)c1ccccc1	ZINC000101161213	370287021	/nfs/dbraw/zinc/28/70/21/370287021.db2.gz	RPPJNJTWEXZEBS-FOWTUZBSSA-N	-1	1	288.372	3.199	50	30		CGEAMM
Cc1ccc(C(=O)/C=C/c2ccc(C(=O)[O-])cc2)c(O)c1	ZINC000096341525	256792340	/nfs/dbraw/zinc/79/23/40/256792340.db2.gz	LZMPKTQNKWCEDN-WEVVVXLNSA-N	-1	1	282.295	3.295	50	30		CGEAMM
C=CCn1c([C@H](CCCC)C[C@H](C)O)n[n-]c1=S	ZINC000002285343	391915859	/nfs/dbraw/zinc/91/58/59/391915859.db2.gz	QMSQBJMZVDKFJC-WDEREUQCSA-N	-1	1	269.414	3.171	50	30		CGEAMM
Cc1ccc(-c2c(C#N)c(=O)[n-]c3c2CCCC3)cc1	ZINC000041377335	292029495	/nfs/dbraw/zinc/02/94/95/292029495.db2.gz	DBNKKRQUWDRVKP-UHFFFAOYSA-N	-1	1	264.328	3.101	50	30		CGEAMM
CSc1ccc(-c2[nH]c(=S)[n-]c(=O)c2C#N)cc1	ZINC000008730730	170350737	/nfs/dbraw/zinc/35/07/37/170350737.db2.gz	PAAZUUFLLAOOSM-UHFFFAOYSA-N	-1	1	275.358	3.105	50	30		CGEAMM
CCn1cc(C(=O)/C=C\c2ccc([O-])c(Cl)c2)cn1	ZINC000096313712	392247620	/nfs/dbraw/zinc/24/76/20/392247620.db2.gz	XTOGOYBHBXFUTN-HYXAFXHYSA-N	-1	1	276.723	3.158	50	30		CGEAMM
CN(C)Cc1c2c(ccc1[O-])C(=O)/C(=C/c1ccccc1)O2	ZINC000020624392	276810109	/nfs/dbraw/zinc/81/01/09/276810109.db2.gz	PVDKSIRMHFOVCC-YBEGLDIGSA-N	-1	1	295.338	3.070	50	30		CGEAMM
C=CCn1c([C@@H](CCCC)C[C@H](C)O)n[n-]c1=S	ZINC000002285342	527349600	/nfs/dbraw/zinc/34/96/00/527349600.db2.gz	QMSQBJMZVDKFJC-QWRGUYRKSA-N	-1	1	269.414	3.171	50	30		CGEAMM
Cc1csc(C(C#N)=C([O-])c2cccc3c2ccn3C)n1	ZINC000076020423	345531100	/nfs/dbraw/zinc/53/11/00/345531100.db2.gz	VVPDFJMYXRLPDL-CYBMUJFWSA-N	-1	1	295.367	3.433	50	30		CGEAMM
[O-]c1oc(-c2ccco2)nc1C=Nc1ccccc1O	ZINC000000438910	368366441	/nfs/dbraw/zinc/36/64/41/368366441.db2.gz	OREAKDKXXLYJOS-OVCLIPMQSA-N	-1	1	270.244	3.096	50	30		CGEAMM
Cc1[n-]n(-c2ccccc2)c(=O)c1C=Nc1ccccc1O	ZINC000013395701	368653210	/nfs/dbraw/zinc/65/32/10/368653210.db2.gz	SHLBEFQZTCGKJE-BGARDKSCSA-N	-1	1	293.326	3.133	50	30		CGEAMM
C=CCc1c(C)[n-]n(-c2nc3ccccc3s2)c1=O	ZINC000100430459	370279056	/nfs/dbraw/zinc/27/90/56/370279056.db2.gz	NWTXZVCBYWNKAR-UHFFFAOYSA-N	-1	1	271.345	3.225	50	30		CGEAMM
Cc1cccc(NC(=O)C([O-])=CC(=O)c2ccc(F)cc2)c1	ZINC000101355167	370288927	/nfs/dbraw/zinc/28/89/27/370288927.db2.gz	JMBUSMVGBMNBML-YBEGLDIGSA-N	-1	1	299.301	3.397	50	30		CGEAMM
Cc1ccc(/N=C/c2cccc([O-])c2O)cc1[N+](=O)[O-]	ZINC000000310787	169605018	/nfs/dbraw/zinc/60/50/18/169605018.db2.gz	JJFRSGJRDPVAOH-OVCLIPMQSA-N	-1	1	272.260	3.065	50	30		CGEAMM
CCc1ccccc1N/N=C(/C)c1c([O-])cc(C)oc1=O	ZINC000102734794	397647343	/nfs/dbraw/zinc/64/73/43/397647343.db2.gz	FCHMZRHAOHUABF-BOPFTXTBSA-N	-1	1	286.331	3.052	50	30		CGEAMM
Cc1cc(=O)[n-]c(NN=Cc2c(Cl)cccc2Cl)n1	ZINC000008619255	170343498	/nfs/dbraw/zinc/34/34/98/170343498.db2.gz	HOXBNCVGPHHSBB-GIDUJCDVSA-N	-1	1	297.145	3.243	50	30		CGEAMM
Cc1[n-]c(=O)c(C#N)c(-c2ccc(Cl)cc2)c1C	ZINC000000049270	368277585	/nfs/dbraw/zinc/27/75/85/368277585.db2.gz	VWIOHRLAJOYHRA-UHFFFAOYSA-N	-1	1	258.708	3.184	50	30		CGEAMM
CCOc1ccc([C@H]2Nc3ccccc3C(=O)N2[O-])cc1	ZINC000000374682	368351326	/nfs/dbraw/zinc/35/13/26/368351326.db2.gz	UVRQITAWNRXSNX-HNNXBMFYSA-N	-1	1	284.315	3.041	50	30		CGEAMM
CCOc1ccc([C@@H]2Nc3ccccc3C(=O)N2[O-])cc1	ZINC000000374685	368352007	/nfs/dbraw/zinc/35/20/07/368352007.db2.gz	UVRQITAWNRXSNX-OAHLLOKOSA-N	-1	1	284.315	3.041	50	30		CGEAMM
COc1cc(/C=C2/Oc3cc([O-])ccc3C2=O)cc(OC)c1	ZINC000090216169	370059419	/nfs/dbraw/zinc/05/94/19/370059419.db2.gz	GSVOFGLOXPEEQI-FRKPEAEDSA-N	-1	1	298.294	3.026	50	30		CGEAMM
COc1ccccc1/C=C/C(=O)c1ccc([O-])cc1	ZINC000004811992	170021608	/nfs/dbraw/zinc/02/16/08/170021608.db2.gz	KYAPKYXQCLBRIU-DHZHZOJOSA-N	-1	1	254.285	3.297	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1COc1ccccc1Cl	ZINC000005444029	170099687	/nfs/dbraw/zinc/09/96/87/170099687.db2.gz	XDSRTEMPZXVHPB-UHFFFAOYSA-N	-1	1	281.768	3.359	50	30		CGEAMM
CCOc1ccc2ccccc2c1C=Nn1cn[n-]c1=S	ZINC000005686525	170128715	/nfs/dbraw/zinc/12/87/15/170128715.db2.gz	DQZVSTWXSHDMTB-RQZCQDPDSA-N	-1	1	298.371	3.375	50	30		CGEAMM
O=C1c2ccc([O-])c(O)c2C/C1=C/c1ccc(F)cc1	ZINC000098053030	280330580	/nfs/dbraw/zinc/33/05/80/280330580.db2.gz	HNDZONHRFCFVDU-YFHOEESVSA-N	-1	1	270.259	3.059	50	30		CGEAMM
CCCCCCCCCCS(=O)(=O)[N-]c1ccccn1	ZINC000003155664	520022850	/nfs/dbraw/zinc/02/28/50/520022850.db2.gz	QBSMRBFHURSMOC-UHFFFAOYSA-N	-1	1	298.452	3.386	50	30		CGEAMM
Cc1cccc(C(=O)Oc2ccc(/C=N/[O-])cc2)c1	ZINC000013111889	368642733	/nfs/dbraw/zinc/64/27/33/368642733.db2.gz	SBSNFTNBYLAUII-MHWRWJLKSA-N	-1	1	255.273	3.022	50	30		CGEAMM
CC(=O)Nc1ccc(/C=C/C(=O)c2ccc([O-])cc2)cc1	ZINC000005128078	170068925	/nfs/dbraw/zinc/06/89/25/170068925.db2.gz	JNIDVNRNUMLNNN-NYYWCZLTSA-N	-1	1	281.311	3.247	50	30		CGEAMM
CCCCCCCCNC(C)=C1SC(=S)[N-]C1=O	ZINC000211042340	346285438	/nfs/dbraw/zinc/28/54/38/346285438.db2.gz	IEKATLVOOMCMTR-ZHACJKMWSA-N	-1	1	286.466	3.316	50	30		CGEAMM
Cc1nc2ccc(N=Cc3cc([N+](=O)[O-])ccc3[O-])cc2[nH]1	ZINC000004728801	368557220	/nfs/dbraw/zinc/55/72/20/368557220.db2.gz	UAUBZSPEJRGUIV-LZYBPNLTSA-N	-1	1	296.286	3.236	50	30		CGEAMM
CC(C)(C)/C(Cn1cnc(Cl)c1Cl)=N\[O-]	ZINC000100684273	370281648	/nfs/dbraw/zinc/28/16/48/370281648.db2.gz	GZGPHHGRJAAMLM-MLPAPPSSSA-N	-1	1	250.129	3.066	50	30		CGEAMM
Cc1cc(C(C#N)=C([O-])c2cc3c(s2)CCC3)nc(C)n1	ZINC000084114362	541932263	/nfs/dbraw/zinc/93/22/63/541932263.db2.gz	ZPXUNMPIWVXKDM-LBPRGKRZSA-N	-1	1	297.383	3.134	50	30		CGEAMM
O=C(/C=C/c1ccc(N2N=N2)cc1)c1ccc([O-])cc1	ZINC000004991328	170051046	/nfs/dbraw/zinc/05/10/46/170051046.db2.gz	HFSGSBOUBBBVNI-XCVCLJGOSA-N	-1	1	265.272	3.391	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1-c1cccc(OCC)c1	ZINC000005906944	170153260	/nfs/dbraw/zinc/15/32/60/170153260.db2.gz	FICJLNSGCNUPBH-UHFFFAOYSA-N	-1	1	261.350	3.192	50	30		CGEAMM
COc1ccc(/C=C/C(=O)c2ccc([O-])cc2)cc1O	ZINC000006897536	170253984	/nfs/dbraw/zinc/25/39/84/170253984.db2.gz	IRCOHSKVGOLJCA-KRXBUXKQSA-N	-1	1	270.284	3.003	50	30		CGEAMM
N#Cc1ccc([O-])c(-n2ccnc2-c2cccc(F)c2F)c1	ZINC000077340627	177254740	/nfs/dbraw/zinc/25/47/40/177254740.db2.gz	OWGGEUNNPVMKAQ-UHFFFAOYSA-N	-1	1	297.264	3.395	50	30		CGEAMM
Cc1ccc(/C=C2\Oc3cc([O-])ccc3C2=O)cc1	ZINC000012447481	280754201	/nfs/dbraw/zinc/75/42/01/280754201.db2.gz	WWQCDLLIKNSZHL-NVNXTCNLSA-N	-1	1	252.269	3.317	50	30	biogenic,in-vitro	CGEAMM
Cc1cc(/C=C2/Oc3cc([O-])ccc3C2=O)cc(C)c1O	ZINC000096920991	301035511	/nfs/dbraw/zinc/03/55/11/301035511.db2.gz	ANHXUJFYRUYOHX-VIZOYTHASA-N	-1	1	282.295	3.331	50	30		CGEAMM
Cc1cc([O-])c(C(=O)C=Cc2ccc(C(C)C)cc2)c(=O)o1	ZINC000003582027	368515580	/nfs/dbraw/zinc/51/55/80/368515580.db2.gz	PAIDIMCPHCRYGD-NADMHLTPSA-N	-1	1	298.338	3.038	50	30		CGEAMM
COc1cc(/C=N/[O-])ccc1OCc1ccccc1F	ZINC000016214946	368710366	/nfs/dbraw/zinc/71/03/66/368710366.db2.gz	JCRYERDGLXXRJF-RQZCQDPDSA-N	-1	1	275.279	3.221	50	30		CGEAMM
N#Cc1c(=O)[n-]c(=S)[nH]c1-c1ccc(Cl)cc1	ZINC000018127222	368739230	/nfs/dbraw/zinc/73/92/30/368739230.db2.gz	XHPUHYGYTQUAMV-UHFFFAOYSA-N	-1	1	263.709	3.037	50	30		CGEAMM
Cc1csc(C(C#N)=C([O-])c2cccc3cc[nH]c32)n1	ZINC000076764142	541911896	/nfs/dbraw/zinc/91/18/96/541911896.db2.gz	HQMIHPWGZQWDHE-LBPRGKRZSA-N	-1	1	281.340	3.423	50	30		CGEAMM
Cc1ccc(C=CC([O-])=C(C#N)C(=O)c2cccs2)o1	ZINC000103503179	397648997	/nfs/dbraw/zinc/64/89/97/397648997.db2.gz	FAFDTASHERKPPG-NNNHXZLVSA-N	-1	1	285.324	3.255	50	30		CGEAMM
CCCOc1cc(Br)c(/C=N/[O-])cc1OC	ZINC000005952101	170161743	/nfs/dbraw/zinc/16/17/43/170161743.db2.gz	ULFKESQEBHYWKI-NTUHNPAUSA-N	-1	1	288.141	3.055	50	30		CGEAMM
COC(=O)c1ccc(/C=C\C(=O)c2ccc([O-])cc2)cc1	ZINC000035301443	172115417	/nfs/dbraw/zinc/11/54/17/172115417.db2.gz	ICURPCVKTUIWLY-WCIBSUBMSA-N	-1	1	282.295	3.075	50	30		CGEAMM
N#Cc1c(=O)[n-]c2c(c1-c1ccccc1Cl)CCCC2	ZINC000041460068	294857357	/nfs/dbraw/zinc/85/73/57/294857357.db2.gz	GAZGDRABFSOALO-UHFFFAOYSA-N	-1	1	284.746	3.446	50	30		CGEAMM
[O-]c1ccc(C=NNc2nc3ccccc3[nH]2)cc1Cl	ZINC000051075703	526339259	/nfs/dbraw/zinc/33/92/59/526339259.db2.gz	GLKUUHZQACXEFC-PXNMLYILSA-N	-1	1	286.722	3.368	50	30		CGEAMM
N#Cc1c(=O)[n-]c2c(c1-c1ccc(Cl)cc1)CCCC2	ZINC000041460072	369185274	/nfs/dbraw/zinc/18/52/74/369185274.db2.gz	JWIBBJIYIGLMKH-UHFFFAOYSA-N	-1	1	284.746	3.446	50	30		CGEAMM
Cc1ccc(/C=C2/Oc3cc([O-])ccc3C2=O)cc1	ZINC000000149771	292040029	/nfs/dbraw/zinc/04/00/29/292040029.db2.gz	WWQCDLLIKNSZHL-OVCLIPMQSA-N	-1	1	252.269	3.317	50	30		CGEAMM
S=c1[n-]ncn1N=Cc1c(Cl)cccc1Cl	ZINC000006057368	170172836	/nfs/dbraw/zinc/17/28/36/170172836.db2.gz	VACXXBHLAVIARN-YIXHJXPBSA-N	-1	1	273.148	3.130	50	30		CGEAMM
C=CCSc1nc([O-])c(CC)c(=O)n1C1CCCCC1	ZINC000016161153	276906649	/nfs/dbraw/zinc/90/66/49/276906649.db2.gz	URMQXODJZSDZRU-UHFFFAOYSA-N	-1	1	294.420	3.295	50	30		CGEAMM
Cc1ccsc1[C@@H]1Nc2ccccc2C(=O)N1[O-]	ZINC000000374652	278996857	/nfs/dbraw/zinc/99/68/57/278996857.db2.gz	VMHVKYKHUFJZBI-GFCCVEGCSA-N	-1	1	260.318	3.012	50	30		CGEAMM
CCCCCOc1ccccc1C=Nn1cn[n-]c1=S	ZINC000006067223	520259989	/nfs/dbraw/zinc/25/99/89/520259989.db2.gz	HDLJFIYKENDHPW-MHWRWJLKSA-N	-1	1	290.392	3.392	50	30		CGEAMM
COCc1cc(C(=O)/C=C\c2cccc(OC)c2)ccc1[O-]	ZINC000033744899	522907478	/nfs/dbraw/zinc/90/74/78/522907478.db2.gz	BDVWQKGIRVKBTP-VURMDHGXSA-N	-1	1	298.338	3.443	50	30		CGEAMM
Cc1csc(C(C#N)=C([O-])c2cccc3c2ccn3C)n1	ZINC000076020417	345530848	/nfs/dbraw/zinc/53/08/48/345530848.db2.gz	VVPDFJMYXRLPDL-ZDUSSCGKSA-N	-1	1	295.367	3.433	50	30		CGEAMM
N#Cc1ccsc1[N-]C(=O)c1cc(-c2ccco2)on1	ZINC000049026013	369382688	/nfs/dbraw/zinc/38/26/88/369382688.db2.gz	LRWXNPFUMMGNIZ-UHFFFAOYSA-N	-1	1	285.284	3.120	50	30		CGEAMM
Cc1n[n-]c(=S)n1N=Cc1c(Cl)cccc1Cl	ZINC000005730841	170134633	/nfs/dbraw/zinc/13/46/33/170134633.db2.gz	BAAJUAFUSRUINN-WLRTZDKTSA-N	-1	1	287.175	3.438	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1[C@@H]1C[C@@H]1c1ccccc1	ZINC000015933421	276912083	/nfs/dbraw/zinc/91/20/83/276912083.db2.gz	CMFMXWPZLFNEKY-VXGBXAGGSA-N	-1	1	257.362	3.398	50	30		CGEAMM
CCCC[C@@H]1Oc2c(Cl)cccc2N([O-])C1=O	ZINC000004648856	534958655	/nfs/dbraw/zinc/95/86/55/534958655.db2.gz	BFMVAFNPNMVAEL-JTQLQIEISA-N	-1	1	255.701	3.013	50	30		CGEAMM
C=CCn1c(Cc2ccc(O)c(Cl)c2)n[n-]c1=S	ZINC000000163555	368305868	/nfs/dbraw/zinc/30/58/68/368305868.db2.gz	XPWWNIKDRUZCIR-UHFFFAOYSA-N	-1	1	281.768	3.076	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1[C@H]1C[C@H]1c1ccccc1	ZINC000015933423	368705299	/nfs/dbraw/zinc/70/52/99/368705299.db2.gz	CMFMXWPZLFNEKY-RYUDHWBXSA-N	-1	1	257.362	3.398	50	30		CGEAMM
O=C(C=C([O-])c1ccc(-n2ccnc2)cc1)C(F)(F)F	ZINC000100497053	370280101	/nfs/dbraw/zinc/28/01/01/370280101.db2.gz	UVNBCXCPQIFDMG-KPKJPENVSA-N	-1	1	282.221	3.059	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C\c1cccc2[nH]ccc21	ZINC000407986242	379987274	/nfs/dbraw/zinc/98/72/74/379987274.db2.gz	KFVHDJSQDSWMCB-PXNMLYILSA-N	-1	1	277.279	3.490	50	30	biogenic	CGEAMM
C=CCn1c(COc2ccccc2C)n[n-]c1=S	ZINC000005730807	170134419	/nfs/dbraw/zinc/13/44/19/170134419.db2.gz	UXZAKEGSCMCZGC-UHFFFAOYSA-N	-1	1	261.350	3.014	50	30		CGEAMM
CN(C)c1ccc(/C=C\C(=O)c2ccc([O-])cc2)cc1	ZINC000008652002	170343919	/nfs/dbraw/zinc/34/39/19/170343919.db2.gz	BJWJZTDHDARRCW-XGICHPGQSA-N	-1	1	267.328	3.354	50	30		CGEAMM
Cc1[n-]c(=O)c(C#N)cc1-c1csc(-c2ccccc2)n1	ZINC000003118378	280182068	/nfs/dbraw/zinc/18/20/68/280182068.db2.gz	UJXSTLXCNHTTRQ-UHFFFAOYSA-N	-1	1	293.351	3.346	50	30		CGEAMM
Cc1cc(=O)[n-]c(NN=Cc2ccc(C(C)(C)C)cc2)n1	ZINC000606346890	348176032	/nfs/dbraw/zinc/17/60/32/348176032.db2.gz	VIAKYFARAJZLNS-UHFFFAOYSA-N	-1	1	284.363	3.234	50	30		CGEAMM
N#Cc1c([N-]C(=O)c2c(F)cccc2F)oc2cccnc12	ZINC000001394405	283080774	/nfs/dbraw/zinc/08/07/74/283080774.db2.gz	ROWRQNJRCCECPO-UHFFFAOYSA-N	-1	1	299.236	3.230	50	30		CGEAMM
O=[N+]([O-])c1cc(/N=C/c2ccc(O)c([O-])c2)ccc1Cl	ZINC000000561315	368387241	/nfs/dbraw/zinc/38/72/41/368387241.db2.gz	RYIRDTKDKFUHRR-VIZOYTHASA-N	-1	1	292.678	3.410	50	30		CGEAMM
CC(N=Nc1ccc(C(=O)[O-])cc1)c1ccc(F)cc1	ZINC000003909056	368524340	/nfs/dbraw/zinc/52/43/40/368524340.db2.gz	PGXHRHXBSJSPCP-YVLHZVERSA-N	-1	1	272.279	3.360	50	30		CGEAMM
O=[N+]([O-])c1cccc(/C(=N/[O-])Nc2cccc(Cl)c2)c1	ZINC000013142492	368645199	/nfs/dbraw/zinc/64/51/99/368645199.db2.gz	LOPJUGLPZHUWHL-UHFFFAOYSA-N	-1	1	291.694	3.496	50	30		CGEAMM
COc1cccc(/C=C2/Oc3cc([O-])ccc3C2=O)c1OC	ZINC000000489782	620334483	/nfs/dbraw/zinc/33/44/83/620334483.db2.gz	GQSYGPPHMQKVOE-OVCLIPMQSA-N	-1	1	298.294	3.026	50	30		CGEAMM
N#Cc1c([N-]C(=O)c2ccno2)sc2c1CCCCC2	ZINC000010253938	368578607	/nfs/dbraw/zinc/57/86/07/368578607.db2.gz	RTOPYRJCLFXOHG-UHFFFAOYSA-N	-1	1	287.344	3.129	50	30		CGEAMM
CCOc1ccc(-c2c(C#N)c(=O)[n-]c3c2CCCC3)cc1	ZINC000041484051	391984972	/nfs/dbraw/zinc/98/49/72/391984972.db2.gz	KBBYBFCTDMZUDX-UHFFFAOYSA-N	-1	1	294.354	3.191	50	30		CGEAMM
CC(N=Nc1ccccc1C(=O)[O-])c1cccs1	ZINC000004738379	170008117	/nfs/dbraw/zinc/00/81/17/170008117.db2.gz	PVYNOWWRJCXAPI-ZROIWOOFSA-N	-1	1	260.318	3.282	50	30		CGEAMM
[O-]c1c(Br)cccc1/C=N/c1nccs1	ZINC000000495616	280450406	/nfs/dbraw/zinc/45/04/06/280450406.db2.gz	KARNHZNXLNROBX-AWNIVKPZSA-N	-1	1	283.150	3.362	50	30		CGEAMM
Cc1cc([O-])cc2c1C(=O)/C(=C/c1ccccc1)O2	ZINC000006623975	280635983	/nfs/dbraw/zinc/63/59/83/280635983.db2.gz	IVERTRYIRDWYOU-ZSOIEALJSA-N	-1	1	252.269	3.317	50	30	biogenic	CGEAMM
CC(=NNc1cccc([N+](=O)[O-])c1)c1cc(F)ccc1[O-]	ZINC000254796108	640915676	/nfs/dbraw/zinc/91/56/76/640915676.db2.gz	XCLSZWBRPIGUBP-UHFFFAOYSA-N	-1	1	289.266	3.276	50	30		CGEAMM
O=C(CC1=C([O-])C(=O)c2ccccc2C1=O)c1ccccc1	ZINC000000433350	368365418	/nfs/dbraw/zinc/36/54/18/368365418.db2.gz	OEKUAUCYHHOPGS-UHFFFAOYSA-N	-1	1	292.290	3.151	50	30	biogenic	CGEAMM
C=CCn1c(COc2ccc(C)cc2C)n[n-]c1=S	ZINC000002536770	368462161	/nfs/dbraw/zinc/46/21/61/368462161.db2.gz	KYZGTYZNWCZUJI-UHFFFAOYSA-N	-1	1	275.377	3.323	50	30		CGEAMM
CC(C)(C)/C(Cn1cnc(Cl)c1Cl)=N/[O-]	ZINC000013401355	368652670	/nfs/dbraw/zinc/65/26/70/368652670.db2.gz	GZGPHHGRJAAMLM-AWNIVKPZSA-N	-1	1	250.129	3.066	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1-c1c[nH]c2ccccc12	ZINC000017820210	368735123	/nfs/dbraw/zinc/73/51/23/368735123.db2.gz	QYIMBZCZTCHWIH-UHFFFAOYSA-N	-1	1	256.334	3.275	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C\C=C\c1ccco1	ZINC000011764739	285015880	/nfs/dbraw/zinc/01/58/80/285015880.db2.gz	UWPJFGPAYRLAJH-LFXCGDNUSA-N	-1	1	254.241	3.158	50	30	biogenic	CGEAMM
CC1=Nc2ccccc2C1N=Nc1ccccc1C(=O)[O-]	ZINC000012377639	391929303	/nfs/dbraw/zinc/92/93/03/391929303.db2.gz	IHHIEJRCFVYQSI-CYVLTUHYSA-N	-1	1	279.299	3.307	50	30		CGEAMM
Cc1ccc(C=CC([O-])=C(C#N)C(=O)c2cccs2)o1	ZINC000104257689	397650070	/nfs/dbraw/zinc/65/00/70/397650070.db2.gz	FAFDTASHERKPPG-ZHRWSRJISA-N	-1	1	285.324	3.255	50	30		CGEAMM
Cc1cc([O-])c(C(=O)/C=C/c2ccc(O)c(O)c2)cc1C	ZINC000072194200	176337133	/nfs/dbraw/zinc/33/71/33/176337133.db2.gz	YITMXMHWDSZXJQ-HWKANZROSA-N	-1	1	284.311	3.316	50	30		CGEAMM
O=C1c2ccc(Cl)c3c(Cl)ccc(c23)C(=O)N1[O-]	ZINC000004984342	619226264	/nfs/dbraw/zinc/22/62/64/619226264.db2.gz	AOGWMSLUUJMARX-UHFFFAOYSA-N	-1	1	282.082	3.132	50	30		CGEAMM
CCC(=NNc1ccc(C(=O)[O-])cc1)c1ccc(O)cc1	ZINC000254482922	640912044	/nfs/dbraw/zinc/91/20/44/640912044.db2.gz	HPBINUNUQWVBPQ-UHFFFAOYSA-N	-1	1	284.315	3.317	50	30		CGEAMM
COc1cccc(/C=C\C(=O)c2ccc([O-])cc2)c1OC	ZINC000096766217	185112383	/nfs/dbraw/zinc/11/23/83/185112383.db2.gz	RFNQYABMSQEIHT-FLIBITNWSA-N	-1	1	284.311	3.306	50	30		CGEAMM
C=C(C)CCSc1nc([O-])cc(=O)n1C1CCCC1	ZINC000252489956	131135114	/nfs/dbraw/zinc/13/51/14/131135114.db2.gz	KGBTWRSJVVXIQI-UHFFFAOYSA-N	-1	1	280.393	3.122	50	30		CGEAMM
N#Cc1ccc(/C=C2/CCc3cc([O-])ccc3C2=O)cc1	ZINC000096402687	283121337	/nfs/dbraw/zinc/12/13/37/283121337.db2.gz	YTNQKHYUCVQRFP-DHDCSXOGSA-N	-1	1	275.307	3.476	50	30		CGEAMM
O=C(C=C([O-])c1ccc(-n2ccnc2)cc1)C(F)(F)F	ZINC000101372126	370288956	/nfs/dbraw/zinc/28/89/56/370288956.db2.gz	UVNBCXCPQIFDMG-GHXNOFRVSA-N	-1	1	282.221	3.059	50	30		CGEAMM
C=CCn1c([C@@H](CC(C)C)C[C@@H](C)O)n[n-]c1=S	ZINC000005817342	170142865	/nfs/dbraw/zinc/14/28/65/170142865.db2.gz	LEGLSVUVSHFHNC-MNOVXSKESA-N	-1	1	269.414	3.027	50	30		CGEAMM
C=CCn1c([C@H](CC(C)C)C[C@@H](C)O)n[n-]c1=S	ZINC000005817358	170143016	/nfs/dbraw/zinc/14/30/16/170143016.db2.gz	LEGLSVUVSHFHNC-GHMZBOCLSA-N	-1	1	269.414	3.027	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1[C@@H](C)Oc1ccccc1	ZINC000006399229	170198465	/nfs/dbraw/zinc/19/84/65/170198465.db2.gz	OHROLIMVKIAXAR-SNVBAGLBSA-N	-1	1	261.350	3.267	50	30		CGEAMM
C#Cc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2)c1	ZINC000022408419	171386990	/nfs/dbraw/zinc/38/69/90/171386990.db2.gz	CSKYDRBRFKYYIX-UHFFFAOYSA-N	-1	1	291.759	3.122	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1-c1ccccc1OCC	ZINC000013119464	368643755	/nfs/dbraw/zinc/64/37/55/368643755.db2.gz	WPEWTVPUSXZQON-UHFFFAOYSA-N	-1	1	261.350	3.192	50	30		CGEAMM
C/C(=N\O)C(C)(C)N([O-])C(=O)Nc1ccc(Cl)cc1	ZINC000005363800	170089722	/nfs/dbraw/zinc/08/97/22/170089722.db2.gz	PYYIPSVPGISTKX-OVCLIPMQSA-N	-1	1	285.731	3.192	50	30		CGEAMM
C=CCn1c([C@H](CCC(C)C)C[C@@H](C)O)n[n-]c1=S	ZINC000004507318	368548746	/nfs/dbraw/zinc/54/87/46/368548746.db2.gz	WIXCHPJNAUNGIL-VXGBXAGGSA-N	-1	1	283.441	3.417	50	30		CGEAMM
O=C(Oc1ccc(/C=N/[O-])cc1)c1ccc(Cl)cc1	ZINC000017086144	368727458	/nfs/dbraw/zinc/72/74/58/368727458.db2.gz	BGCZNFZJANXVKF-CXUHLZMHSA-N	-1	1	275.691	3.367	50	30		CGEAMM
Cc1cccc([O-])c1/N=C/c1ccc([N+](=O)[O-])cc1	ZINC000000059996	169521910	/nfs/dbraw/zinc/52/19/10/169521910.db2.gz	XTEBVHJWOWVYNU-OQLLNIDSSA-N	-1	1	256.261	3.359	50	30		CGEAMM
O=C(/C=C\c1cccc([N+](=O)[O-])c1)c1ccc([O-])cc1	ZINC000033556063	624348783	/nfs/dbraw/zinc/34/87/83/624348783.db2.gz	WYQHZANXMKJOBP-WTKPLQERSA-N	-1	1	269.256	3.197	50	30		CGEAMM
CC(C)Cc1cc(-c2ccccc2)c(C#N)c(=O)[n-]1	ZINC000013898907	640971647	/nfs/dbraw/zinc/97/16/47/640971647.db2.gz	PQUAHPCHMVFJRT-UHFFFAOYSA-N	-1	1	252.317	3.112	50	30		CGEAMM
CCCCOc1ccc(C=Nn2c(C)n[n-]c2=S)cc1	ZINC000005848886	344862877	/nfs/dbraw/zinc/86/28/77/344862877.db2.gz	DATRUZXHDWIIHC-XNTDXEJSSA-N	-1	1	290.392	3.310	50	30		CGEAMM
CCCCOc1ccc(C=Nn2cn[n-]c2=S)cc1	ZINC000005848908	344863048	/nfs/dbraw/zinc/86/30/48/344863048.db2.gz	PHSYBOMDBCQANT-OQLLNIDSSA-N	-1	1	276.365	3.002	50	30		CGEAMM
CC(=O)C1=C([O-])c2cc(Cl)c(Cl)cc2C1=O	ZINC000000086069	368285469	/nfs/dbraw/zinc/28/54/69/368285469.db2.gz	BKZQZHGCZHKFMW-UHFFFAOYSA-N	-1	1	257.072	3.048	50	30		CGEAMM
C#C[C@](C)(CC)OC(=O)[N-]C(=O)c1ccccc1Cl	ZINC000002161451	368447945	/nfs/dbraw/zinc/44/79/45/368447945.db2.gz	ALHGPESJTIVKJV-CQSZACIVSA-N	-1	1	279.723	3.008	50	30		CGEAMM
CCCOc1ccc(Br)cc1C=N[O-]	ZINC000252426450	377620989	/nfs/dbraw/zinc/62/09/89/377620989.db2.gz	BZDKQYSCCPXCDG-UHFFFAOYSA-N	-1	1	258.115	3.046	50	30		CGEAMM
CC(=O)C1=C([O-])[C@@H](Cc2ccccc2)c2ccccc2C1=O	ZINC000253406627	377688485	/nfs/dbraw/zinc/68/84/85/377688485.db2.gz	UUKSDTDSXOYIET-INIZCTEOSA-N	-1	1	292.334	3.454	50	30		CGEAMM
CC(=O)C1=C([O-])c2ccccc2[C@H](Cc2ccccc2)C1=O	ZINC000253406627	377688491	/nfs/dbraw/zinc/68/84/91/377688491.db2.gz	UUKSDTDSXOYIET-INIZCTEOSA-N	-1	1	292.334	3.454	50	30		CGEAMM
C=CCn1c(CCSCCCC)n[n-]c1=S	ZINC000006359809	170195133	/nfs/dbraw/zinc/19/51/33/170195133.db2.gz	HAWYIUBHDGQHER-UHFFFAOYSA-N	-1	1	257.428	3.202	50	30		CGEAMM
O=C(Cc1cccc(F)c1)Nc1nc(-c2ccco2)n[nH]1	ZINC000013002871	260067335	/nfs/dbraw/zinc/06/73/35/260067335.db2.gz	HTOUOAKZIAZQPE-UHFFFAOYSA-N	-1	1	286.266	3.035	50	30		CGEAMM
N#Cc1c(=O)[n-]c2c(c1-c1cccc(Cl)c1)CCCC2	ZINC000041460070	294857423	/nfs/dbraw/zinc/85/74/23/294857423.db2.gz	IUCAZILPWOYPEW-UHFFFAOYSA-N	-1	1	284.746	3.446	50	30		CGEAMM
Cc1ccc([O-])c(C(=O)C=C(N)C(Cl)(Cl)Cl)c1	ZINC000004955601	619225321	/nfs/dbraw/zinc/22/53/21/619225321.db2.gz	OALCLGPSDBJKFR-YHYXMXQVSA-N	-1	1	294.565	3.096	50	30		CGEAMM
C=CCn1c(=S)[n-]nc1[C@@H]1C[C@H]1c1ccccc1	ZINC000015933422	368705145	/nfs/dbraw/zinc/70/51/45/368705145.db2.gz	CMFMXWPZLFNEKY-NWDGAFQWSA-N	-1	1	257.362	3.398	50	30		CGEAMM
Cc1cc(-c2ccccc2)sc1C(=O)C=C(O)C(=O)[O-]	ZINC000100567181	370280730	/nfs/dbraw/zinc/28/07/30/370280730.db2.gz	WJVBTHHRPPKGSN-WQLSENKSSA-N	-1	1	288.324	3.433	50	30		CGEAMM
C=CCc1ccccc1OCc1n[n-]c(=S)n1CC=C	ZINC000005685791	170129047	/nfs/dbraw/zinc/12/90/47/170129047.db2.gz	BPESHTCZHMDJBL-UHFFFAOYSA-N	-1	1	287.388	3.434	50	30		CGEAMM
C=CCn1c(COc2c(C)cccc2C)n[n-]c1=S	ZINC000005981852	170165453	/nfs/dbraw/zinc/16/54/53/170165453.db2.gz	NBRXYPZLJOTPCB-UHFFFAOYSA-N	-1	1	275.377	3.323	50	30		CGEAMM
Cc1ccccc1/C=C1\Oc2cc([O-])ccc2C1=O	ZINC000016740609	281332607	/nfs/dbraw/zinc/33/26/07/281332607.db2.gz	CZOCXZAWZDBDCZ-NVNXTCNLSA-N	-1	1	252.269	3.317	50	30	biogenic	CGEAMM
Cc1c(/N=C/c2cccc([O-])c2O)cccc1[N+](=O)[O-]	ZINC000000273981	368330292	/nfs/dbraw/zinc/33/02/92/368330292.db2.gz	LFFUVOIVYZBEIM-OVCLIPMQSA-N	-1	1	272.260	3.065	50	30		CGEAMM
Cc1cccc(C(=O)Oc2ccc(C=N[O-])cc2)c1	ZINC000252627800	377642813	/nfs/dbraw/zinc/64/28/13/377642813.db2.gz	SBSNFTNBYLAUII-UHFFFAOYSA-N	-1	1	255.273	3.022	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C\c1ccc(F)cc1	ZINC000000539425	285015930	/nfs/dbraw/zinc/01/59/30/285015930.db2.gz	LRUJRAQGJJEHMX-AUWJEWJLSA-N	-1	1	256.232	3.148	50	30	biogenic	CGEAMM
N#Cc1c(=O)[n-]c(=S)[nH]c1-c1cccc(Cl)c1	ZINC000006804533	279498216	/nfs/dbraw/zinc/49/82/16/279498216.db2.gz	MZFWQIOXQSGSTC-UHFFFAOYSA-N	-1	1	263.709	3.037	50	30		CGEAMM
O=C(/C=C\c1cnn(-c2ccccc2)c1)c1ccc([O-])cc1	ZINC000096891309	185125053	/nfs/dbraw/zinc/12/50/53/185125053.db2.gz	CHENZBJCTMLFGG-WDZFZDKYSA-N	-1	1	290.322	3.474	50	30		CGEAMM
COc1ccccc1/C=C1\Oc2cc([O-])ccc2C1=O	ZINC000012859113	368630688	/nfs/dbraw/zinc/63/06/88/368630688.db2.gz	AUTVGGJLTZQXAE-NVNXTCNLSA-N	-1	1	268.268	3.017	50	30	biogenic	CGEAMM
Cc1ccc(-c2csc(-c3c([O-])csc3N)n2)cc1	ZINC000016245266	368710000	/nfs/dbraw/zinc/71/00/00/368710000.db2.gz	XBHKBGNXMQNEDY-UHFFFAOYSA-N	-1	1	288.397	3.062	50	30		CGEAMM
C=CCn1c([C@H](CCCC)C[C@@H](C)O)n[n-]c1=S	ZINC000002285341	391914712	/nfs/dbraw/zinc/91/47/12/391914712.db2.gz	QMSQBJMZVDKFJC-GHMZBOCLSA-N	-1	1	269.414	3.171	50	30		CGEAMM
C[C@@]1(C#N)CCCN(Cc2cccc([O-])c2Cl)C1	ZINC000590360043	346844006	/nfs/dbraw/zinc/84/40/06/346844006.db2.gz	OIFQPBGOAXQWEL-AWEZNQCLSA-N	-1	1	264.756	3.171	50	30		CGEAMM
C=CCn1c([C@@H](CCC(C)C)C[C@H](C)O)n[n-]c1=S	ZINC000004507322	368548755	/nfs/dbraw/zinc/54/87/55/368548755.db2.gz	WIXCHPJNAUNGIL-RYUDHWBXSA-N	-1	1	283.441	3.417	50	30		CGEAMM
O=C1c2ccc([O-])cc2O/C1=C/c1cccc(F)c1	ZINC000000534632	620365276	/nfs/dbraw/zinc/36/52/76/620365276.db2.gz	CISJJIPWRRRGMU-VGOFMYFVSA-N	-1	1	256.232	3.148	50	30		CGEAMM