Added 40 molecules from epoch 20787 for P23977

P23977_molecules.csv

@@ -41105,3 +41105,43 @@ rxn:2:75401:113297,CCc1ccc(NC2COc3cscc32)c2cnccc12,SUTCAQWRYWKYRA-UHFFFAOYSA-N
 rxn:2:77769:141008,COc1cc(NC2CCc3ccsc32)cc2nccnc12,KGPXJADARLIEDJ-UHFFFAOYSA-N
 rxn:2:78338:99104,COCc1cc2cc(NC3CCc4ncsc4C3)cnc2[nH]1,KYFGXLDQMYWRSQ-UHFFFAOYSA-N
 rxn:2:84121:112875,Cc1cc2ncc(NC3CC(C#Cc4cccs4)C3)cn2n1,PCQOJKHGOBHSEN-UHFFFAOYSA-N
+rxn:1:41917:3313,Cc1sccc1C#CCn1cc(-c2cc(C#N)c(F)cc2N)nn1,YVPYHLUHCALIIE-UHFFFAOYSA-N
+rxn:1:42016:20594,N#Cc1cc(C#CCn2cc(-c3cnc(Cl)cc3N)nn2)cs1,NZJSQJURCNLGPO-UHFFFAOYSA-N
+rxn:1:43683:1664,Cc1cc(-c2cn(CC#Cc3cc(Cl)ncc3Br)nn2)cc(C)c1N,FSXMIJZZAKXBKJ-UHFFFAOYSA-N
+rxn:1:44111:39089,Nc1cc(C#CCCn2cc(-c3ccc(Br)s3)nn2)cnc1O,DCALNBMJNPBKJY-UHFFFAOYSA-N
+rxn:1:47710:31895,COc1cc(C)c(-c2cn(-c3nccc4c(I)c[nH]c34)nn2)cn1,WXOXIATUXHGUBC-UHFFFAOYSA-N
+rxn:1:48364:39372,Cc1cc(-c2cn(CC(O)C(O)c3cc(I)c[nH]3)nn2)sc1C,RBBIMJJVFKKUBE-UHFFFAOYSA-N
+rxn:1:49432:27779,Cc1nc(-c2cn(C3(CI)CCNC3)nn2)nc2[nH]cnc12,DMGOKOSZJBBJRA-UHFFFAOYSA-N
+rxn:1:51959:1595,Nc1ccnc(Cl)c1C1CC1CCn1cc(-c2csc(Br)n2)nn1,FRJYNIXTZPIEOC-UHFFFAOYSA-N
+rxn:1:52479:7438,COc1ncc(-c2cn(Cc3csc(Br)n3)nn2)c(OC)n1,XHBZTUOVQPPLBJ-UHFFFAOYSA-N
+rxn:1:58686:31921,N#Cc1cc(-c2cn(CCCCc3ccsc3Cl)nn2)ccc1O,HTCMIGITUBAAES-UHFFFAOYSA-N
+rxn:1:59907:31836,COc1ccc(Br)cc1-n1cc(-c2cnc(C#N)cc2C)nn1,XSLACFYDIPLFKM-UHFFFAOYSA-N
+rxn:1:59915:30475,CCn1ncc(-c2cn(Cc3sc(Br)cc3Br)nn2)c1C,BSAXJTDUAPFLCB-UHFFFAOYSA-N
+rxn:1:59934:1429,Cc1sc(-c2cn(-c3ccc(CCN)cc3)nn2)cc1Br,YSBXMAQQHIAXML-UHFFFAOYSA-N
+rxn:1:60111:18607,Cc1ccccc1-n1cc(-c2cn(I)nn2)c(C)n1,PSHGOIIEAIAOMA-UHFFFAOYSA-N
+rxn:1:62178:2756,Cc1cc(Br)c(-c2cn(-c3ccc4c(c3)CNCC4)nn2)s1,YUOGPYXYMXTNKH-UHFFFAOYSA-N
+rxn:1:62588:31500,C[C@@H](N)c1ccc(-c2cn(C3CCCC3I)nn2)cc1Cl,KDEOHBDDAUVPJX-IFXDAHQISA-N
+rxn:1:62688:24202,CC(c1cn(-c2cc(I)cc(I)c2I)nn1)N1CC(O)C1,ASHAXDDJULYARL-UHFFFAOYSA-N
+rxn:1:65677:39011,Cc1cscc1C=CCn1cc(-c2cnc3cn[nH]c3c2)nn1,FNEANQAYMHMYSY-UHFFFAOYSA-N
+rxn:2:102045:106742,CSc1ccc2c(c1)CCC2Nc1ccnc2[nH]ncc12,KJVMFHRNVNTIQB-UHFFFAOYSA-N
+rxn:2:105227:83505,CSC1CCCC(Nc2cc3c(C)[nH]ccc-3nc2=O)C1,HPPMCAQSHYOSFB-UHFFFAOYSA-N
+rxn:2:107855:108204,Cn1c(=O)[nH]c2ccc(NC3CCc4cscc4C3)cc21,YLNJGYYACQHMHO-UHFFFAOYSA-N
+rxn:2:110094:131923,Cc1c(NC2CC(C)(C)C(C)(C)C2)cc2[nH]cnc2c1C,GWGROUAFMSCALW-UHFFFAOYSA-N
+rxn:2:110654:119925,CSc1sc(NC(C)c2cnc3c(c2)ncn3C)nc1C,OYNCNSKZWVJCSY-UHFFFAOYSA-N
+rxn:2:117866:72770,CC(CCc1ccsc1)Nc1cc(-c2cn[nH]c2)on1,YGKFLCMNMGYLAZ-UHFFFAOYSA-N
+rxn:2:129760:104190,Cc1c(NC2CC3(CCSCC3)C2)cnc2nccnc12,GCLJVTVOOOMHTP-UHFFFAOYSA-N
+rxn:2:134287:104190,Cc1ncc2cc(NC3CC4(CCSCC4)C3)cnc2n1,YEXZDJVTVQMOAV-UHFFFAOYSA-N
+rxn:2:139039:108204,c1cc2c(NC3CCc4cscc4C3)n[nH]c2nn1,ROHLRMNBKBLVGI-UHFFFAOYSA-N
+rxn:2:139108:72533,Cc1cncc2cc(NC3CCC4(C)CC34)cnc12,PJJZYYGDMZLVCZ-UHFFFAOYSA-N
+rxn:2:140004:88023,COc1cc2ncncc2cc1NC(C)c1cc[se]c1,GWMFZMZRSJRACB-UHFFFAOYSA-N
+rxn:2:144253:108204,Cc1c(NC2CCc3cscc3C2)cc2[nH]c(=O)[nH]c2c1C,BOXGIYWGBFAXQC-UHFFFAOYSA-N
+rxn:2:158085:118376,O=c1[nH][nH]c2c1cnc1ccc(NC3CCc4ccsc4C3)cc12,WQCHJANFQXNCHH-UHFFFAOYSA-N
+rxn:2:66708:137366,COc1nc2c(NC3CC(c4nccs4)C3)nsc2nc1C,XNXXQRMMFXMFSY-UHFFFAOYSA-N
+rxn:2:75161:167043,CC(NC1(C)CCSCC1)c1ccc(-c2cnc3nc[nH]c3c2)s1,FHOXGOXSQORKKY-UHFFFAOYSA-N
+rxn:2:75833:97954,Cc1nc2[nH]cnc2c(C)c1NCC1CCc2sccc21,XMWUCVDQHULSRA-UHFFFAOYSA-N
+rxn:2:78189:99490,Cc1cc(C)c2c(NC(C)c3cnc4nc[nH]c4c3)csc2n1,PJQOYHPJDRBZDD-UHFFFAOYSA-N
+rxn:2:79970:71450,Cc1nc(=S)cc(NC2CCC(C)c3ccsc32)[nH]1,BHWGOZUPPITAJR-UHFFFAOYSA-N
+rxn:2:88821:99490,Cc1sccc1C#CCCNC(C)c1cnc2nc[nH]c2c1,DPEDBKUCRKZLKV-UHFFFAOYSA-N
+rxn:2:90493:118131,Cc1cnc(C2CC(Nc3cnc4[nH]cnc4c3C)C2)s1,QGDNAWQDUQESFF-UHFFFAOYSA-N
+rxn:2:92106:102373,Cc1cc2[nH]cc(NC3CC(c4ccc(C)s4)C3)c2cn1,LEFIRKNHGZLNGM-UHFFFAOYSA-N
+rxn:2:94577:71323,CC(Nc1cc(C2CC2C)n[nH]1)c1ccc2nscc2c1,ZJBLJLDFYUKVHY-UHFFFAOYSA-N