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3589
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3595
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3601
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3604
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3607
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3620
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3623
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3627
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3632
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3635
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3639
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3640
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3643
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3657
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3731
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3736
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3737
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3800
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+ "##Oc2ccccc21": 3656,
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3806
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3809
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3831
+ "sc2c1CCC2": 3683,
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3838
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3841
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3842
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+ "NC2c3ccccc3": 3710,
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3867
+ "NCc3ccccc3Cl": 3719,
3868
+ "n2ccc3cc": 3720,
3869
+ "##c1ncn2C1CC": 3721,
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+ "COc1c2c": 3723,
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+ "CSc1nc2ccccc2c": 3724,
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+ "nc2ccccn12": 3726,
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+ "3c2": 3727,
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+ "3n2": 3728,
3877
+ "##sc3ccccc3": 3729,
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+ "cncc2Cl": 4095
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+ }
4245
+ }
4246
+ }
tokenizer_config.json ADDED
@@ -0,0 +1,15 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
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+ "clean_up_tokenization_spaces": true,
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+ "cls_token": "[CLS]",
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+ "do_basic_tokenize": true,
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+ "do_lower_case": true,
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+ "mask_token": "[MASK]",
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+ "never_split": null,
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+ "pad_token": "[PAD]",
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+ "sep_token": "[SEP]",
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+ "strip_accents": null,
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+ "tokenize_chinese_chars": true,
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+ "tokenizer_class": "BertTokenizer",
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+ "unk_token": "[UNK]"
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+ }
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458
+ ##nc12
459
+ ##c3ccccc32
460
+ C2CCN
461
+ ##C3
462
+ ##nc3cc
463
+ CC1CN
464
+ OC3
465
+ ##c4c
466
+ ##N1CCN
467
+ n2nc
468
+ cs1
469
+ NCc1ccccc1
470
+ ##2CCN
471
+ ##c1ncc
472
+ c23
473
+ c1ccc2
474
+ ##c2C
475
+ c4c
476
+ cc2F
477
+ c2cccs2
478
+ cc23
479
+ cccc2
480
+ C3CC3
481
+ ##O1
482
+ Cc1nn
483
+ n4
484
+ Nc1c
485
+ ##c3nc
486
+ Cc1cn
487
+ Nc3cc
488
+ c2nnc
489
+ ##CC5
490
+ ##1C2
491
+ ##2CN
492
+ ##CCN1
493
+ ##n2C
494
+ ##c12
495
+ Nc3cccc
496
+ ##CCOC
497
+ OCO4
498
+ Oc3ccc
499
+ CSc2
500
+ N1CCOCC1
501
+ cccc3
502
+ CCc1cc
503
+ CCc1ccccc1
504
+ c21
505
+ COc2ccc
506
+ c1cccnc1
507
+ nc12
508
+ cc1NC
509
+ Nc4ccc
510
+ ccc2c1
511
+ ##4ccccc4
512
+ COc1c
513
+ CCCC1
514
+ ##SCC
515
+ ##2Cl
516
+ ##sccc
517
+ CC1CC
518
+ c1cnc
519
+ ##nnn
520
+ c1cccs1
521
+ cc5
522
+ OC1C
523
+ Cc3cccc
524
+ c2ccco2
525
+ CN2C
526
+ N3CCC
527
+ C1CC1
528
+ Nc1ccc2c
529
+ c1ccco1
530
+ OCc2ccccc2
531
+ ##c32
532
+ nn3
533
+ c2ccncc2
534
+ ##2ccccc12
535
+ ##c4cccc
536
+ COc1ccc2
537
+ c1Cl
538
+ N2CCCC
539
+ Clc1ccc
540
+ ##CCCNC
541
+ c2cnc
542
+ ##2C3
543
+ Cn2c
544
+ Cc4ccccc4
545
+ ##nc3ccccc3
546
+ N2CCCCC2
547
+ NOC
548
+ NCCO
549
+ cnc2
550
+ ##CC3CC
551
+ NCc3ccc
552
+ ##3cc
553
+ ##Oc1ccc
554
+ c3cccnc3
555
+ n1c
556
+ CCCCCCCC
557
+ ##2ccccc2c1
558
+ N2CCCC2
559
+ CCCC3
560
+ ##CCCC4
561
+ C2CCCN
562
+ COc1ccccc1C
563
+ ##n1cc
564
+ C2OC
565
+ COC1
566
+ c2ccccn2
567
+ CCc1c
568
+ ##nc5
569
+ Nc2c
570
+ C1CCCCC1
571
+ c3nc4
572
+ c1cc2c
573
+ CN2CCN
574
+ Nc1ncc
575
+ cc32
576
+ ##c2ccccc2C
577
+ OCCCC
578
+ Cc4ccc
579
+ cccc1
580
+ c2ncc
581
+ C2CCC
582
+ c3ccc4c
583
+ CCOc1cc
584
+ CCCCC1
585
+ ccc23
586
+ c2nc3ccccc3
587
+ CN1CCC
588
+ Fc1ccc
589
+ ##OC2
590
+ ##O2
591
+ n2cn
592
+ NC4
593
+ ##N2
594
+ C23
595
+ C2C1
596
+ N3C
597
+ C3O
598
+ ##c3c2
599
+ ##CCCCC4
600
+ N1CCCC1
601
+ OP
602
+ oc2c1
603
+ CCCCNC
604
+ c5ccc
605
+ c3ccco3
606
+ C1CCC2
607
+ NCc2ccccc2
608
+ c2cc3c
609
+ c2cccc3
610
+ ##N1C
611
+ COP
612
+ CN1CC
613
+ NCC2
614
+ N4CCOCC4
615
+ N3CC
616
+ ##n3c
617
+ c3ccccc32
618
+ C1c1ccc
619
+ no2
620
+ sc2
621
+ ##OC1
622
+ cc3F
623
+ c3cccs3
624
+ ##5c
625
+ OCC1OC
626
+ ##sc2
627
+ cc3C
628
+ OCCC
629
+ nnc1
630
+ ccn1
631
+ cs2
632
+ c2ccccc2C
633
+ c5ccccc5
634
+ N5
635
+ ##1Cl
636
+ CNS
637
+ C2CCCCC2
638
+ sc2c1
639
+ N3CCCC3
640
+ ##2ccc
641
+ nc21
642
+ C1CN
643
+ ##3C2
644
+ Oc1ccccc1
645
+ c2ccccc2Cl
646
+ CCC1C
647
+ O3
648
+ Nc1n
649
+ c3ccncc3
650
+ no
651
+ cc1N
652
+ NC1C
653
+ ##c1nc2ccccc2
654
+ Oc2ccccc2
655
+ c1ccccc1C
656
+ nc2c
657
+ ccc1OC
658
+ CSC
659
+ OCC2
660
+ c1ncc
661
+ Cc3cc
662
+ OCc3ccccc3
663
+ c2c1C
664
+ cc2c
665
+ n1cc
666
+ FC
667
+ ##c1cn
668
+ Cc1noc
669
+ ##CCS
670
+ c1F
671
+ ##CCN1C
672
+ CN2CCC
673
+ nc4
674
+ cc1S
675
+ nc1C
676
+ ##c5ccccc5
677
+ S1
678
+ c2csc
679
+ ##sc1
680
+ Oc1cc
681
+ s3
682
+ c1ccncc1
683
+ NC1CCCCC1
684
+ CCC4C
685
+ c3C
686
+ ncnc32
687
+ oc2cc
688
+ ##c1ccc2c
689
+ CCn1cc
690
+ ##2CC
691
+ CCN1CCN
692
+ CCc2ccccc2
693
+ cc3Cl
694
+ CC1CCC
695
+ ccc1Cl
696
+ c1N
697
+ c2cc1OC
698
+ N3CCCCC3
699
+ N1CCCCC1
700
+ c3n2
701
+ ##CC3C
702
+ on1
703
+ c4ccccc34
704
+ c1nc2ccccc2
705
+ nc2cc
706
+ CC5
707
+ Cc1cnc
708
+ CCl
709
+ CCOc1ccccc1
710
+ ##n12
711
+ Oc2cc
712
+ OCCCN
713
+ ##2CCOCC2
714
+ Cc1ccc2
715
+ Cc1ccccc1C
716
+ n2cnc3c
717
+ Nc2ncc
718
+ c1nnc
719
+ CCCl
720
+ N4CCN
721
+ c1ccccc1Cl
722
+ ##nc1C
723
+ ##oc1
724
+ c3ccccn3
725
+ ccc2C
726
+ ##onc
727
+ c2ccccc2F
728
+ CNCC
729
+ cc3c2
730
+ ccc1N
731
+ ##1CC
732
+ ##c5ccc
733
+ CCc1
734
+ c3cn
735
+ Cc3c
736
+ C2CN
737
+ CCCS
738
+ c1NC
739
+ ##n2cc
740
+ c1ccccn1
741
+ C3CC
742
+ ##1CCC
743
+ ##1O
744
+ C3CCCCC3
745
+ ##oc2
746
+ CCCn1c
747
+ Cc1ncc
748
+ CSc1ccc
749
+ ##3nc
750
+ COCCN
751
+ ##nc2c1
752
+ CSc1nnc
753
+ Oc1cccc
754
+ c2C1
755
+ n3c
756
+ ##c2ccccc2c1
757
+ Nc1nnc
758
+ ##3c2
759
+ N1CCCC1C
760
+ cc2C1
761
+ ##c2ccccc2C1
762
+ ##CC4CC
763
+ ##sc3
764
+ ##23
765
+ ##21
766
+ N1CCC2
767
+ Nc2ccc3c
768
+ C2N
769
+ ccc32
770
+ ##1CCOCC1
771
+ Cn2cc
772
+ C4CC4
773
+ o3
774
+ Oc3ccccc3
775
+ c1cncc
776
+ ##nc23
777
+ nc3c2
778
+ OCc2ccc
779
+ CC1CCN
780
+ c2ccccc2C1
781
+ NCc3ccccc3
782
+ C3CCN
783
+ ##scc
784
+ n2ccc
785
+ ##3CCN
786
+ CCc1nc
787
+ c1csc
788
+ n3cc
789
+ c1nn
790
+ OCCO2
791
+ Cc3
792
+ ##c3ccccc3c2
793
+ ##o4
794
+ nc2ccccc12
795
+ NC2CCCCC2
796
+ CCCCCCCCC
797
+ c6
798
+ SC1
799
+ Cc1cc2c
800
+ Cn1nc
801
+ ##CCCO2
802
+ ##c23
803
+ NCc1cccc
804
+ ##s4
805
+ ##n3C
806
+ C1CC2
807
+ c3ncc
808
+ CC12
809
+ c3cnc
810
+ CC1CCCCC1
811
+ ##3CCOCC3
812
+ NC1CCN
813
+ c2ccccc2n1
814
+ ##CCCO1
815
+ NC1CCC
816
+ ##CC1C
817
+ C5CCC4
818
+ ON
819
+ cc3c
820
+ n3C
821
+ ##n23
822
+ CCCCC2
823
+ ccc1F
824
+ c2ccnc
825
+ OCCO3
826
+ NCCCCC
827
+ ##CCCCN
828
+ ##c2nnc
829
+ CN4
830
+ ##n2C1
831
+ C2SC
832
+ CON
833
+ c2cncc
834
+ ccc2n1
835
+ ##cnccc
836
+ nc32
837
+ CCc1cccc
838
+ c2O
839
+ Nc1ncnc2
840
+ ##S1
841
+ N3CCCC
842
+ c3cccc4
843
+ CSc2nnc
844
+ nc2ccccc21
845
+ CSc1nc
846
+ C3OC
847
+ Cc1nnc
848
+ ncnc2
849
+ COCCO
850
+ C4C
851
+ C1CCCN1C
852
+ ##3ccc
853
+ ##nc3ccc
854
+ ##ncc4
855
+ ##nc4ccccc4
856
+ OC2C
857
+ C12C
858
+ Cc2cn
859
+ c1cc2ccccc2
860
+ ##nc3c2
861
+ ##32
862
+ c1ccccc1F
863
+ OC2OC
864
+ ##ncn1
865
+ C5CCC43C
866
+ ##2CCCCC2
867
+ c2noc
868
+ ##c1ccccc1C
869
+ CSc1
870
+ COc1ccccc1N1CCN
871
+ cccc2Cl
872
+ c3n
873
+ c3ccccc3C
874
+ nn12
875
+ CC12CCC
876
+ c1sc
877
+ c1cc2cc
878
+ CCc2ccc
879
+ c1ccc2nc
880
+ Cc1csc
881
+ c2ncccc
882
+ c2F
883
+ ##nc21
884
+ CCCCCCCCCCCC
885
+ nc2n1
886
+ CCCCCCCCCCCCCCC
887
+ ##S2
888
+ ##NC1
889
+ cccc1Cl
890
+ n1Cc1ccc
891
+ Nc1ccccc1C
892
+ OS
893
+ sc
894
+ c2nc3c
895
+ ccc2OC
896
+ nc2ccc
897
+ cc2OC
898
+ Cc2ccc3c
899
+ CC1OC
900
+ ##3CC
901
+ ccc3c2
902
+ ##c4ccccc43
903
+ ##cnc2c
904
+ c2ccc3ccccc3
905
+ Oc2cccc
906
+ ##5C
907
+ c2cc3ccccc3
908
+ CCC12
909
+ ##CCC12C
910
+ CCCOc1ccc
911
+ nc3cc
912
+ ##c3ccccc3C2
913
+ c3ccccc3Cl
914
+ Si
915
+ CCC4C5
916
+ ##NS
917
+ c4c3
918
+ c34
919
+ Cn3
920
+ CCOP
921
+ COc1cc2nc
922
+ c2o
923
+ c2Cl
924
+ cc2s1
925
+ ##3ccccc23
926
+ ##oc3
927
+ ##3CCC
928
+ Cc1cccnc1
929
+ Nc3nc
930
+ c2sc
931
+ ##c1ncn2C1
932
+ COc1cc2
933
+ oc
934
+ ##c2ccccn2
935
+ ##Oc2ccc
936
+ NCC3
937
+ c3nc4ccccc4
938
+ c3ccc4
939
+ ##3C4
940
+ ##CC2C
941
+ c1cc2
942
+ oc2
943
+ c1ccc2ccccc2c1
944
+ OC4
945
+ COc3ccc
946
+ c2ccc3nc
947
+ cc2O
948
+ NCCc1ccccc1
949
+ cnn
950
+ c2s
951
+ Nc2nnc
952
+ oc12
953
+ ##cccc1C
954
+ C1C2
955
+ ##O3
956
+ N1N
957
+ OCC3
958
+ Cc1ccco1
959
+ cccc12
960
+ CNc1nc
961
+ c3ccccc3C2
962
+ c1s
963
+ NC2CCN
964
+ ccc34
965
+ CCc3ccccc3
966
+ ncn2
967
+ ##2CCCC2
968
+ c32
969
+ cccc4
970
+ cnc3
971
+ Cc1ccc2nc
972
+ Nc1ccc2
973
+ CSC1
974
+ N1c1ccc
975
+ ##3ccccc3c2
976
+ cc1Br
977
+ CCCCO
978
+ ##1CCCC1
979
+ ##OC3
980
+ nnc2
981
+ CC1CC1
982
+ cc34
983
+ c3nnc
984
+ cc3C2
985
+ Oc2c
986
+ CCCC4
987
+ ##O4
988
+ CCCc1cc
989
+ ##CCOCCO
990
+ CCc1n
991
+ C3CCC
992
+ C3CCC12C
993
+ NC1CCCC1
994
+ ##5ccccc5
995
+ CCC2C
996
+ Cn1ccc
997
+ ##CCCCCCCC
998
+ NCCc1ccc
999
+ c1o
1000
+ CCCCCCCCCCCCCCCC
1001
+ C6
1002
+ Cc1cccs1
1003
+ ##c2nc3ccccc3
1004
+ Nc2nccc
1005
+ ccc2F
1006
+ c1ccc2cc
1007
+ c1nc2c
1008
+ c2nc3cc
1009
+ c2ncn
1010
+ c2nnn
1011
+ NCc1cc
1012
+ CSCCC
1013
+ c2ccc3ccccc3c2
1014
+ ##c1nc2c
1015
+ ##OC4
1016
+ c1CC
1017
+ c2ccccc2c1
1018
+ CC3C
1019
+ ##n2c1
1020
+ CN2CC
1021
+ ##n1Cc1ccc
1022
+ NC1CC
1023
+ ##sc3c
1024
+ COc1ccccc1NC
1025
+ c2nccc
1026
+ ##c2cn
1027
+ N1CC2
1028
+ c1cccc2
1029
+ CN3CCN
1030
+ c3ccccc3F
1031
+ on2
1032
+ COc1nc
1033
+ ##4ccccc4c3
1034
+ Nc2ccccc2C
1035
+ CCNS
1036
+ ##nc4c
1037
+ ##3CCCCC3
1038
+ CO2
1039
+ OCc3ccc
1040
+ CC1O
1041
+ CCN2C
1042
+ ##c1cnc
1043
+ NCCNC
1044
+ CCCCCCCCCC
1045
+ CCSC
1046
+ C1c1ccccc1
1047
+ ##CCCO3
1048
+ ccc2Cl
1049
+ ##nc2n1
1050
+ c3nn
1051
+ nc23
1052
+ c2nc3
1053
+ OC2CCN
1054
+ ##nc4cc
1055
+ Nc3ncc
1056
+ cc2n1
1057
+ NC1CC1
1058
+ n2ncc
1059
+ ##c1nccc
1060
+ COC1C
1061
+ NCc1ccco1
1062
+ Nc4cc
1063
+ CC1CCCN
1064
+ c1ccccc1NC
1065
+ ncnc21
1066
+ CCCOC
1067
+ Cc2ccco2
1068
+ N4CCCC4
1069
+ ccc5
1070
+ Oc1c
1071
+ ccn2
1072
+ c1ccccc1O
1073
+ c3C2
1074
+ ##3CCCC3
1075
+ ##c3cc4c
1076
+ COCCNC
1077
+ CCCCCN
1078
+ ccc1NC
1079
+ C1c2ccccc2C
1080
+ c1cccc2ccccc12
1081
+ C4CC
1082
+ C1CCCC1
1083
+ CCCCn1c
1084
+ ##c2ncc
1085
+ ##cccc1
1086
+ COc2ccccc2
1087
+ ##ccccc45
1088
+ C21
1089
+ c4nc
1090
+ sc3
1091
+ ##N2C
1092
+ c2cnn
1093
+ C1c2ccccc2
1094
+ c4ccco4
1095
+ C2CCCN2C
1096
+ CC2CC2
1097
+ Nc3c
1098
+ Nc4ccccc4
1099
+ NCCS
1100
+ ccc1OCC
1101
+ ##1CCCCC1
1102
+ c1c2ccccc2
1103
+ ##occc
1104
+ cc1OCC
1105
+ ##CCOCC5
1106
+ c2cc3
1107
+ ##c6
1108
+ CCN1CC
1109
+ NCc2cc
1110
+ C1CCC2C3
1111
+ c3ccnc
1112
+ ##c3ccccc3C
1113
+ Cc1nc2
1114
+ cccc1C
1115
+ ##N1CC
1116
+ nn23
1117
+ ##c1ccccn1
1118
+ nc3c
1119
+ ##c1ncn2C1OC
1120
+ C2NC
1121
+ nc3ccccc23
1122
+ Cc2cccs2
1123
+ CF
1124
+ ccc2O
1125
+ ccc3C
1126
+ NC2CC2
1127
+ ##n5
1128
+ C2CC3
1129
+ ##2CO
1130
+ C4O
1131
+ c2ccccc2O
1132
+ CCCN1C
1133
+ Nc1nc2c
1134
+ c1ccn
1135
+ sc1
1136
+ ##N1CCC
1137
+ N2CCC3
1138
+ Cc1nc2c
1139
+ Nc4cccc
1140
+ ##c2ccc3c
1141
+ COc1ccc2cc
1142
+ C1CCC2C
1143
+ CCCc1c
1144
+ NC2CCCC2
1145
+ ##c3C
1146
+ ##ccccc13
1147
+ Oc1ccc2c
1148
+ cn4
1149
+ c1ccccc1N
1150
+ c2nc3ccc
1151
+ ##ccccc6
1152
+ NC3CCCCC3
1153
+ cnc1
1154
+ NCc4ccc
1155
+ ##c1nc2cc
1156
+ c3ccccc3n2
1157
+ N4CCC
1158
+ C2CCCC2
1159
+ CNc2nc
1160
+ c1ccccc12
1161
+ n2n1
1162
+ c4cccnc4
1163
+ CO1
1164
+ c3cncc
1165
+ CSc2nc
1166
+ c2cc3cc
1167
+ ncn1
1168
+ ##c2n
1169
+ c5cc
1170
+ nn1C
1171
+ Oc3cc
1172
+ ##c1cccnc1
1173
+ n1nc
1174
+ CCOc1cccc
1175
+ OCO5
1176
+ ##4CCOCC4
1177
+ c1S
1178
+ Cc2nc
1179
+ OCCO4
1180
+ ##nn3
1181
+ CP
1182
+ CSCC
1183
+ Cc2cccnc2
1184
+ c3cnn
1185
+ N2CC3
1186
+ NCCCCN
1187
+ ##2OC
1188
+ O4
1189
+ NP
1190
+ c3F
1191
+ CC1NC
1192
+ cccc1F
1193
+ NCc2cccc
1194
+ C2C3
1195
+ Nc1cccnc1
1196
+ CC12C
1197
+ C3CCCC3
1198
+ ##N1CCOCC1
1199
+ ##c2cccnc2
1200
+ c1cnn
1201
+ CCN1CCC
1202
+ n2ccnc2
1203
+ c2OC
1204
+ CC21
1205
+ Nc4
1206
+ c2cccc3ccccc23
1207
+ SC2
1208
+ nc1N
1209
+ c1nnn
1210
+ n3nc
1211
+ C2S
1212
+ ##C1CCN
1213
+ ##2CC3CC
1214
+ ##c3ccccn3
1215
+ ##c3nnc
1216
+ c3ccccc3c2
1217
+ ##2CCC1
1218
+ CCCCC3
1219
+ c1ccccc1C2
1220
+ N1CCc2c
1221
+ Nc1nccs1
1222
+ ##CCCC5
1223
+ nc2C
1224
+ Cn1cn
1225
+ NCc2ccco2
1226
+ NCCCO
1227
+ ##n2nc
1228
+ c4ccncc4
1229
+ ##4ccc
1230
+ cccc3Cl
1231
+ Cn3c
1232
+ nc3ccc
1233
+ ##ncn2
1234
+ S2
1235
+ c3nccc
1236
+ C1CCC1
1237
+ Cc1ccccc1NC
1238
+ ##n1ccc
1239
+ CNc1ccc
1240
+ sc1C
1241
+ ##4cc
1242
+ cc2cc
1243
+ ##n2ccc
1244
+ NCCc2ccc
1245
+ cc3OC
1246
+ CCO2
1247
+ Cc1nc2ccccc2
1248
+ c3ncccc
1249
+ c4ccccn4
1250
+ C1CO
1251
+ C1C2C
1252
+ CN3CCC
1253
+ CC2CCCCC2
1254
+ CCCCOC
1255
+ NC3CC3
1256
+ CCNCC
1257
+ Cc2cnc
1258
+ COCC1
1259
+ Nc1nccc
1260
+ COc1
1261
+ N4CCCCC4
1262
+ ##OCCO
1263
+ ##CN1
1264
+ ##CCCC1C
1265
+ Oc2nc
1266
+ ccc2c
1267
+ c5cccc
1268
+ ##4CCC
1269
+ CSC2
1270
+ ##4c3
1271
+ OCc4ccccc4
1272
+ COc1cccc2
1273
+ CCCCOc1ccc
1274
+ ##n2CC
1275
+ N3CCNCC3
1276
+ c4cnn
1277
+ NCC1CN
1278
+ NCC1CCCO1
1279
+ ##sc2c
1280
+ ##4C3
1281
+ Oc2
1282
+ OCCCO
1283
+ CC3CC3
1284
+ OC1CC
1285
+ n2c1
1286
+ CCCCCCN
1287
+ COc1ccc2nc
1288
+ NCCc1c
1289
+ ##nn1
1290
+ c1nc2cc
1291
+ n1CC
1292
+ c1ccccc1S
1293
+ OCc1ccc
1294
+ ##ncn3
1295
+ Cc1oc
1296
+ NCCc2ccccc2
1297
+ ##n1ccnc1
1298
+ Oc4ccc
1299
+ c2N
1300
+ n3n2
1301
+ Nc3ccc4c
1302
+ c2ccccc2S
1303
+ ##CCCCC1C
1304
+ Cn1cncn1
1305
+ ##6C
1306
+ Cn1ncc
1307
+ Sc2ccc
1308
+ Fc1cccc
1309
+ ##CCCCCC1
1310
+ c1ccnc
1311
+ NC2CCC
1312
+ c4nc5
1313
+ Cc1ccnc
1314
+ ncc1
1315
+ oc1
1316
+ ##c1ccccc1Cl
1317
+ cn2C
1318
+ OCc2
1319
+ c3cc4c
1320
+ c1nc2
1321
+ c5c
1322
+ Clc1cccc
1323
+ CC1c1ccc
1324
+ C3C2
1325
+ ##ns
1326
+ C1SC
1327
+ ##nn2C
1328
+ CN1CCC2
1329
+ N2CCNCC2
1330
+ ##no
1331
+ ##3CC4CC
1332
+ CCCCCNC
1333
+ cnc12
1334
+ ##nc2C
1335
+ CSc1n
1336
+ cccc2c1
1337
+ CCc1nnc
1338
+ c3cc4ccccc4
1339
+ ##c4ccccc4C3
1340
+ c3c2C
1341
+ OC3OC
1342
+ CCN2
1343
+ Cc1cc2
1344
+ c1C1
1345
+ CC1CCCC
1346
+ ##CCCCCC2
1347
+ CNC1
1348
+ ##nc32
1349
+ n3ccc
1350
+ C1CCS
1351
+ cc4F
1352
+ N1Cc1ccc
1353
+ cccc21
1354
+ NN2C
1355
+ CCC5
1356
+ c2ccccc2OC
1357
+ ##3CN
1358
+ ##ncn
1359
+ co2
1360
+ Cc1ccncc1
1361
+ C4CCC3
1362
+ c1nccc
1363
+ COc3ccccc3
1364
+ C3CCCN
1365
+ N3CC4
1366
+ N4C
1367
+ ##CC2CCC
1368
+ OCc2cc
1369
+ ##CCOc1ccc
1370
+ cn12
1371
+ Oc4ccccc4
1372
+ CCCc1ccc
1373
+ ##n1nc
1374
+ n12
1375
+ Cc4cccc
1376
+ CCNc1nc
1377
+ cccc2C
1378
+ ccc3n2
1379
+ c1nc2ccc
1380
+ N2CCCC2C
1381
+ c1cnccn1
1382
+ ##sc4
1383
+ ##nc3ccccc23
1384
+ Cc2ccccc2Cl
1385
+ COc1cccc2c1
1386
+ Cc2nnc
1387
+ CNc2ccc
1388
+ c2ccsc2
1389
+ CCn1nc
1390
+ C23CC4CC
1391
+ c2sccc
1392
+ cc1CN
1393
+ N1CCCN
1394
+ c2cc1
1395
+ ##c2cc3c
1396
+ CCOCC
1397
+ NCCN1
1398
+ c4cccs4
1399
+ CC2CC
1400
+ Cc3ccccn3
1401
+ Nc1nc2ccc
1402
+ cccc2F
1403
+ c1Br
1404
+ COCCC
1405
+ N2CCCN
1406
+ ##CC1CC1
1407
+ ##sc1C
1408
+ ##c1cc2c
1409
+ CBr
1410
+ ##4CC5
1411
+ ##CCCCCC
1412
+ c3ccoc3
1413
+ ncnc2cc
1414
+ c2ccc3ncc
1415
+ c1c2c
1416
+ C1CSC
1417
+ Cn2nc
1418
+ ##4ccccc4n3
1419
+ no3
1420
+ oc2c
1421
+ CCc2c
1422
+ cccc3F
1423
+ CCc3ccc
1424
+ CC2C1
1425
+ c3ccccc3OC
1426
+ Nc2nc3ccccc3
1427
+ N2CCCCCC2
1428
+ CN2CCOCC2
1429
+ CCCCCCCCCCCCCC
1430
+ COc1ncc
1431
+ ##CCN2C
1432
+ ##N1CCCC1
1433
+ CC2CN
1434
+ CCCCc1ccc
1435
+ ##2ncnc
1436
+ nn2C
1437
+ nc3ccccc32
1438
+ Cc1onc
1439
+ c4ccccc43
1440
+ Cn1ccnc1
1441
+ c2c3c
1442
+ ##noc
1443
+ ##c3cccc4
1444
+ c2no
1445
+ ##oc2c1
1446
+ ##OC1C
1447
+ c5c4
1448
+ ##CC6
1449
+ C2c3cc4c
1450
+ CC1N
1451
+ CC1CCC2
1452
+ ##n3c2
1453
+ ##CCCOc1ccc
1454
+ c1ccccc1OC
1455
+ ##CCCCC2C
1456
+ c4cnc
1457
+ noc2C
1458
+ OCCCCC
1459
+ ##c1cc1
1460
+ NC4CC4
1461
+ ##c1ccncc1
1462
+ Nc1nc2cc
1463
+ CCC1CC
1464
+ cc2NC
1465
+ ##nnnc1
1466
+ ##n1Cc1ccccc1
1467
+ COc2cccc
1468
+ Cc1cnn
1469
+ c1OCC
1470
+ NCc1cccnc1
1471
+ Cn2cn
1472
+ sc4
1473
+ ##34
1474
+ ##Nc1ccc
1475
+ ##nc43
1476
+ C12CC3CC
1477
+ ##c1nc2
1478
+ OCc2cccc
1479
+ Nc1ccccc1Cl
1480
+ ##sc2nc
1481
+ C3CCC3
1482
+ c3ccc4ccccc4c3
1483
+ n2nn
1484
+ C1CCCN1
1485
+ cs3
1486
+ ##4CCCC4
1487
+ C3CN
1488
+ c3ccsc3
1489
+ Cc2ccccc2F
1490
+ N1CCc2cc
1491
+ c2nc3ccccc3s2
1492
+ cc2N
1493
+ N2N
1494
+ C1Nc2ccc
1495
+ CC1CCC2C
1496
+ ##n1CC
1497
+ n2cccc
1498
+ nc2N
1499
+ cnc1C
1500
+ CCc2cc
1501
+ CCN2CCN
1502
+ NC3CCCC3
1503
+ ##3cccc
1504
+ C1c1cccc
1505
+ n1ccc
1506
+ CN3CCOCC3
1507
+ oc3
1508
+ ##OC2C
1509
+ ccc2O1
1510
+ ##CN1C
1511
+ Cc2ccncc2
1512
+ c3nc4cc
1513
+ C2CCC2
1514
+ NC3CCN
1515
+ ccc43
1516
+ NCC2CCCO2
1517
+ ##c1nn
1518
+ cc3n2
1519
+ COc1cc2ncnc
1520
+ COC1OC
1521
+ c4ccccc4C
1522
+ ##c5cc
1523
+ n1Cc1ccccc1
1524
+ N5CCN
1525
+ Cn3cc
1526
+ CCC3C
1527
+ c1C2
1528
+ COc1ccccc1CNC
1529
+ ##n2ccnc2
1530
+ COc2cc
1531
+ ##n3cc
1532
+ CN2CCCCC2
1533
+ c2ccc3cc
1534
+ Nn1c
1535
+ Oc1nc
1536
+ ccc2C1
1537
+ ccc2cc
1538
+ ncc1C
1539
+ Cc5ccccc5
1540
+ ##2S
1541
+ ##cccnc23
1542
+ CCC1OC
1543
+ NCc1ccc2c
1544
+ CCCc1ccccc1
1545
+ ##c2cnc
1546
+ ##nc34
1547
+ Nc2ccc3
1548
+ nc2ccccc2c1
1549
+ ##oc4
1550
+ ##5cc
1551
+ CO3
1552
+ ##n1C1
1553
+ cc3s2
1554
+ nc2c1c
1555
+ c2ncnc
1556
+ CCCN1
1557
+ CN2CCCC
1558
+ Cc3cccnc3
1559
+ Se
1560
+ ##2c3c
1561
+ NC2C
1562
+ C4CCCCC4
1563
+ SCc2ccc
1564
+ ##c5cccc
1565
+ CCc1cc2c
1566
+ Nc2nccs2
1567
+ ##CCN1CCN
1568
+ CCO1
1569
+ c4ccc5c
1570
+ sc2n1
1571
+ N5CCOCC5
1572
+ CCc1nn
1573
+ oc2ccc
1574
+ nc2s1
1575
+ cccc23
1576
+ NC2CC
1577
+ CN2CCCC2
1578
+ Oc2ccc3c
1579
+ ccc4c3
1580
+ Nc3ccccc3C
1581
+ ##c1ccccc12
1582
+ COc1cc2cc
1583
+ CC4C
1584
+ C3COC
1585
+ Cc4cc
1586
+ NCCC1
1587
+ c2ncnc3
1588
+ ##nc4ccc
1589
+ Nc1ccccn1
1590
+ Cn2ccc
1591
+ CC12CCC3C
1592
+ c2ncccn2
1593
+ nnc3
1594
+ c2cc1C
1595
+ COc1ccccc1N
1596
+ c3Cl
1597
+ n1N
1598
+ ##CCCN1C
1599
+ Cn1cnc
1600
+ Nc1nc2ccccc2
1601
+ sc3c2
1602
+ C32
1603
+ c1nc2ccccc2s1
1604
+ Cc1cc2cc
1605
+ Cc1ccccn1
1606
+ nc1O
1607
+ ##scn
1608
+ CNc1cc
1609
+ ccc1Oc1ccc
1610
+ ##2ccccc2n1
1611
+ ##4nc
1612
+ COC3
1613
+ ##nc2N
1614
+ ccc2o1
1615
+ NN1C
1616
+ Nc1cc2c
1617
+ cc4c3
1618
+ NCCN1CCOCC1
1619
+ ##C4
1620
+ ##c2nn
1621
+ Cc1nc2cc
1622
+ Cc1ccccc1N
1623
+ c2nnc3
1624
+ n2CC
1625
+ ccc3OC
1626
+ Cc3ccco3
1627
+ COCCn1c
1628
+ ##4CC5CC
1629
+ nc3ccccc3c2
1630
+ ##nn2
1631
+ c1sccc
1632
+ OC5
1633
+ Cc1ccsc1
1634
+ c1ccsc1
1635
+ cnn2
1636
+ ##1C2CCC2
1637
+ CC2O
1638
+ NCCc3ccc
1639
+ OC1CCC2
1640
+ NCCCNC
1641
+ cc1C1
1642
+ CCCc1nc
1643
+ ##CCCCC5
1644
+ CNC2
1645
+ ccc2N
1646
+ C2C3C
1647
+ nc3n2
1648
+ C12CCC
1649
+ Cc1sc
1650
+ CC2CCC
1651
+ Cc2ccccn2
1652
+ c2cnccn2
1653
+ ##c1c2c
1654
+ c3O
1655
+ CN1CCCC1
1656
+ CCCCCO
1657
+ OCC2C
1658
+ cc43
1659
+ C2CO
1660
+ ##c1cc1n
1661
+ co1
1662
+ ##1CC1
1663
+ Cc1ccc2ccccc2c1
1664
+ ##nc1O
1665
+ ##c1nc2ccc
1666
+ NCc3cccc
1667
+ Cc1ccc2cc
1668
+ CCOCC1
1669
+ c1noc
1670
+ N3CCCCCC3
1671
+ ##4CCN
1672
+ ##c2c3c
1673
+ c1cccc2c
1674
+ ccc3F
1675
+ ##c2ncccc
1676
+ ##NC2
1677
+ OCCOC
1678
+ Cc1ccccc1Cl
1679
+ NCCN2
1680
+ n3ccnc3
1681
+ cnc
1682
+ nnc12
1683
+ ##n1cnc2c
1684
+ COc1ccccc1CN
1685
+ Nc1ccccc1F
1686
+ NC12CC3CC
1687
+ n2C1
1688
+ C1CCCC
1689
+ CSc2ccc
1690
+ c5ccccc45
1691
+ N4CC
1692
+ Cc3ccc4c
1693
+ OCc2c1cc1n
1694
+ ##SC1
1695
+ CC1C2
1696
+ C3N
1697
+ ##CC1CC
1698
+ n3ncc
1699
+ CC1CO
1700
+ c3noc
1701
+ n4c
1702
+ CN5
1703
+ ##c1ncnc2
1704
+ Nc2ccccn2
1705
+ NCCCCCC
1706
+ NC1CN
1707
+ c2ccn
1708
+ c3ncnc4
1709
+ ##2cccnc12
1710
+ ##c3cn
1711
+ N2C1
1712
+ CC1C3
1713
+ ##CCN1CCC
1714
+ Brc1ccc
1715
+ Nc2ccccc21
1716
+ ##CCOC1
1717
+ NCc3ccco3
1718
+ ##n1cn
1719
+ Cc1ccccc1O
1720
+ ##1OCCCN
1721
+ OCOC
1722
+ c2ccccc2N
1723
+ CCN2CCC
1724
+ ##c3ncnc
1725
+ 2c
1726
+ Nc5ccc
1727
+ NCc1c
1728
+ CCCc2ccccc2
1729
+ CN3C
1730
+ CN1CCOCC1
1731
+ c1cnc2c
1732
+ Cc1nc2ccc
1733
+ cc1NS
1734
+ Sc2ccccc2
1735
+ ##4CC
1736
+ ##c3cnc
1737
+ ##N1CCCCC1
1738
+ NCc1ccccn1
1739
+ cc2o1
1740
+ Cc1cccc2ccccc12
1741
+ nn4
1742
+ oc3c2
1743
+ ##occ
1744
+ ##NCC
1745
+ ccn3
1746
+ N1c2ccccc2
1747
+ NCCc3ccccc3
1748
+ CCCN1CCN
1749
+ Nc1ccncc1
1750
+ cc4C
1751
+ ##c3ccncc3
1752
+ oc2ccccc12
1753
+ ccc3c
1754
+ CCON
1755
+ OC2CC
1756
+ ncc2
1757
+ ##c3nc4ccccc4
1758
+ CCCCS
1759
+ CSc1ccccc1
1760
+ ccc3Cl
1761
+ NO1
1762
+ N1Cc1ccccc1
1763
+ ##OO4
1764
+ C2c2ccc
1765
+ CCN3C
1766
+ CCC12C
1767
+ Cc5ccc
1768
+ n5
1769
+ ##2c1C
1770
+ ##oc2cc
1771
+ ##4CC4
1772
+ CC1CC2
1773
+ ##c1ccnc2cc
1774
+ C4CCN
1775
+ ccc3o2
1776
+ SCCC
1777
+ ##OCCN
1778
+ ##SC2
1779
+ ##5c4
1780
+ COc1n
1781
+ Nc3nccc
1782
+ Cc4c
1783
+ ##c3c1
1784
+ C2CCCC
1785
+ ##nc2ccccc12
1786
+ Cn2ccnc2
1787
+ ##c1cncc
1788
+ C13
1789
+ N12
1790
+ CC2CCC1
1791
+ CSc1nc2ccccc2
1792
+ Cn1c2c
1793
+ ##c5c
1794
+ OC2C1
1795
+ n1cn
1796
+ c3ccccc3O
1797
+ CCOc2ccc
1798
+ Cn1cnc2c
1799
+ ##nc6
1800
+ ##ccccc21
1801
+ C2CCC3
1802
+ ##CC1O
1803
+ NCc2ccc3c
1804
+ cnc23
1805
+ c2cn1
1806
+ nc2c1C
1807
+ CN3CCCCC3
1808
+ COC2
1809
+ N1CCCCCC1
1810
+ cnc32
1811
+ N1c1ccccc1
1812
+ ##C2CC2
1813
+ SCc2ccccc2
1814
+ ##1NC
1815
+ ##OCC2
1816
+ ##oc3cc
1817
+ c4ncc
1818
+ ##c2ccncc2
1819
+ n1ccnc1
1820
+ c3ncccn3
1821
+ ##n2cn
1822
+ CCO3
1823
+ CC3C2
1824
+ nc2n
1825
+ CCCCN1C
1826
+ ##4CCCCC4
1827
+ cc6
1828
+ OC1OC
1829
+ ##sc4c
1830
+ NCc4ccccc4
1831
+ C3CCC2
1832
+ CCN3
1833
+ C1Cc2ccccc2
1834
+ NC1c2ccccc2
1835
+ Cc2nc3ccccc3
1836
+ ##3ccccc3n2
1837
+ CCOc1ccccc1C
1838
+ nccc
1839
+ ##2oc
1840
+ CCn2c
1841
+ ##c3ncc
1842
+ cc1C2
1843
+ OCC1C
1844
+ n3c2
1845
+ n3cccc
1846
+ NCc1cccs1
1847
+ NCc2cccnc2
1848
+ C1c2cc
1849
+ ##CC4C
1850
+ N2CCc3c
1851
+ CN3CCCC3
1852
+ C1CCC2C3CCC4
1853
+ CS2
1854
+ c2cs
1855
+ CCOC1
1856
+ Nc2cn
1857
+ Cc2cccc3ccccc23
1858
+ 1ccc
1859
+ NC5
1860
+ C23C
1861
+ CC1c1ccccc1
1862
+ c3ccccc31
1863
+ Nc1cnc
1864
+ ##onc1
1865
+ cc2c1C
1866
+ n1ncc
1867
+ Cc1ccccc1F
1868
+ c3cccc4ccccc34
1869
+ CC2CCN
1870
+ ##C1CC
1871
+ NC3CCC
1872
+ ##c34
1873
+ cc3O
1874
+ c4C
1875
+ c1cc2ccc
1876
+ Cc2ccccc2C
1877
+ c4ccccc4F
1878
+ CCn1ccc
1879
+ CN2CCC3
1880
+ cn23
1881
+ Sc1nnc
1882
+ c2oc
1883
+ Nc1cccc2ccccc12
1884
+ Clc1ccc2c
1885
+ Oc3cccc
1886
+ c3nnn
1887
+ OCc1cc
1888
+ N3CCC4
1889
+ Nc2cccnc2
1890
+ 2cc
1891
+ CCC1CN
1892
+ c4n3
1893
+ n2N
1894
+ CCCCc1nc
1895
+ NNS
1896
+ c4ccccc4c3
1897
+ OCCNC
1898
+ ##sc2c1
1899
+ cc13
1900
+ ##CCCN1
1901
+ C1Cc2c
1902
+ Cc3ccccc3F
1903
+ C2c3ccccc3
1904
+ ##CCCCCC3
1905
+ ##c1ncn2C
1906
+ c1cn2c
1907
+ CCCCCCNC
1908
+ n1cnc
1909
+ CCOc1ccccc1NC
1910
+ se
1911
+ c3ccccc3S
1912
+ c2cnc3c
1913
+ Nc2ccccc2Cl
1914
+ c3s2
1915
+ cc2nc
1916
+ NNc1ccc
1917
+ Nc1cn
1918
+ C1NCC
1919
+ CCC43C
1920
+ nnc1SCC
1921
+ ccc1Nc1ncc
1922
+ ##Sc2ccc
1923
+ ##CC2CC
1924
+ Nc2c3ccccc3
1925
+ ncc2c1
1926
+ n2Cc2ccc
1927
+ ##c1ccc1
1928
+ NCCC2
1929
+ CNCCC
1930
+ cc2N1
1931
+ ##ccccc32
1932
+ cc3o2
1933
+ c4cn
1934
+ c2cc3nc
1935
+ ##CC12
1936
+ ##nn3C
1937
+ Nc1sc2c
1938
+ C5C
1939
+ COCc1cc
1940
+ ##CC2CC2
1941
+ c1coc
1942
+ c2cccc3c
1943
+ Cn1nnc
1944
+ ##CCN1CC
1945
+ Nc1ncnc2c1ncn2C1OC
1946
+ Nc1ccc2nc
1947
+ NCCc2c
1948
+ CC3CCCCC3
1949
+ Cc1ccccc1OC
1950
+ CCCN1CCC
1951
+ nc3C
1952
+ ##2CCC1CC
1953
+ CNc2cc
1954
+ c1ccccc1Br
1955
+ C4CCC
1956
+ CCCN2C
1957
+ nc3ccccc13
1958
+ Nc1cc2
1959
+ ncn3
1960
+ Cc2csc
1961
+ CCC1C32
1962
+ N1CC1
1963
+ N4CCCC
1964
+ Cc1ccc2oc
1965
+ c6ccc
1966
+ ##sc12
1967
+ NCC1C
1968
+ cc4Cl
1969
+ CC4CC4
1970
+ CCOc1ccc2c
1971
+ C5CC5
1972
+ ncc12
1973
+ n2cccn2
1974
+ c1oc
1975
+ Cc1cc2nc
1976
+ c2s1
1977
+ Cc1cncc
1978
+ ccnc2c1
1979
+ ccc2ccccc12
1980
+ c2cnc3
1981
+ OC3OC4
1982
+ ##CCN2
1983
+ NN2
1984
+ CN1CCCCC1
1985
+ CCSc1nnc
1986
+ cnc21
1987
+ s4
1988
+ CCC3C4
1989
+ ##c2ccccc2O1
1990
+ ##CCO2
1991
+ Cc2ccc3ccccc3c2
1992
+ c1CN
1993
+ Nc1ccn
1994
+ c1ncnc2
1995
+ CCC1C32OO4
1996
+ COCCCNC
1997
+ OCc3cccc
1998
+ CC2OC
1999
+ ##c1ccccc1F
2000
+ ##c4nc
2001
+ NN1
2002
+ ##cnnn2
2003
+ cnn1
2004
+ ##CCOC3
2005
+ N2c2ccc
2006
+ CCOc1c
2007
+ ##CCCN2
2008
+ NCC1OC
2009
+ c2nccs2
2010
+ c4cncc
2011
+ CCNCC2
2012
+ ##c3ccccn23
2013
+ Cc3cccs3
2014
+ COc2ccc3c
2015
+ ##4ccccc34
2016
+ ##Sc1ccc
2017
+ C3CCOCC3
2018
+ ##C12
2019
+ nc34
2020
+ SCc3ccccc3
2021
+ ##n4cc
2022
+ NCC3CCCO3
2023
+ Nc3nccs3
2024
+ ##n4c
2025
+ ccc3N
2026
+ NOCC
2027
+ N2CCc3ccccc3C2
2028
+ ##CCOC2
2029
+ cccc32
2030
+ OCC2CC2
2031
+ C1c2c
2032
+ Cn1c2ccccc2
2033
+ c3csc
2034
+ c1cc2ccccc2o1
2035
+ NCc2c
2036
+ CSc1cccc
2037
+ nn3C
2038
+ ##S3
2039
+ CCCc3ccccc3
2040
+ ##c2ccccc2N
2041
+ CC32
2042
+ cn1C
2043
+ CC2CCC1N2C
2044
+ C2c2ccccc2
2045
+ c1cccc2c1
2046
+ nc2nc
2047
+ cc4c
2048
+ n4cc
2049
+ c4nc5ccccc5
2050
+ CNCCN
2051
+ Cc1sc2nc
2052
+ Nc2nc3c
2053
+ Nc2ccccc2F
2054
+ CSc2nc3ccccc3
2055
+ CCCn1
2056
+ N1CCc2ccccc21
2057
+ CCCCCCCCCCCCC
2058
+ c3ncnc
2059
+ cnc2N
2060
+ Oc1ccccc1C
2061
+ Sc3ccc
2062
+ oc3cc
2063
+ sc2nc
2064
+ ##c3ccccc3n
2065
+ CCCC1C
2066
+ NNc1nc
2067
+ NCCN1C
2068
+ c1cnc2ccc
2069
+ ##ncc3cc
2070
+ cnc2c1
2071
+ cncc
2072
+ ##2n1
2073
+ ##5ccc
2074
+ OCc3c
2075
+ C2CCC1
2076
+ cccc3C
2077
+ NC1c1ccc
2078
+ NCCN2CCOCC2
2079
+ ##c1noc
2080
+ NCCCN1CCOCC1
2081
+ cn3C
2082
+ CCc1ccccc1NC
2083
+ cc1Nc1nc
2084
+ ##Oc1ccccc1
2085
+ c13
2086
+ ##c1cccc2ccccc12
2087
+ SCCN
2088
+ ##5ccccc45
2089
+ c2O1
2090
+ NCc4cccc
2091
+ OCc2c
2092
+ CCC3C2
2093
+ Cn1cccc1C
2094
+ c2c1CC
2095
+ N3CCCC3C
2096
+ ##c1c2ccccc2
2097
+ ##c3n
2098
+ Clc1ccccc1
2099
+ ##c1ccnc
2100
+ c2cnn3
2101
+ CCC21
2102
+ N2CCc3ccccc32
2103
+ COCCOC
2104
+ ##nc5ccccc5
2105
+ Cc3ccncc3
2106
+ c2ccccc2Br
2107
+ Cc6
2108
+ CN1CCCC
2109
+ c2ccccc2C3
2110
+ COCc2ccccc2
2111
+ ccc2N1
2112
+ c4ccccc4Cl
2113
+ c2cn3c
2114
+ Nc3ccccc32
2115
+ OC1CCC
2116
+ N1CCc2ccccc2C1
2117
+ CCCCCCCCCCCCCCCCCC
2118
+ C1CCC2C3CC
2119
+ c3c1
2120
+ OCc3cc
2121
+ ##NC3
2122
+ c2ccccc2S1
2123
+ C3SC
2124
+ NCCOC
2125
+ C1COC
2126
+ CCCCCCCN
2127
+ C5O
2128
+ Cc2ncc
2129
+ CCc1nc2c
2130
+ n2cccc2
2131
+ n4C
2132
+ ##oc2c
2133
+ CCN2CCOCC2
2134
+ ##CC3CCC
2135
+ SCc3ccc
2136
+ NCCN3
2137
+ Oc1ccc2
2138
+ NCC1CCN
2139
+ ##N2CCOCC2
2140
+ c1nccs1
2141
+ ##cc2
2142
+ c3OC
2143
+ C1S
2144
+ c2ccccc2NC
2145
+ c4ncccc
2146
+ C3CCC4
2147
+ c2cc3ccc
2148
+ CNC3
2149
+ ##CCCN2C
2150
+ c4ccccc4C3
2151
+ NCCN3CCOCC3
2152
+ C1Nc2ccccc2C1
2153
+ Cn2nn
2154
+ NCCCCCCCC
2155
+ Oc3
2156
+ o4
2157
+ CCCCCCO
2158
+ C1CCCC2
2159
+ ##CCCCC3C
2160
+ ##nc3n
2161
+ cccc5
2162
+ NO2
2163
+ CCC32
2164
+ ncc3
2165
+ CN3CC
2166
+ ##2C3CCC4
2167
+ oc1C
2168
+ oc2C
2169
+ sc2cc
2170
+ CNc2
2171
+ ##OC5
2172
+ c2ccoc2
2173
+ COc1cccc2c
2174
+ ccc3O
2175
+ ccc45
2176
+ c2cc3ccccc3o2
2177
+ Nn2c
2178
+ NCc2ccccn2
2179
+ OC3C
2180
+ c1ccoc1
2181
+ ##c2ccnc3cc
2182
+ ##nc4c3
2183
+ N1Cc2ccccc2
2184
+ ##4C5
2185
+ Cc2cc3c
2186
+ NCC1CCC
2187
+ CN4CCN
2188
+ 1cccc
2189
+ oc4
2190
+ ##n4C
2191
+ ##N3
2192
+ N2CCO
2193
+ NC23CC4CC
2194
+ Nc1nc2
2195
+ C1CCc2c
2196
+ CCc1ccc2c
2197
+ ##c2sc
2198
+ CCCCCC1
2199
+ c2ccccc23
2200
+ CC21C
2201
+ CS1
2202
+ C4CCCC4
2203
+ n4ccc
2204
+ c3cnccn3
2205
+ Fc1cc
2206
+ OO1
2207
+ COS
2208
+ COCCCN
2209
+ ##ccccc24
2210
+ Clc1cc
2211
+ COCc1ccccc1
2212
+ CSc1ncc
2213
+ CCOc1nc
2214
+ c2c1CN
2215
+ Cc3ccccc3Cl
2216
+ c1ccc2oc
2217
+ NCc1ccncc1
2218
+ C1CCC2C3C
2219
+ ##nc2ccc
2220
+ ##c3ccccc3c
2221
+ Cc1cc2ccccc2
2222
+ ncnc43
2223
+ ##CCN1S
2224
+ ##CCCNC2
2225
+ N4CCNCC4
2226
+ CN4CCOCC4
2227
+ ##oc1C
2228
+ c3sccc
2229
+ cc2C2
2230
+ CCCCCOC
2231
+ CCc1ncnc
2232
+ Nc4c
2233
+ CCCCC4
2234
+ N2CC2
2235
+ NCc1ccccc1Cl
2236
+ c4nccc
2237
+ ##c1ncccc1C
2238
+ NCc2cccs2
2239
+ Nc3nc4ccccc4
2240
+ Sc1ccc
2241
+ on3
2242
+ sc12
2243
+ ##SCC2
2244
+ c1c2cc
2245
+ Cc1c2c
2246
+ ##ncccc3
2247
+ ##CCN1CCOCC1
2248
+ NC4CCCCC4
2249
+ ##c1nc2ccccc2c
2250
+ SCCO
2251
+ ##OP
2252
+ cc1N1CCN
2253
+ C1CCOCC1
2254
+ nc5
2255
+ ##c1ncn2
2256
+ NCCCCCCN
2257
+ NCC1CC1
2258
+ ##n2Cc2ccc
2259
+ c3nc4c
2260
+ S3
2261
+ C2c1ccc
2262
+ c43
2263
+ CCNc1cc
2264
+ ##CCC12
2265
+ c4ccnc
2266
+ ##5ccccc5c4
2267
+ ##Oc1cccc
2268
+ CCc4ccccc4
2269
+ CNCC2
2270
+ Cc1ccsc1C
2271
+ OC1CC2
2272
+ Cc2cc3ccccc3
2273
+ c2cccc3c2
2274
+ c3nc4ccccc4s3
2275
+ c1oc2ccccc2
2276
+ c7
2277
+ cc2Br
2278
+ c3ccc4ccccc4n3
2279
+ ccc2n1C
2280
+ NNc2ccc
2281
+ C2C1C
2282
+ ncc23
2283
+ CCCOc2ccc
2284
+ Fc1ccccc1
2285
+ ##SCC1
2286
+ c2c1c
2287
+ N1CCO
2288
+ nc2c1ncn2C1OC
2289
+ ccc3ccccc23
2290
+ CCNC1
2291
+ C1CCc2cc
2292
+ CC2C3
2293
+ C2CCNCC2
2294
+ C2CC3CCC
2295
+ Cc4
2296
+ oc23
2297
+ CC6
2298
+ CCC2C1
2299
+ C1c2cccc
2300
+ ccc3C2
2301
+ NC1CCS
2302
+ Cc1cccc2c1
2303
+ Nc1c2c
2304
+ OCCCCCC
2305
+ cnc1N
2306
+ N2CC3CN
2307
+ 1cc
2308
+ N6
2309
+ OCc4ccc
2310
+ CCCn1cc
2311
+ C3NC
2312
+ NCCSC
2313
+ Nc1cncc
2314
+ CN1CCCN
2315
+ cn2c1
2316
+ ncc3c2
2317
+ ##ncccc2c1
2318
+ CNc3ccc
2319
+ ##cnn3
2320
+ Nc2nc3ccc
2321
+ Cc3ccccc3C
2322
+ CCC23C
2323
+ ncnc3
2324
+ c2cncnc2
2325
+ c3nc4ccc
2326
+ ##Oc1cc
2327
+ ##cc1
2328
+ ##c1ccco1
2329
+ C2SCC
2330
+ CCN3CCOCC3
2331
+ OCCCCN
2332
+ Cn1cncc
2333
+ c3cc4cc
2334
+ c4ccc5
2335
+ Nc2cccc3ccccc23
2336
+ 2c1
2337
+ n2cnnn2
2338
+ ##ncc5
2339
+ ##c3ccccc3O2
2340
+ ##nn4
2341
+ CCOc2ccccc2
2342
+ ccc1Br
2343
+ ncnc1
2344
+ c5cccnc5
2345
+ C4C5
2346
+ Cn3cncn3
2347
+ 2ccc
2348
+ ##3OC
2349
+ ##Sc2ccccc21
2350
+ nc2C1
2351
+ Cc1cccc2nc
2352
+ c2cnccc
2353
+ ncn2C
2354
+ NC4CCCC4
2355
+ OCC2OC
2356
+ c3nccs3
2357
+ c2ncccc12
2358
+ cccc4F
2359
+ sc4n3
2360
+ cn2c
2361
+ ##oc2ccc
2362
+ ##c2ccccc12
2363
+ cc3cc
2364
+ C34CC5CC
2365
+ Cn1nnnc1
2366
+ Cc2ccccc21
2367
+ ##c4ccccc4C
2368
+ N2Cc3ccccc3
2369
+ CCN1CCC2
2370
+ C3CCC21C
2371
+ NC1c2ccccc2CC1O
2372
+ OCc1c
2373
+ NC1CCCN
2374
+ n3cn
2375
+ N1Cc2ccccc2C1
2376
+ CCCCCc1ccc
2377
+ ##nc2cc1OCCCN
2378
+ csc1
2379
+ NC1C2
2380
+ C2CCOCC2
2381
+ COC12
2382
+ N3CCCN
2383
+ Cc1cccc2cc
2384
+ Nc3cccnc3
2385
+ Nc1cccc2
2386
+ NC3CC
2387
+ ncc2C
2388
+ c2nnnn2C
2389
+ n2Cc2ccccc2
2390
+ ##3c4
2391
+ c3ccccc13
2392
+ C1c2ccc
2393
+ c4nnc
2394
+ ##c3ccc4c
2395
+ ##n3nc
2396
+ Cc1coc
2397
+ C2Cc3ccccc3
2398
+ N2Cc3ccccc3C2
2399
+ Nc1ccccc1NC
2400
+ N1CC2CN
2401
+ CCN1CCOCC1
2402
+ CCn1c2ccccc2
2403
+ cnn2C
2404
+ c1sc2nc
2405
+ C2SC1
2406
+ c2o1
2407
+ C2CC1
2408
+ n21
2409
+ ccc2s1
2410
+ Nc3ccc4
2411
+ Nc2ncnc3
2412
+ n2cncn2
2413
+ OC3CCN
2414
+ ##nnnn1
2415
+ C3CCNCC3
2416
+ c2ncccc2c1
2417
+ Sc1nc
2418
+ nnc
2419
+ ##OCC3
2420
+ ##43
2421
+ ##6c
2422
+ cc1CC
2423
+ ccn
2424
+ CCNc1ccc
2425
+ CCNc2nc
2426
+ n1nn
2427
+ Cc1ccccc1S
2428
+ c1cs
2429
+ Cc1cccc2
2430
+ c1ccc2ccc
2431
+ NCc3cccnc3
2432
+ sc2ccccc12
2433
+ n2nnnc2
2434
+ Cc3nc
2435
+ ##on3
2436
+ ##oc3c
2437
+ C2c3ccc
2438
+ CC1CCCC1
2439
+ C34
2440
+ Cc1ccccc1OCC
2441
+ C1CS
2442
+ OC12C
2443
+ N1Cc2cc
2444
+ CCC31
2445
+ C12CCN
2446
+ C3C4
2447
+ ##ncccc2
2448
+ CCCC21C
2449
+ Nc3ccccc3N
2450
+ COc1ccc2oc
2451
+ C3CCC4C
2452
+ sc3n2
2453
+ ##oc12
2454
+ ##5CC3
2455
+ c1CCC
2456
+ c3c4c
2457
+ N1CCCC2
2458
+ N2c3ccccc3
2459
+ ##n34
2460
+ C1C2CCC
2461
+ nc2O
2462
+ ##ncccn2
2463
+ ##2CN1C
2464
+ C2CCC3C
2465
+ c3cn4nc
2466
+ n3cccc3
2467
+ NCCCC1
2468
+ CCP
2469
+ ##CCC5
2470
+ c3o2
2471
+ Cc1nccc
2472
+ C2c3c
2473
+ CC23
2474
+ ##c3cccnc3
2475
+ nc2cccc
2476
+ NNc2nc
2477
+ Cc2ccsc2
2478
+ COC1CCC2
2479
+ ##OC1CC
2480
+ OC4OC
2481
+ COc1cccc2c1C
2482
+ n3cccn3
2483
+ 1c
2484
+ ##n2c1C
2485
+ ##CCCN3
2486
+ ccc1N1CCOCC1
2487
+ Nc2ccc3nc
2488
+ ##c4ccccc4c3
2489
+ CCC23
2490
+ ncnc12
2491
+ C1OC2
2492
+ ##c4cc5c
2493
+ noc3C
2494
+ c3cccc4c3
2495
+ c2ncccc2
2496
+ 2C
2497
+ CI
2498
+ CNCCCN
2499
+ cc3c2C
2500
+ Cn1nccc
2501
+ CN2CCCN
2502
+ Nc2nn
2503
+ c2cnc3ccc
2504
+ CCOc1ccc2nc
2505
+ ##SC3
2506
+ COc1cnc
2507
+ COc1ccc2c3c1
2508
+ Cn2cncn2
2509
+ ##sc3ccccc23
2510
+ Cn3nc
2511
+ O5
2512
+ ##c2cnn
2513
+ COC4
2514
+ c3ccccc3N
2515
+ NC1CCCC
2516
+ nc1NC
2517
+ ##ncccc12
2518
+ Nc3ccccn3
2519
+ ##cnccc12
2520
+ n2ncc3c
2521
+ CCc2cccc
2522
+ NCc3cc
2523
+ c1ccc2ccccc2n1
2524
+ ccc2NC
2525
+ NCCCn1ccnc1
2526
+ ##CCN1CCCC1
2527
+ ##CCCNC1
2528
+ CC1CCCN1C
2529
+ ##cccnc34
2530
+ CCF
2531
+ ##CCNCC2
2532
+ CCN2CC
2533
+ NCCCCNC
2534
+ ccc13
2535
+ c2c1O
2536
+ CCCNS
2537
+ ccc3n2C
2538
+ CCNC2
2539
+ ##CCCO4
2540
+ C2CCS
2541
+ ncc1Cl
2542
+ nn3c2
2543
+ OCCCCO
2544
+ sc2C1
2545
+ ##c1nc2ccccc2s1
2546
+ c1c2ccccc2nc
2547
+ NCc2ccncc2
2548
+ c3ncccc23
2549
+ cnc2c
2550
+ ##o5
2551
+ ##ccc1
2552
+ CCCCCC2
2553
+ C1CC3
2554
+ CSc1cc
2555
+ ccc1S
2556
+ cc4C3
2557
+ Cc1cccc2c
2558
+ c2ccc3ccc
2559
+ Cc2nn
2560
+ cnn1C
2561
+ ##nc5cc
2562
+ Cc3cnc
2563
+ c1oc2ccc
2564
+ Sc2c
2565
+ CNc1cccc
2566
+ CSc3nnc
2567
+ OCC4CC4
2568
+ ccc2c1C
2569
+ NC1CCCCCC1
2570
+ Nc3nnc
2571
+ nnc1C
2572
+ CSc1nc2c
2573
+ nn2c
2574
+ ##Oc1c
2575
+ ##sc3c2
2576
+ ccc4C
2577
+ N1CCC1
2578
+ CCSCC
2579
+ CCCOc1cc
2580
+ c2nc3ccccc3o2
2581
+ sc2c1CCCC2
2582
+ c3ccc4nc
2583
+ c2nnc3n2
2584
+ CCc1cn
2585
+ C21C
2586
+ ccnc2cc1OCCCN
2587
+ CC2CCCC2
2588
+ CCNCC3
2589
+ CSC3
2590
+ C2COC
2591
+ ccc3nc2
2592
+ CCCCCS
2593
+ Cn2nnc
2594
+ CN3CCCC
2595
+ CC2C4
2596
+ NCc3ccc4c
2597
+ ccc2OC1CN
2598
+ CSC12
2599
+ Cn3ccnc3
2600
+ Cc1occc
2601
+ CC1C1
2602
+ CCN3CCN
2603
+ N2CCC2
2604
+ NNc1ccccc1
2605
+ cc4s3
2606
+ cc1OC1CCCC1
2607
+ CCCCCn1c
2608
+ NCCCc1ccccc1
2609
+ C5CCCC5
2610
+ n2nccn2
2611
+ ##2CCC1CC2
2612
+ c2cnn3cccnc23
2613
+ COc4ccc
2614
+ cc2n
2615
+ cc3CC
2616
+ ##CC21
2617
+ n3ccccc3
2618
+ nc3c2C
2619
+ c4ccoc4
2620
+ cccc2n1
2621
+ CSc2nn
2622
+ c1csnn1
2623
+ ##3CCC2
2624
+ CCc1ncc
2625
+ OC1CN
2626
+ cc2S
2627
+ ##c2cccs2
2628
+ c4nn
2629
+ CC2CCCO2
2630
+ COC1CN
2631
+ ##CC1CCCCC1
2632
+ CCOCCCNC
2633
+ CCCN1CC
2634
+ N3CCc4ccccc4C3
2635
+ ##n3ccnc3
2636
+ 1C
2637
+ CCCCc1c
2638
+ ##c2cccc3
2639
+ c1Cc1ccc
2640
+ ##CN1CCN
2641
+ Cc3ncc
2642
+ C1CCC2C3CCC4CC
2643
+ ##4cccc
2644
+ ##Nc1nc
2645
+ CC1SC
2646
+ ##nc2n
2647
+ ##CC1CCN
2648
+ CCOCC2
2649
+ Cc2ccccc2OC
2650
+ NCCCN2CCOCC2
2651
+ cccc13
2652
+ Nc2ncc3c
2653
+ n3cnc4c
2654
+ c6ccccc6
2655
+ c1sc2ccccc2c1
2656
+ CCn2
2657
+ COc2c
2658
+ CCC1C2CCC2
2659
+ CNCCCC
2660
+ c1ccc3c
2661
+ c4noc
2662
+ ##c1ccccc1OC
2663
+ nc2sc
2664
+ N1CCNCC1
2665
+ c3c2CCCC3
2666
+ ##cnnn1
2667
+ ##sc23
2668
+ Cc3nnc
2669
+ cccc4Cl
2670
+ N1Cc2ccccc2CC1C
2671
+ ##5CC35
2672
+ 1n
2673
+ Nc5ccccc5
2674
+ ##2CCCC
2675
+ N1c1cccc
2676
+ ##CC1OC
2677
+ ##CC1CCCO1
2678
+ NCC4
2679
+ nc2sc3c
2680
+ C4CCC4
2681
+ NCCC3
2682
+ ##ncccc3c2
2683
+ C1NC2
2684
+ ##nnnn2
2685
+ c2cccc3cccnc23
2686
+ c2sc3nc
2687
+ ccc5c4
2688
+ c4ncccn4
2689
+ 1ccccc1
2690
+ 2n1
2691
+ CC3CCCO3
2692
+ C1Cc2cc
2693
+ ccc31
2694
+ CCN1CCCC1
2695
+ nnn2
2696
+ nc4c3
2697
+ Cn1cncc1C
2698
+ nc4cc
2699
+ ##oc4ccccc4
2700
+ c1onc
2701
+ C2c3cc
2702
+ N2CC3CC
2703
+ n2CCC
2704
+ ccc2N1C
2705
+ cc45
2706
+ CC4CC
2707
+ N1CCOC
2708
+ Nc2ccccc2N
2709
+ CCSc1nc
2710
+ ##2CCC1C
2711
+ Oc1cc2c
2712
+ CCc1nc2ccc
2713
+ Sc3ccccc3
2714
+ ##c1sc
2715
+ CCc3c
2716
+ c3nc12
2717
+ c2ccccc2N1
2718
+ OCCS
2719
+ nc3n
2720
+ nn2c1
2721
+ c2nn3c
2722
+ ##ncccc2C
2723
+ NCCCN1CCN
2724
+ cn2C1
2725
+ n2cnc
2726
+ ##CCCNC3
2727
+ c2nc3ccccc3c
2728
+ noc1C
2729
+ c2ccc3ncnc
2730
+ cnn3
2731
+ c2nonc2N
2732
+ c1c2
2733
+ COc3cccc
2734
+ cc2oc1
2735
+ c2ccccc2c1C
2736
+ cc3C1
2737
+ N1c2ccc
2738
+ c2cc1Cl
2739
+ CSc2ccccc2
2740
+ Cc1cn2c
2741
+ N1CCc2nc
2742
+ N1Cc1cccc
2743
+ CC1C2C
2744
+ Nc2ccncc2
2745
+ ncc2Cl
2746
+ ##CCNC3
2747
+ cc2c1OC
2748
+ NCC1CCCCC1
2749
+ COc1ccc2nccc
2750
+ nc2cnc
2751
+ CC12CC3CC
2752
+ c2ncccc2C
2753
+ Oc2ccccc21
2754
+ cc1I
2755
+ OCc5ccccc5
2756
+ CC1CCCO1
2757
+ c1ccccc1S2
2758
+ Cc1ccn2c
2759
+ C1CNC
2760
+ CN1CCCC1C
2761
+ N1CCCc2ccccc21
2762
+ OC1CCCCC1
2763
+ c1cnc2
2764
+ N1CCn2c
2765
+ CCC21C
2766
+ OC2CCCCC2
2767
+ NCCCl
2768
+ ##CCOC4
2769
+ cccc1NC
2770
+ Cc3cn
2771
+ Cc2cnn3c
2772
+ c3no
2773
+ c3cc4ccccc4o3
2774
+ coc2c1
2775
+ ##OCCC2
2776
+ OCc2nc
2777
+ CCC1CCN
2778
+ ##CCN3
2779
+ CCCC5
2780
+ c2coc
2781
+ ##nc1N
2782
+ C4N
2783
+ ccc3N2
2784
+ Nc1ncnc
2785
+ OCCN1CCN
2786
+ N4CCOCC4C
2787
+ c1nc2ccccc2o1
2788
+ Cn1ncc2c
2789
+ C1CCCN1S
2790
+ NCCCC1NC
2791
+ ##2CC2
2792
+ CCCCCCOc1ccc
2793
+ C2CCCC3
2794
+ CC1CCC1
2795
+ cccn2c1
2796
+ ##c2ccccc23
2797
+ ##c3cccnc32
2798
+ c3ccccc3Br
2799
+ c1cc2nc
2800
+ ##c2cc1OC
2801
+ CCOCCO
2802
+ Cc2ccccc2O
2803
+ cc1CNC
2804
+ N5CCCC5
2805
+ CCc1noc
2806
+ c2OC1CN
2807
+ cnc3c2
2808
+ c3sc
2809
+ OCc1cccc
2810
+ OC1CCN
2811
+ cc2O1
2812
+ C2CC3C
2813
+ c2cccnc12
2814
+ ##c3ccccc3nc
2815
+ C1COc2ccc
2816
+ ##c2ncn3
2817
+ CCNC3
2818
+ C5CC
2819
+ N2CCOC
2820
+ c4cc5ccccc5
2821
+ oc2c1C
2822
+ CCC4C3
2823
+ c1cc2ccccc2s1
2824
+ c3ncccc3
2825
+ ##nsnc12
2826
+ ##oc3ccc
2827
+ OCc2nnc
2828
+ ##ncnc
2829
+ ##c1cc2cc
2830
+ N1O
2831
+ n2nnc
2832
+ n2c1C
2833
+ c2cc1O
2834
+ COc1ccnc
2835
+ OCCF
2836
+ Nc2cncc
2837
+ c1ncn
2838
+ CCN1CCCCC1
2839
+ OCC1CC
2840
+ ##CCN1CCCCC1
2841
+ n1cncn1
2842
+ c3cncnc3
2843
+ COc1cncc
2844
+ Oc4cc
2845
+ SCC2
2846
+ nc4ccccc43
2847
+ ##1N
2848
+ ##3O
2849
+ ##4O
2850
+ ##6OC
2851
+ NC3C
2852
+ c3oc
2853
+ CCC1C2
2854
+ C1SCC
2855
+ CC2c2ccc
2856
+ n1cnc2c
2857
+ n1cccc1
2858
+ ##CC1CCC
2859
+ ##CC3CN
2860
+ ccc3cc
2861
+ COc1ccccc1C1
2862
+ C1OCC
2863
+ Nc2ccnc3cc
2864
+ Cc2nc3cc
2865
+ CCn1cn
2866
+ OCCN3CCCCC3
2867
+ nnc2C
2868
+ Cn2cnc3c
2869
+ nc3ccccn23
2870
+ sc2C
2871
+ ##s5
2872
+ ##2COC
2873
+ ##c2ccccc2Cl
2874
+ ##c2ccccc2N1C
2875
+ CC2N
2876
+ CCN3CCC
2877
+ CNCc2ccc
2878
+ c3ccn
2879
+ COc1ccccc1CC
2880
+ C1CCCCN1C
2881
+ Nc1ccccc1Br
2882
+ CCN1CCCC
2883
+ Nc2ncnc3cc
2884
+ nnn1
2885
+ Cc3cccc4ccccc34
2886
+ COc1ccc2c3c
2887
+ c2cc3ccccc3oc2
2888
+ N1CC2CCC
2889
+ Nc1nc2ccccc2s1
2890
+ cc1Nc1ncnc2c
2891
+ Sc2cc
2892
+ c2C2
2893
+ C2CCCO2
2894
+ CC12CC
2895
+ cc3c1
2896
+ c4F
2897
+ N21
2898
+ COC1CCN
2899
+ C4OC
2900
+ ##nc4ccccc34
2901
+ c1ccc2ncc
2902
+ n3cncn3
2903
+ c2oc3cc
2904
+ ##5ccccc5n4
2905
+ c4nc5cc
2906
+ n1nccn1
2907
+ C7
2908
+ ##on1
2909
+ ##c1cnn
2910
+ NCc3ccccn3
2911
+ ##ncn4
2912
+ ##c2ccccc2c1C
2913
+ cc3nc2
2914
+ ##nc2nc
2915
+ ##CC2O
2916
+ C2CS
2917
+ C2O1
2918
+ CCCCCCCCNC
2919
+ Cc1nccn1
2920
+ COc1cc2oc
2921
+ ##c1ncccn1
2922
+ c1ncccn1
2923
+ ##c3cccc4ccccc34
2924
+ OCCCO2
2925
+ ##Sc1ccccc1
2926
+ c3c2c1
2927
+ cc2ccc
2928
+ ##c1cc2
2929
+ COc1cccc2cc
2930
+ c4ccccc4OC
2931
+ c2cnc3cc
2932
+ OCCO5
2933
+ ncc4c3
2934
+ Cc1nn2c
2935
+ CCN1CCCC1C
2936
+ ccc4F
2937
+ c2cccnc21
2938
+ nc4ccccc34
2939
+ c2ccc3ccccc3n2
2940
+ ##c6ccccc6
2941
+ Sc1ccccc1
2942
+ ##2CCC3
2943
+ C1c1c
2944
+ ##c2ccccc2n1
2945
+ n2nccc
2946
+ COCc1ccc
2947
+ c1COc1ccc
2948
+ c2c1CCCC2
2949
+ Nc1cccc2c1
2950
+ NCCCOC
2951
+ C2Oc3cc
2952
+ Cc2n
2953
+ cn3C2CC2
2954
+ OCCCCCCCC
2955
+ ##sc2ccccc12
2956
+ n1Cc1ccco1
2957
+ COc1cc2c3c
2958
+ Nc3ncc4c
2959
+ cncc2
2960
+ ##O5
2961
+ CO4
2962
+ ccc1N1CCN
2963
+ CN1CC2
2964
+ NCCN1CCN
2965
+ CCn1ncc
2966
+ CCCCCCCCc1ccc
2967
+ OCC3CC3
2968
+ Cc1nc2cccc
2969
+ n3cnnn3
2970
+ ##3c4c5ccc
2971
+ Oc3c
2972
+ OCCCNC
2973
+ ##nncc
2974
+ ##SCCN
2975
+ ##5CCC
2976
+ NCc1nc
2977
+ ##n3ccc
2978
+ C1Cc2ccc
2979
+ ##CCC23C
2980
+ Nc1sc
2981
+ ##c1nn2c
2982
+ Nc1ccccc1OC
2983
+ Cc2cc3cc
2984
+ C3C4C
2985
+ cn5
2986
+ cc5c4
2987
+ n2cnc3cc
2988
+ ccc1OCc1ccccc1
2989
+ CC12CCC3
2990
+ c3ccc4cc
2991
+ c1oc2cc
2992
+ Nc2c3ccccc3nc3ccccc23
2993
+ C2Cc3ccccc3CN
2994
+ 1CC
2995
+ cnc4
2996
+ ##13
2997
+ ##SCCC
2998
+ ##Sc1nnc
2999
+ ##cc1C
3000
+ ##c2nc3c
3001
+ C1CCCO1
3002
+ ##n2c3c
3003
+ ##ncc3c
3004
+ CCCCn1
3005
+ CC3CCC
3006
+ ##nc3cccc
3007
+ NC1N
3008
+ CN1C2CCC1CC
3009
+ c2ccc3nnc
3010
+ CCCOc1ccccc1
3011
+ CN1CCc2c
3012
+ Nc1ncnc2c1nc
3013
+ Nc1ccc2oc
3014
+ c1cccc2c1C
3015
+ ##scn3
3016
+ ##1OCC
3017
+ ##5CCOCC5
3018
+ ##CCCOc1cc
3019
+ N2CCCc3ccccc32
3020
+ CCCOc1cccc
3021
+ ccc4n3
3022
+ c1ccc2c3c
3023
+ cnc2C
3024
+ NC1CCCc2ccccc21
3025
+ Cn3ccc
3026
+ N1CC2CC
3027
+ c2nc3cccc
3028
+ ##nsnc23
3029
+ Cn4cc
3030
+ Oc1
3031
+ oc3C
3032
+ ##3oc
3033
+ cc2oc
3034
+ CS3
3035
+ CCCNc1nc
3036
+ ##CN1CCC
3037
+ NCCN4CCOCC4
3038
+ CCCCCn1cc
3039
+ cc2c1O
3040
+ CCC4CC
3041
+ noc4
3042
+ c2sc3ccccc3c2
3043
+ Cn1cnc2cc
3044
+ c1nc2cccc
3045
+ Oc5ccccc5
3046
+ c1scc
3047
+ NCc4cc
3048
+ NC2C3
3049
+ CONC
3050
+ COCCN1C
3051
+ cc2ccccc21
3052
+ ##1COC
3053
+ cc31
3054
+ C3C1
3055
+ n2nc3c
3056
+ ##c2ccnc
3057
+ ccc2oc1
3058
+ C1C1
3059
+ c1cccc2cccnc12
3060
+ c1CNC
3061
+ CCC1N
3062
+ SCc2cc
3063
+ NCCN2CCN
3064
+ CCCCCCc1ccc
3065
+ N5CCCCC5
3066
+ c2oc3c
3067
+ Cc4ccccn4
3068
+ Sc2nc
3069
+ ##2NC
3070
+ ##c3nn
3071
+ ##c3c4c
3072
+ CCCn1nc
3073
+ c1cc3c
3074
+ CCOCC3
3075
+ c2c1OC
3076
+ cccc34
3077
+ COC12C
3078
+ nc4ccccc24
3079
+ c1cccc2nsnc12
3080
+ OO2
3081
+ NCc1cn
3082
+ ##CCNCC3
3083
+ ##c2ccco2
3084
+ c4n
3085
+ ##nc2sc
3086
+ Brc1cccc
3087
+ ##n3n2
3088
+ c2c1N
3089
+ SCc2cccc
3090
+ c1ncccc
3091
+ CCN1CC2
3092
+ NCCCNCCCCN
3093
+ OCCN3CCOCC3
3094
+ n4ncc
3095
+ Cc1cnc2c
3096
+ Oc3ccc4c
3097
+ ##N2CCCC2
3098
+ Cc3ccsc3
3099
+ OCc2ccc3ccccc3n2
3100
+ ncnc2cc1O
3101
+ 3cc
3102
+ OCC3C
3103
+ CCc3ccccc32
3104
+ c2sc3
3105
+ NCc2cn
3106
+ ##CCC1C
3107
+ ##CCC2C
3108
+ ##c1ccc2ccccc2c1
3109
+ CCCCCN1C
3110
+ CCC2C3CCC4
3111
+ N1CCCCC1C
3112
+ CCN2CCCCC2
3113
+ N2CC3C
3114
+ n1NC
3115
+ n2ccccc2
3116
+ Nc1ccc2ncnc
3117
+ c3cnc4
3118
+ N4CC5
3119
+ Nc2sc3c
3120
+ C1CC1C
3121
+ c1cnn2ccc
3122
+ N1Cc2c
3123
+ Cc2cnn
3124
+ Cc2nc3c
3125
+ Nc3ccccc3F
3126
+ ##2CCC1C2
3127
+ ##n2Cc2ccccc2
3128
+ CSc1nc2cc
3129
+ C1COc2ccccc2O1
3130
+ oc3ccccc23
3131
+ CCC3C2CCC2
3132
+ CCc4ccc
3133
+ ##c3nccc
3134
+ ##c3cnn
3135
+ OCc1cn
3136
+ cc2nc1O
3137
+ C3CCCC
3138
+ n1CCC
3139
+ CSc1c
3140
+ Nc1ccc2ccccc2c1
3141
+ ##CCCN1CCN
3142
+ ##nc3nc
3143
+ cccc2C1
3144
+ ##c3ccnc4cc
3145
+ NC3CCOCC3
3146
+ C1CCC1C
3147
+ C3Cc4ccc
3148
+ cn3c2
3149
+ OC1CO
3150
+ CCc1cnc
3151
+ cccc1N
3152
+ NCC2CC2
3153
+ N3CCS
3154
+ ##c1nc2ccccc2n1
3155
+ ccc1NS
3156
+ ##3ncnc
3157
+ COCCOc1cc
3158
+ c2oc3ccccc3c2
3159
+ ##OCCO3
3160
+ c2sccc2
3161
+ c3sccc3
3162
+ COc1ccc2c3c1OC1C
3163
+ Oc2ccccc2C
3164
+ ##4CCCC
3165
+ CNCCO
3166
+ cc2CC1C
3167
+ ##CC3CC1CC
3168
+ N3CCC3
3169
+ C2C3CCC
3170
+ N1CCc2
3171
+ ##CCC1CC
3172
+ c1Oc1ccc
3173
+ Nc2ccccc2OC
3174
+ C12CC
3175
+ C1CCNCC1
3176
+ cc2c1N
3177
+ c1cnco1
3178
+ NCc3cccs3
3179
+ c2nccnc2
3180
+ sc21
3181
+ N5CCC
3182
+ CN4CCC
3183
+ ##c2nc3ccccc3s2
3184
+ Cc1nc2ccccc2c
3185
+ cc1Nc1ncnc2cnc
3186
+ CCN1CCCC1CNC
3187
+ ##6cc
3188
+ ##6ccccc6
3189
+ COCC2
3190
+ c3s
3191
+ CNCc2cccc
3192
+ c3cnc4ccccc4
3193
+ c1cnn2c
3194
+ c3c2F
3195
+ ##2ccccc21
3196
+ C3CO
3197
+ NCCCN3CCOCC3
3198
+ CCC45CC35
3199
+ c4csc
3200
+ cccc2s1
3201
+ COc1ccc2ccc
3202
+ ##c5ccccc5C4
3203
+ CCn1ccnc1
3204
+ n2ccc3c
3205
+ COCCOc1ccc
3206
+ c1cc2ccccc2oc1
3207
+ ##OCCO2
3208
+ OOC1
3209
+ cnc3cc
3210
+ CCCc2ccc
3211
+ ccn4
3212
+ COc1ccc2ccccc2c1
3213
+ ##c1cc2ccccc2
3214
+ N1c1cc
3215
+ ##ncc12
3216
+ c3ccccc3N2
3217
+ nc2N1
3218
+ C4CCC23C
3219
+ CCCN2CCN
3220
+ NC2CCCCCC2
3221
+ c3cccc4c
3222
+ CCOc1ccc2
3223
+ ##SCc1ccc
3224
+ NCCCN1CCCC1
3225
+ NCC1CC
3226
+ ##CCN1c1nc
3227
+ cnc2n1
3228
+ COC1CC
3229
+ NC4CCC
3230
+ COc1cc2nccc
3231
+ Oc2cnc
3232
+ Nc2ncccn2
3233
+ cc2n1CC
3234
+ ##sc4ccccc34
3235
+ ns2
3236
+ ccn23
3237
+ N1S
3238
+ ##CCO3
3239
+ N2CCCCC2C
3240
+ c1ccccc1NS
3241
+ NCCS1
3242
+ ##C1CC1
3243
+ NC1CC2
3244
+ cc4OC
3245
+ C2Cc3c
3246
+ CCC1CCC
3247
+ Nc2nc3cc
3248
+ Nc1ccnc
3249
+ Nc1ccccc1O
3250
+ N1CC2C
3251
+ NCCCn2ccnc2
3252
+ C5CCN
3253
+ c4cccc5
3254
+ ##N2CCCCC2
3255
+ NCc2ccccc2Cl
3256
+ c2cccc3nsnc23
3257
+ CN1CCc2cc
3258
+ no4
3259
+ ##3cccnc23
3260
+ c5c4C2
3261
+ Oc3nc
3262
+ ##3c4c
3263
+ OCP
3264
+ OCc2cn
3265
+ CNc1ncc
3266
+ CC2NC
3267
+ c1ccccc1C3
3268
+ N32
3269
+ CCOc3ccc
3270
+ CNCc1ccc
3271
+ CC3OC
3272
+ C1COC2
3273
+ C1C2CC
3274
+ ##C1OC
3275
+ OC2CCCC2
3276
+ C2CCCCN2C
3277
+ C1Nc2cc
3278
+ Nc2ncnc3ccc
3279
+ c3ncn
3280
+ Nc3ccon3
3281
+ c2cncnc21
3282
+ Cc1ccc2cccc
3283
+ CSc1nn
3284
+ ##OS
3285
+ ##c1nnn
3286
+ NCc3c
3287
+ ##c2cccnc21
3288
+ CC2c2ccccc2
3289
+ N2S
3290
+ n23
3291
+ c5cnn
3292
+ OC12
3293
+ OCCN3CCCC3
3294
+ ##c4ccccn4
3295
+ C2CCCN2
3296
+ Nc1nonc1
3297
+ ##oc2ccccc12
3298
+ C3CCCN3C
3299
+ N3CC4CCC
3300
+ c2csnn2
3301
+ Nc5cc
3302
+ OCCC2
3303
+ csc2
3304
+ ##ON
3305
+ ##45
3306
+ ##7C
3307
+ c2oc1
3308
+ ##c3sc
3309
+ COc1cn
3310
+ OC1C2
3311
+ CNc1nccc
3312
+ c4nnn
3313
+ ##cnn2
3314
+ ##nc2cccc
3315
+ c3ccccc3NC
3316
+ c2cccc3cc
3317
+ Cn1ncc2
3318
+ C4CCOCC4
3319
+ c2ncnc3c2
3320
+ ##C2OC
3321
+ ##c2c1C
3322
+ ##CCC3CC4
3323
+ OCCN4CCCC4
3324
+ NCCCCCCNC
3325
+ NCC3CC3
3326
+ ##CC2CCC1C2
3327
+ ncnc2cc1OC
3328
+ ##OCCC1
3329
+ ##c1oc
3330
+ ##c2nc3cc
3331
+ NCc2nnc
3332
+ Cc1o
3333
+ c4C3
3334
+ CC2CCCN
3335
+ C3CC4
3336
+ CCCCc2nnc
3337
+ CCCCc1nn
3338
+ ##nnc2ccccc21
3339
+ CC3CCCC3
3340
+ ##nc1Cl
3341
+ c1CO
3342
+ nc3c2c
3343
+ COc1ccccc1NS
3344
+ Nc2n
3345
+ ##ncccc4c3
3346
+ OCCN2C
3347
+ ##N2CC
3348
+ cc2cnc
3349
+ CCc1ccccn1
3350
+ ##3C4CC5
3351
+ ##CCOCCOCCOCCO
3352
+ Cn1ccc2cc
3353
+ ##c2nc3ccccc3c
3354
+ c1sccc1
3355
+ ##n1cnnc1
3356
+ CCC314
3357
+ Cc1occc1C
3358
+ ##5CC6
3359
+ CCc4ccccc43
3360
+ CNCC3
3361
+ cc2n1C
3362
+ cc3n2C
3363
+ ##CCCCC2C1
3364
+ ##nc2c3c
3365
+ N3N
3366
+ N3C2
3367
+ ccc2nc
3368
+ ##n1cncn1
3369
+ Cc3ccccc32
3370
+ N1CCc2ccc
3371
+ CCN1S
3372
+ NCCCN1
3373
+ NCCCN2CCN
3374
+ c2cccnc2N
3375
+ CC1CCCCN1C
3376
+ ##Oc1ccc2c
3377
+ ##3CCNCC3
3378
+ ##5C4
3379
+ Nc4nc
3380
+ ##c1nc2cccc
3381
+ ##c1c2
3382
+ CCBr
3383
+ CCc3nc
3384
+ ##c3n2
3385
+ ##n2nn
3386
+ CCCCc1ccccc1
3387
+ Cc1ccn
3388
+ ##nn3c2
3389
+ CCO4
3390
+ ccc2OCC
3391
+ NC2CCCN
3392
+ nc31
3393
+ SC3
3394
+ NCCN1CCCC1
3395
+ OC2CCC3
3396
+ CCSC1
3397
+ cc2C1C
3398
+ CCCCCCCCN
3399
+ NCC2CCN
3400
+ CC5C
3401
+ c1cc2c3c
3402
+ OCc3ccc4ccccc4n3
3403
+ Cn4
3404
+ SS
3405
+ oc2ccccc21
3406
+ ##3CCCC
3407
+ c2Br
3408
+ CCCc1nnc
3409
+ CNc2cccc
3410
+ ##CCN3C
3411
+ Cc1cccn2c
3412
+ c3cccn3
3413
+ ##ccccc43
3414
+ CNC1CCN
3415
+ Cc1ccccc1N1CCN
3416
+ Nc1nn
3417
+ OC1CCCC1
3418
+ c2cn3cc
3419
+ OC21
3420
+ CC1CNC
3421
+ N2CCc3cc
3422
+ OCC1c2ccccc2
3423
+ NCCCCCCC
3424
+ ccc1OCc1ccc
3425
+ Nc1ncnc2c1c
3426
+ c1C1CC
3427
+ ##on2
3428
+ ##Sc1nc
3429
+ ##cc1O
3430
+ ##CCc1ccccc1
3431
+ ##c1cccs1
3432
+ c3N
3433
+ CCCc1cccc
3434
+ ##CCNC2
3435
+ ##n2cccc
3436
+ CCNCC1
3437
+ ##CCO4
3438
+ Nc1ccc2cc
3439
+ NCCc4ccccc4
3440
+ CC3CC
3441
+ NC1CCCCN
3442
+ N2Cc3ccc
3443
+ NCCNCC
3444
+ ccc1CNC
3445
+ Cc1nnc2n1
3446
+ c4ccsc4
3447
+ OCCN2CCCCC2
3448
+ ccc2c1O
3449
+ Cc4ccc5c
3450
+ CN1CCc2ccccc2C1
3451
+ N3CCc4ccccc43
3452
+ C2CNCC
3453
+ c2occc
3454
+ Oc3ccnc
3455
+ c5ccccn5
3456
+ c1ccccc1Sc1ccc2c
3457
+ N3CC4CC3C
3458
+ Nc2nc3ccccc3s2
3459
+ N2CCOCC2C
3460
+ 1ccn
3461
+ Cn1nccc1
3462
+ Sc1cc
3463
+ cnc2cc
3464
+ sc2c
3465
+ ##Oc2ccccc2
3466
+ OCc5cccc
3467
+ ccnc3
3468
+ cc3N
3469
+ cc3c2c1
3470
+ n1cnnn1
3471
+ c2ccnc3cc
3472
+ ##c3ccccc3n2
3473
+ CCOCCC
3474
+ c1cccc3
3475
+ CCCN3C
3476
+ cnn12
3477
+ ccc4o3
3478
+ Nc4ccc5c
3479
+ ##2C3CC
3480
+ C2CCCN2S
3481
+ c2nccnc2C
3482
+ NCC2CCCCC2
3483
+ Cc1ccccc1CNC
3484
+ cc3c21
3485
+ NCCCCCN
3486
+ c2oc3ccc
3487
+ c1cc2n
3488
+ COCCCn1c
3489
+ CCn1c2ccccc2c2cc
3490
+ c2ncccc2F
3491
+ Sc2cccc
3492
+ ##Oc3ccc
3493
+ ##5CCCC5
3494
+ ##sc2C
3495
+ ##c3ccccc23
3496
+ NCN
3497
+ COc4ccccc4
3498
+ c3oc2
3499
+ ##n2ncc
3500
+ C3CCCO3
3501
+ N23
3502
+ n2ncc3cc
3503
+ CCCCc1cc
3504
+ c3ccccc3n
3505
+ CCCNCC
3506
+ ##CCC21
3507
+ C1CC2C
3508
+ CN1C2
3509
+ CCCCN2CCN
3510
+ CCS2
3511
+ ##sccc4
3512
+ CCOc1cc2c
3513
+ ##cnccc23
3514
+ c2cc3ccccc3s2
3515
+ c2cc1OCC
3516
+ CC1COCCN1c1nc
3517
+ n1nnnc1C
3518
+ Cn4c
3519
+ ##c2c1c
3520
+ ##c3ncccc
3521
+ COc2ccccc2C
3522
+ CCCCCC3
3523
+ ##c2ccc3
3524
+ CC2SC
3525
+ CSc3ccc
3526
+ Nc1ncccc
3527
+ ##CN1CC
3528
+ CCCCCCCNC
3529
+ OCCOc2ccc
3530
+ Cn1cc2c
3531
+ Nc3ccccc3Cl
3532
+ ##nc5c
3533
+ noc1
3534
+ Nc4nccc
3535
+ c1nc2n
3536
+ Nn3c
3537
+ nc4c
3538
+ ##2ncc
3539
+ CCCc2c
3540
+ cc2c2cc
3541
+ ##OC1CN
3542
+ ccnc2
3543
+ ##c2ccccc2c
3544
+ c2ccccc2NC1
3545
+ c45
3546
+ c3ccccc3n2C
3547
+ ##nnc1
3548
+ ccc2S
3549
+ c1cccc2cc
3550
+ ##c1csc
3551
+ ##c1coc
3552
+ CCC1NC
3553
+ CCC1CC2
3554
+ Cc3ccc4
3555
+ N1CCCc2cc
3556
+ Nc1ccccc1N
3557
+ ##nccc3
3558
+ ##N1CCC2
3559
+ Oc2ccc3ccccc3c2
3560
+ c1ncccc1C
3561
+ cccc3c2
3562
+ C1CC1c1ccccc1
3563
+ C23CCC
3564
+ nc43
3565
+ CCOc1ccccc1N1CCN
3566
+ CN4CCCC4
3567
+ c2ncccc21
3568
+ C1Cc2ccccc2CN1C
3569
+ 2n
3570
+ OB
3571
+ oc3ccccc32
3572
+ CCc3cccc
3573
+ CCn3c
3574
+ OCc3cn
3575
+ ccc6
3576
+ CCCCn1cc
3577
+ CC3N
3578
+ C1Cc1ccccc1
3579
+ ##C1CCCC1
3580
+ ##3CO
3581
+ cc4n3
3582
+ c5ncc
3583
+ CN2CCS
3584
+ ##2CCNCC2
3585
+ CC1CCCCN1
3586
+ CCOc1ccccc1N
3587
+ Oc1cccc2ccccc12
3588
+ Nc1nncs1
3589
+ ##c1cncnc1
3590
+ NC2CCCc3ccccc32
3591
+ ncc1Br
3592
+ ##n2cnnc2
3593
+ NC1C2CC3CC1CC
3594
+ 3ccc
3595
+ OCCC3
3596
+ Oc4cccc
3597
+ ##OCCC
3598
+ ##c2nc3ccc
3599
+ OC2CN
3600
+ CCCc1nc2c
3601
+ CNc1ccccc1
3602
+ ##1C1
3603
+ N2CCCC3
3604
+ c1ccccc1OCC
3605
+ c2coc3cc
3606
+ NCCc1ccccn1
3607
+ nc2scc
3608
+ ##C1CCCCC1
3609
+ COc1cccc2ccccc12
3610
+ CN2CCOC
3611
+ CCC1O
3612
+ N1CCSCC1
3613
+ Nc1ncn
3614
+ NCCCc2ccccc2
3615
+ ##2ccccc2c1C
3616
+ Nc2cccc3
3617
+ Cc2noc
3618
+ CCn1c2c
3619
+ cccc31
3620
+ c1cccnc1Cl
3621
+ ##sccc23
3622
+ Nc1nccn2c
3623
+ c2cccc3cccc
3624
+ c3cnn4
3625
+ CC1CCNC1
3626
+ c2cc3cccc
3627
+ ##c2noc
3628
+ ##n1cccn1
3629
+ Cn2cccn2
3630
+ ##c2ncccc21
3631
+ SCCCN
3632
+ nc4ccc
3633
+ ##5CC
3634
+ CCn2cc
3635
+ ##c2nnn
3636
+ c1c2ccc
3637
+ NCc1nnc
3638
+ CNc2ccccc2
3639
+ ##CCOCC6
3640
+ c3ccccc3S2
3641
+ CNC1C
3642
+ Cc2ccc3
3643
+ c1Cc1ccccc1
3644
+ NC2CCCC
3645
+ cc1CO
3646
+ Nc2cnn
3647
+ CCCCCc1cc
3648
+ ##N1CCCC
3649
+ c2cccnc2Oc2ccc
3650
+ c3cccnc3N
3651
+ c1nc2ccccc2c
3652
+ n1cccn1
3653
+ CCN3CC2CC2
3654
+ C1Cc2ccccc2CN1
3655
+ ##CCCN1S
3656
+ Cn2nnc3ccccc32
3657
+ ##Oc2ccccc21
3658
+ c1I
3659
+ c2c1cc
3660
+ NCc3ccncc3
3661
+ OC3C2
3662
+ C1CCCCC1C
3663
+ ##1CNC
3664
+ c4Cl
3665
+ CC2CCCN2C
3666
+ ##CCO1
3667
+ ##nccs4
3668
+ CCCC12
3669
+ Cc1cc2ccc
3670
+ CSc3nc
3671
+ ##CC3CC3
3672
+ c3cc5c
3673
+ Nc2ccc3ccccc3c2
3674
+ N2CCNC
3675
+ NCCN2C
3676
+ CN1Cc2c
3677
+ N2CCSCC2
3678
+ Cn2cncc
3679
+ CCCOc1ccc2c
3680
+ OCCN2CCOCC2
3681
+ Nc2cnc
3682
+ OCCCCCCCCCCCC
3683
+ sc23
3684
+ sc2c1CCC2
3685
+ ##c5ccccc54
3686
+ ##sc3n2
3687
+ Oc2cccc3
3688
+ OC4CCN
3689
+ NCc4ccco4
3690
+ Cn1cnnc1
3691
+ CSc1nc2ccc
3692
+ nnc3s2
3693
+ CC1C21CC1
3694
+ cn2c1N
3695
+ 3c
3696
+ cncc3
3697
+ COc3cc
3698
+ CCCCCOc1ccc
3699
+ CN2C1
3700
+ C2c3
3701
+ C2CCCCCC2
3702
+ ##OCO4
3703
+ ##CCCCO1
3704
+ n2c3c
3705
+ CNCc1cc
3706
+ OCC4
3707
+ nc2c1ncn2C
3708
+ c3cc4
3709
+ C4CCCN
3710
+ ##c2ncnc
3711
+ NC2c3ccccc3
3712
+ ##c4ccccc4n
3713
+ C1O5
3714
+ ##c1ncccc1
3715
+ c1cnc2ccccc2c1
3716
+ cc2c1NC
3717
+ nn3c
3718
+ CCCCCCCCOC
3719
+ sc2c1CCN
3720
+ NCc3ccccc3Cl
3721
+ n2ccc3cc
3722
+ ##c1ncn2C1CC
3723
+ c1cc2cccc
3724
+ COc1c2c
3725
+ CSc1nc2ccccc2c
3726
+ Nc3nc4ccccc4s3
3727
+ nc2ccccn12
3728
+ 3c2
3729
+ 3n2
3730
+ ##sc3ccccc3
3731
+ ##CCc2ccccc2
3732
+ ##c1C2
3733
+ CCc3cc
3734
+ c1sc2
3735
+ C1c1cc
3736
+ C13C
3737
+ Clc1ccccc1C
3738
+ CNc2c
3739
+ C2CC3CC
3740
+ ##NC12
3741
+ c2ccccc2n1C
3742
+ c4OC2C
3743
+ CCN2CCCC2
3744
+ CCCCc1ncc
3745
+ CNC2CCN
3746
+ CN1c1ccc
3747
+ nn1CC
3748
+ Oc2cccnc2
3749
+ CCCCNS
3750
+ n2Cc1ccccc1
3751
+ cn4C3
3752
+ ##c3ncn
3753
+ Nc3ccnc
3754
+ CCc1ccccc1N
3755
+ Nc4ccc5
3756
+ ##OC2OC
3757
+ CN4CCCCC4
3758
+ ##CCCCCCCCCCC
3759
+ Cc1cc2oc
3760
+ c2nccnc2C2CN
3761
+ nc3ccccc3
3762
+ sc2ccc
3763
+ c2S
3764
+ ##ccccc7
3765
+ c3o
3766
+ c3CC
3767
+ CNN
3768
+ ##OCO3
3769
+ ##CCCCCCC
3770
+ c4sccc4
3771
+ N2NC
3772
+ ##CCCCC3C2
3773
+ c2ccnc3
3774
+ ##c3ccccc3N
3775
+ ##nc2sc3c
3776
+ ##c2csc
3777
+ c3cc12
3778
+ C4C3
3779
+ cc4o3
3780
+ cc1OCc1ccccc1
3781
+ N2Cc3cc
3782
+ Nc1ccccc12
3783
+ CCC2CCCCC2
3784
+ Nc2ccnc
3785
+ c3c2N
3786
+ CCS3
3787
+ N2CCc3ccc
3788
+ ##cnn2C
3789
+ NCCCN2CCC
3790
+ NCCCN3CCN
3791
+ ccc4Cl
3792
+ OC3CCCC3
3793
+ NCc1ccccc1F
3794
+ Nc3ccncc3
3795
+ n3cnc
3796
+ CN4CC
3797
+ ##cnccc34
3798
+ ncnc2s1
3799
+ CCCCOc1cc
3800
+ CN2CCc3c
3801
+ C1C2C3C
3802
+ Oc2ncc
3803
+ c2n1Cc1ccc
3804
+ ##c3nc4cc
3805
+ CCCn2c
3806
+ CC12CCN
3807
+ c2ccccc2N1C
3808
+ C31
3809
+ CCCCN1CC
3810
+ ##nc2c1C
3811
+ c3ccccc3nc12
3812
+ NCCc1cccc
3813
+ NCCc3c
3814
+ C1C5
3815
+ ccc1N1CCCC1
3816
+ ##C1CCC2
3817
+ NNc2ccccc2
3818
+ CCCN2
3819
+ nc3nc
3820
+ nc3sc4c
3821
+ NCCN1CCC
3822
+ Nc2ncccc2
3823
+ N1CCCCN1CCN
3824
+ ##CCC1CC2
3825
+ Nc2cc3c
3826
+ OCCOCCO
3827
+ CCCCNc1nc
3828
+ CCCCN1CCN
3829
+ C1Nc2c
3830
+ CCn1cnc2c
3831
+ ccc4c23
3832
+ n2ncnc2n1
3833
+ Cc1cnc2nc
3834
+ ##4ccccc43
3835
+ COc1ccc2nc3cc
3836
+ NOC3
3837
+ NCCOc2ccccc2
3838
+ c1cc2cnc
3839
+ noc2
3840
+ CCc1sc
3841
+ C2CNCCO2
3842
+ COCCN1CCN
3843
+ C6O
3844
+ c2cc1NC
3845
+ ncnc2cc1OCCCN
3846
+ COc1ncccc1C
3847
+ n2Cc2ccco2
3848
+ Nc5
3849
+ ##cc3
3850
+ cc2nc1
3851
+ C2c3ccccc3C
3852
+ ##CCCCCCN
3853
+ ##2C2
3854
+ ##c2ccccc2C2
3855
+ CCN3CCCC3
3856
+ ##CCCCCN
3857
+ Cc1ccoc1C
3858
+ OCC2CO
3859
+ CC3CCOCC3
3860
+ CCOC1OC
3861
+ ##nc3n2
3862
+ ##c4ccccc4O3
3863
+ CN12
3864
+ c2nsc3ccccc23
3865
+ OC1CC2C
3866
+ c1cnc2cc
3867
+ c1nn2c
3868
+ OCCN2CCCC2
3869
+ cn3n2
3870
+ NCCOCCO
3871
+ Cc4cccnc4
3872
+ Fc1ccc2c
3873
+ CSCc1ccccc1
3874
+ ccc1Nc1nc
3875
+ c2ccc3ncsc3c2
3876
+ cccc43
3877
+ c2nnnn2
3878
+ c2cc3n
3879
+ Oc2ncccc2C
3880
+ CC1CCCCOC
3881
+ C4CCNCC4
3882
+ n4ccnc4
3883
+ Cc1sc2ncnc
3884
+ Cc2cc3ccccc3nc2
3885
+ N2Cc3ccccc3CC2C
3886
+ cs4
3887
+ NCc2cnc
3888
+ COCCN1CCC
3889
+ C1c2
3890
+ Cc1ccc2ccc
3891
+ c1ccccc1N1CCN
3892
+ ##ncc2C1
3893
+ ##c3ccccc3C1
3894
+ Cc1ccoc1
3895
+ CCOCC4
3896
+ CCOc1ncccc1C
3897
+ ##n3cccc
3898
+ Cc1ccccc1CN
3899
+ ccc2N2CCOCC2
3900
+ CCCN2CCC
3901
+ ##c2ncn
3902
+ ccc3s2
3903
+ ccc3ccccc32
3904
+ c5cn
3905
+ NNC2
3906
+ CN1N
3907
+ c2cnn3c
3908
+ OC2CC3C
3909
+ ncc21
3910
+ c1nonc1
3911
+ Cc2nc3ccc
3912
+ n2Cc1ccc
3913
+ NCCCN2
3914
+ CCCO2
3915
+ Nc3ccccc3OC
3916
+ CSc2ncc
3917
+ c2ccncc2NC
3918
+ cnc2nc
3919
+ NC4CCN
3920
+ c5ccco5
3921
+ ccn12
3922
+ c2sc3ccccc3
3923
+ ##CN1CCC2
3924
+ c2nnc3sc
3925
+ OC5OC
3926
+ ##c2ncccc2C
3927
+ ccc1Nc1ncc2c
3928
+ cncc1Cl
3929
+ oc4c3
3930
+ cccn2c1N
3931
+ oc3c
3932
+ ##2O
3933
+ ##oc2C
3934
+ ##Sc3ccccc32
3935
+ ##6CC
3936
+ ##cc2ccccc12
3937
+ ##CCc2ccccc21
3938
+ c2N1
3939
+ COCCCOc1cc
3940
+ CCCc1nn
3941
+ C2S1
3942
+ ##1CO
3943
+ c2ccccc2n
3944
+ ##CCCN1CCOCC1
3945
+ ccc2nc1
3946
+ c3cc4ccc
3947
+ NC1CCOC1
3948
+ C2Cc2ccccc2
3949
+ C2Cc3cc
3950
+ c1COC
3951
+ c2c1CCC2
3952
+ NC2CCS
3953
+ NNC1
3954
+ nc3s2
3955
+ CN1S
3956
+ CCC1CCCCC1
3957
+ NCCN1CCCCC1
3958
+ OC2CC3
3959
+ c2ccc3oc
3960
+ c1ncccc1
3961
+ CCCCCCS
3962
+ Nc2ncnc
3963
+ Nc2ncnc3c2
3964
+ C1OC1C
3965
+ C2CCNC2
3966
+ n4cn
3967
+ CSc2nc3cc
3968
+ c5ccccc5c4
3969
+ OCC23
3970
+ c1NS
3971
+ Cc3nc4ccccc4
3972
+ c1ccccc1Nc1ccc2c
3973
+ c1sccc1NC
3974
+ cc1C21NC
3975
+ 2ccccc2
3976
+ oc3ccc
3977
+ ##N3C
3978
+ ##sc2ccccc2c1
3979
+ ##CC2C1
3980
+ CCc2nc
3981
+ c2scc
3982
+ c2c1ccc1
3983
+ COCCN1
3984
+ CCCc1n
3985
+ c2cccn2
3986
+ ccn3C
3987
+ ##n2c1n
3988
+ ##CCOc2cc
3989
+ ##ncc1C
3990
+ COCc1c
3991
+ Cc2ccc3cc
3992
+ nc1S
3993
+ NC2CCOCC2
3994
+ CCCCCCC1
3995
+ Nc1cnn
3996
+ nc3sc
3997
+ CN2CC3
3998
+ CC1Cc2ccccc2N1C
3999
+ CCSc1ccc
4000
+ N2CCc3ncnc
4001
+ ##n1Cc1cccc
4002
+ C1OC1OC
4003
+ C1NCN
4004
+ C1NC2CCC1C2
4005
+ CSc2nc3c
4006
+ COC1CCC
4007
+ NCC2CCC
4008
+ NC1CO
4009
+ c1sc2cc
4010
+ cnc34
4011
+ N1c2ccccc2Sc2ccccc21
4012
+ c1sc2ccccc2c1Cl
4013
+ n2c1COCC2
4014
+ ##oc3c2
4015
+ c2I
4016
+ OCc5ccc
4017
+ cc2CN
4018
+ ##CCCCO2
4019
+ ccnc12
4020
+ C34C
4021
+ CCNc1ncc
4022
+ CCN4CCOCC4
4023
+ ##nn5
4024
+ CNCc3ccc
4025
+ NCCS2
4026
+ OCCc2ccc
4027
+ ##CCCN1CC
4028
+ NN1CCOCC1
4029
+ ##c2cccc3c2
4030
+ c3cnc4c
4031
+ c4ccc5ccccc5c4
4032
+ ccc3n
4033
+ c4ccccc4O
4034
+ ##nc45
4035
+ Nc1cccc2c
4036
+ N2Cc1ccc
4037
+ Nc2onc
4038
+ Nc1ncnc2c
4039
+ CCC34
4040
+ CC1Cc2c
4041
+ Cc2coc
4042
+ ##12CC3CC
4043
+ Cn1ccnc1C
4044
+ ##ncccc23
4045
+ CCCCCCOC
4046
+ cc2c1Nc1ccc
4047
+ OCCN2CCN
4048
+ NCCCCc1ccccc1
4049
+ Nc3ccccc3S
4050
+ c1cccnc1Oc1ccc
4051
+ nn32
4052
+ Fc1ccc2
4053
+ n2cnc3ccccc32
4054
+ OCCCN3CCCCC3
4055
+ COCCNc1nc
4056
+ C1CC2CCC
4057
+ CSc1nnnn1
4058
+ C1CCC13CC
4059
+ CN1CCC23c4c5ccc
4060
+ c2sccc2n1
4061
+ n2C1OC
4062
+ N4CCCCCC4
4063
+ n2nnnc2SCC
4064
+ NCCCCC1
4065
+ on4
4066
+ cc1CC2
4067
+ OCc4cccc
4068
+ ##n1c2ccccc2
4069
+ ##2CNC
4070
+ c2ccccc2oc1
4071
+ ##c1ccccc1O
4072
+ n1nnc
4073
+ n1nnnc1
4074
+ c1ccccc1CC2
4075
+ OCCc2ccccc2
4076
+ Cc2ccccc2C1
4077
+ Nc1cccc2cccnc12
4078
+ N2Cc2ccccc2
4079
+ c1cnccc
4080
+ Cc1ncsc1
4081
+ Oc1ccc2cc
4082
+ CC1COC
4083
+ C2Oc3c
4084
+ Nc2cccc3c2
4085
+ ccc4ccccc34
4086
+ CCCC12C
4087
+ n2cnnc2
4088
+ ##nc4ccccc43
4089
+ c1cc2ccccc2cc1O
4090
+ Cc1nc2nc
4091
+ c1ccno1
4092
+ c5cnc
4093
+ sc4c3
4094
+ n1ccc2cc
4095
+ C2COc3ccccc3O2
4096
+ cncc2Cl