0 B5R1.1 C1=COC=N1 SPC-m896 [0,0,0,0,0,0|1,0,1]=2 1 B6R1.2 BrC1=CC=NN1 SPC-n183 [0,1,0,0,0,0|1,0,0]=2 2 B6R1.2 BrC1=NC=NN1 SPC-g148 [0,1,0,0,0,0|2,0,0]=3 3 B6R1.2 BrC1=NN=CS1 SPC-h716 [0,1,0,0,0,0|2,0,1]=4 4 B6R1.2 CC1=CNC=C1 SPC-m068 [0,1,0,0,0,0|0,0,0]=1 5 B6R1.2 CC1=CNN=C1 SPC-n152 [0,1,0,0,0,0|1,0,0]=2 6 B6R1.2 CC1=COC=N1 SPC-n151 [0,1,0,0,0,0|1,0,1]=3 7 B6R1.2 CC1=CSC=N1 SPC-g112 [0,1,0,0,0,0|1,0,1]=3 8 B6R1.2 ClC1=CSC=C1 SPC-t726 [0,1,0,0,0,0|1,0,0]=2 9 B6R1.2 ClC1=CSC=N1 SPC-n125 [0,1,0,0,0,0|1,0,1]=3 10 B6R1.2 ClC1=NNC=C1 SPC-j937 [0,1,0,0,0,0|1,0,0]=2 11 B6R1.2 FC1=CNN=C1 SPC-k134 [0,1,0,0,0,0|1,0,0]=2 12 B6R1.2 FC1=NNC=C1 SPC-j936 [0,1,0,0,0,0|1,0,0]=2 13 B6R1.2 IC1=CC=NN1 SPC-p388 [0,1,0,0,0,0|1,0,0]=2 14 B6R1.2 IC1=CNN=C1 SPC-g139 [0,1,0,0,0,0|1,0,0]=2 15 B6R1.2 IC1=COCC1 SPC-t718 [0,1,0,0,0,0|1,0,2]=4 16 B6R1.2 IC1=NC=CO1 SPC-m994 [0,1,0,0,0,0|1,0,1]=3 17 B6R1.2 NC1=CC=NN1 SPC-g055 [0,1,0,0,0,0|1,0,0]=2 18 B6R1.2 NC1=CN=CS1 SPC-u196 [0,1,0,0,0,0|1,0,1]=3 19 B6R1.2 NC1=CNN=C1 SPC-p006 [0,1,0,0,0,0|1,0,0]=2 20 B6R1.2 NC1=CSN=C1 SPC-r370 [0,1,0,0,0,0|1,0,1]=3 21 B6R1.2 NC1=NC=CN1 SPC-g069 [0,1,0,0,0,0|1,0,0]=2 22 B6R1.2 NC1=NOC=C1 SPC-j749 [0,1,0,0,0,0|1,0,1]=3 23 B6R1.2 NN1C=CC=C1 SPC-j724 [0,1,0,0,0,0|0,0,0]=1 24 B6R1.2 O=C1C=CCC1 SPC-g207 [0,1,0,0,0,0|1,0,1]=3 25 B6R1.2 O=C1C=CCO1 SPC-t619 [0,1,0,0,0,0|1,0,1]=3 26 B6R1.2 O=C1C=CNN1 SPC-p382 [0,1,0,0,0,0|1,0,0]=2 27 B6R1.2 O=C1CCNC1 SPC-g182 [0,1,0,0,0,0|0,0,3]=4 28 B6R1.2 OC1CC=CC1 SPC-n355 [0,1,0,0,0,0|1,0,2]=4 29 B6R1.2 ON1C=CC=N1 SPC-r119 [0,1,0,0,0,0|1,0,0]=2 30 B6R1.2 S=C1N=CNN1 SPC-s197 [0,1,0,0,0,0|2,0,0]=3 31 B4R0.2 C=CCCO SPC-t137 [0,0,1,0,0,0|1,0,2]=4 32 B4R1.1 C1CNC1 SPC-g160 [0,0,0,0,1,0|0,0,3]=4 33 B4R1.1 C1CNC1 SPC-p889 [0,0,0,0,1,0|0,0,3]=4 34 B4R1.1 C1CNC1 SPC-p889 [0,0,0,0,1,0|0,0,3]=4 35 B6R1.1 C1=CCNCC1 SPC-g659 [0,0,0,0,0,1|0,0,2]=3 36 B6R1.1 C1=CCOCC1 SPC-h047 [0,0,0,0,0,1|1,0,2]=4 37 B5R1.2 O=C1CCN1 SPC-t120 [0,1,0,0,1,0|0,0,2]=4 38 B5R1.2 O=C1CNC1 SPC-h722 [0,1,0,0,1,0|0,0,2]=4 39 B7R1.3 BrC1=CC=NC=C1 SPC-k219 [0,1,0,0,0,1|0,0,1]=3 40 B7R1.3 BrC1=CN=CN=C1 SPC-g345 [0,1,0,0,0,1|0,0,1]=3 41 B7R1.3 BrC1=NC=CC=N1 SPC-s847 [0,1,0,0,0,1|0,0,1]=3 42 B7R1.3 BrC1=NN=CC=C1 SPC-t686 [0,1,0,0,0,1|0,0,1]=3 43 B7R1.3 CC1=CC=CN=N1 SPC-g427 [0,1,0,0,0,1|0,0,1]=3 44 B7R1.3 CC1=CCCNC1 SPC-m637 [0,1,0,0,0,1|0,0,2]=4 45 B7R1.3 CC1=CCNCC1 SPC-h455 [0,1,0,0,0,1|0,0,2]=4 46 B7R1.3 CC1=CN=NC=C1 SPC-g520 [0,1,0,0,0,1|0,0,1]=3 47 B7R1.3 CC1=NC=CC=N1 SPC-u374 [0,1,0,0,0,1|0,0,1]=3 48 B7R1.3 CC1=NC=NC=C1 SPC-g053 [0,1,0,0,0,1|0,0,1]=3 49 B7R1.3 ClC1=NN=CC=C1 SPC-h220 [0,1,0,0,0,1|0,0,1]=3 50 B7R1.3 FC1=NC=CC=C1 SPC-m992 [0,1,0,0,0,1|0,0,1]=3 51 B7R1.3 IC1=NC=CC=N1 SPC-t866 [0,1,0,0,0,1|0,0,1]=3 52 B7R1.3 IC1=NC=CN=C1 SPC-m717 [0,1,0,0,0,1|0,0,1]=3 53 B7R1.3 NC1=CC=CN=N1 SPC-j168 [0,1,0,0,0,1|0,0,1]=3 54 B7R1.3 NC1=CN=NC=C1 SPC-j087 [0,1,0,0,0,1|0,0,1]=3 55 B7R1.3 NC1=CN=NC=C1 SPC-u396 [0,1,0,0,0,1|0,0,1]=3 56 B7R1.3 NC1=NC=CN=C1 SPC-g316 [0,1,0,0,0,1|0,0,1]=3 57 B7R1.3 O=C1C=CC=NN1 SPC-g446 [0,1,0,0,0,1|0,0,0]=2 58 B7R1.3 O=C1C=CCOC1 SPC-s270 [0,1,0,0,0,1|1,0,1]=4 59 B7R1.3 O=C1C=CN=CN1 SPC-n087 [0,1,0,0,0,1|0,0,0]=2 60 B7R1.3 OC1=CC=NC=C1 SPC-g124 [0,1,0,0,0,1|0,0,1]=3 61 B7R1.3 OC1=CN=CN=C1 SPC-k979 [0,1,0,0,0,1|0,0,1]=3 62 B7R1.3 [O-]C1=CC=CC=C1 SPC-k243 [0,1,0,0,0,1|1,0,0]=3 63 B7R1.3 [S-]C1=CC=CC=C1 SPC-t743 [0,1,0,0,0,1|1,0,0]=3 64 B7R1.3 [SiH3]C1=CC=CC=C1 SPC-r404 [0,1,0,0,0,1|1,0,0]=3 65 B7R1.1 C#CC1=CNN=C1 SPC-n145 [0,2,0,0,0,0|1,0,0]=3 66 B7R1.1 COC1=CNN=C1 SPC-p580 [0,2,0,0,0,0|1,0,0]=3 67 B7R1.1 ClCC1=CSC=N1 SPC-g086 [0,2,0,0,0,0|1,0,1]=4 68 B7R1.1 N#CC1=CC=CN1 SPC-m922 [0,2,0,0,0,0|0,0,0]=2 69 B7R1.1 N#CC1=CNN=C1 SPC-h236 [0,2,0,0,0,0|1,0,0]=3 70 B7R1.1 N#CC1=COC=N1 SPC-n935 [0,2,0,0,0,0|1,0,1]=4 71 B7R1.1 N#CC1=NC=CN1 SPC-h841 [0,2,0,0,0,0|1,0,0]=3 72 B7R1.1 N#CC1=NC=CN1 SPC-m914 [0,2,0,0,0,0|1,0,0]=3 73 B7R1.1 N#CC1=NOC=C1 SPC-n930 [0,2,0,0,0,0|1,0,1]=4 74 B7R1.1 NCC1=CN=CO1 SPC-u502 [0,2,0,0,0,0|1,0,1]=4 75 B7R1.1 NCC1=CN=CS1 SPC-n637 [0,2,0,0,0,0|1,0,1]=4 76 B7R1.1 NCC1=CNC=N1 SPC-n641 [0,2,0,0,0,0|1,0,0]=3 77 B7R1.1 NCC1=CNN=C1 SPC-h529 [0,2,0,0,0,0|1,0,0]=3 78 B7R1.1 NCC1=CNN=C1 SPC-u445 [0,2,0,0,0,0|1,0,0]=3 79 B7R1.1 NCC1=COC=N1 SPC-n934 [0,2,0,0,0,0|1,0,1]=4 80 B7R1.1 NCC1=CON=C1 SPC-t984 [0,2,0,0,0,0|1,0,1]=4 81 B7R1.1 NCC1=NC=CS1 SPC-m756 [0,2,0,0,0,0|1,0,1]=4 82 B7R1.1 NCC1=NOC=C1 SPC-k851 [0,2,0,0,0,0|1,0,1]=4 83 B7R1.1 O=CC1=CC=NN1 SPC-p008 [0,2,0,0,0,0|1,0,0]=3 84 B7R1.1 O=CC1=CN=CS1 SPC-s113 [0,2,0,0,0,0|1,0,1]=4 85 B7R1.1 O=CC1=CNN=C1 SPC-g855 [0,2,0,0,0,0|1,0,0]=3 86 B7R1.1 O=CC1=CNN=C1 SPC-k121 [0,2,0,0,0,0|1,0,0]=3 87 B7R1.1 O=CC1=COC=N1 SPC-m897 [0,2,0,0,0,0|1,0,1]=4 88 B7R1.1 O=CC1=CSC=C1 SPC-g519 [0,2,0,0,0,0|1,0,0]=3 89 B7R1.1 O=CC1=NC=CN1 SPC-n997 [0,2,0,0,0,0|1,0,0]=3 90 B7R1.1 O=CC1=NC=CS1 SPC-s112 [0,2,0,0,0,0|1,0,1]=4 91 B7R1.1 OCC1=CNC=N1 SPC-s789 [0,2,0,0,0,0|1,0,0]=3 92 B7R1.1 OCC1=CNN=C1 SPC-j657 [0,2,0,0,0,0|1,0,0]=3 93 B7R1.1 OCC1=COC=N1 SPC-k823 [0,2,0,0,0,0|1,0,1]=4 94 B7R1.1 OCC1=NNC=C1 SPC-j656 [0,2,0,0,0,0|1,0,0]=3 95 B7R1.1 OCC1=NOC=C1 SPC-k850 [0,2,0,0,0,0|1,0,1]=4 96 B7R1.2 BrC1=CC(Br)=NN1 SPC-s266 [0,2,0,0,0,0|1,0,0]=3 97 B7R1.2 BrC1=CN=C(I)N1 SPC-t039 [0,2,0,0,0,0|1,0,0]=3 98 B7R1.2 BrC1=CSC(Br)=N1 SPC-g314 [0,2,0,0,0,0|1,0,1]=4 99 B7R1.2 CC1=CC(Cl)=NN1 SPC-j294 [0,2,0,0,0,0|1,0,0]=3 100 B7R1.2 CC1=CC(N)=NN1 SPC-g654 [0,2,0,0,0,0|1,0,0]=3 101 B7R1.2 CC1=CN(C)N=C1 SPC-s115 [0,2,0,0,0,0|1,0,0]=3 102 B7R1.2 CC1=NC(Br)=CS1 SPC-r369 [0,2,0,0,0,0|1,0,1]=4 103 B7R1.2 CC1=NN(C)C=C1 SPC-g247 [0,2,0,0,0,0|1,0,0]=3 104 B7R1.2 CC1=NNC(C)=N1 SPC-j293 [0,2,0,0,0,0|2,0,0]=4 105 B7R1.2 CN1C=C(Br)C=N1 SPC-g070 [0,2,0,0,0,0|1,0,0]=3 106 B7R1.2 CN1C=C(I)C=N1 SPC-g007 [0,2,0,0,0,0|1,0,0]=3 107 B7R1.2 CN1C=C(N)C=N1 SPC-g585 [0,2,0,0,0,0|1,0,0]=3 108 B7R1.2 CN1C=C(N)C=N1 SPC-p030 [0,2,0,0,0,0|1,0,0]=3 109 B7R1.2 CN1C=CC(Br)=N1 SPC-g829 [0,2,0,0,0,0|1,0,0]=3 110 B7R1.2 CN1C=CC(Cl)=N1 SPC-v037 [0,2,0,0,0,0|1,0,0]=3 111 B7R1.2 CN1C=CC(I)=N1 SPC-u127 [0,2,0,0,0,0|1,0,0]=3 112 B7R1.2 CN1C=C[N+](C)=C1 SPC-m458 [0,2,0,0,0,0|1,0,0]=3 113 B7R1.2 CN1C=NC(I)=C1 SPC-g586 [0,2,0,0,0,0|1,0,0]=3 114 B7R1.2 ClC1=CSC(Br)=N1 SPC-t993 [0,2,0,0,0,0|1,0,1]=4 115 B7R1.2 FC1=CN=C(Br)S1 SPC-m590 [0,2,0,0,0,0|1,0,1]=4 116 B7R1.2 NC1=CC(Br)=NN1 SPC-k030 [0,2,0,0,0,0|1,0,0]=3 117 B7R1.2 NC1=CC(Cl)=NN1 SPC-j892 [0,2,0,0,0,0|1,0,0]=3 118 B7R1.2 NC1=CC(F)=NN1 SPC-h042 [0,2,0,0,0,0|1,0,0]=3 119 B7R1.2 NC1=CC(O)=NN1 SPC-n036 [0,2,0,0,0,0|1,0,0]=3 120 B7R1.2 NC1=CSC(Cl)=C1 SPC-k871 [0,2,0,0,0,0|1,0,0]=3 121 B7R1.2 NC1=NC=C(Cl)S1 SPC-m588 [0,2,0,0,0,0|1,0,1]=4 122 B7R1.2 NC1=NC=C(F)S1 SPC-m589 [0,2,0,0,0,0|1,0,1]=4 123 B7R1.2 NC1=NC=C(F)S1 SPC-n215 [0,2,0,0,0,0|1,0,1]=4 124 B7R1.2 O=C1CNC(=O)C1 SPC-n497 [0,2,0,0,0,0|0,0,2]=4 125 B7R1.4 BrC1=C(I)C=NN1 SPC-m504 [0,2,0,0,0,0|1,0,0]=3 126 B7R1.4 CC1=C(Br)NN=C1 SPC-i582 [0,2,0,0,0,0|1,0,0]=3 127 B7R1.4 CC1=C(C)NN=C1 SPC-s309 [0,2,0,0,0,0|1,0,0]=3 128 B7R1.4 CC1=C(Cl)N=CN1 SPC-q880 [0,2,0,0,0,0|1,0,0]=3 129 B7R1.4 CC1=C(N)NN=C1 SPC-h585 [0,2,0,0,0,0|1,0,0]=3 130 B7R1.4 CC1=C(N)SC=N1 SPC-u799 [0,2,0,0,0,0|1,0,1]=4 131 B7R1.4 CC1=CSC=C1N SPC-p592 [0,2,0,0,0,0|1,0,0]=3 132 B7R1.4 CN1N=CC=C1N SPC-s781 [0,2,0,0,0,0|1,0,0]=3 133 B7R1.4 ClC1=C(Br)NN=C1 SPC-v128 [0,2,0,0,0,0|1,0,0]=3 134 B7R1.4 ClC1=C(I)SC=C1 SPC-u292 [0,2,0,0,0,0|1,0,0]=3 135 B7R1.4 FC1=C(Br)NN=C1 SPC-u034 [0,2,0,0,0,0|1,0,0]=3 136 B7R1.4 FC1=NNC=C1Br SPC-m495 [0,2,0,0,0,0|1,0,0]=3 137 B7R1.4 NC1=C(Br)C=NN1 SPC-g516 [0,2,0,0,0,0|1,0,0]=3 138 B7R1.4 NC1=CNN=C1N SPC-j423 [0,2,0,0,0,0|1,0,0]=3 139 B7R1.4 NC1=CSC=C1Br SPC-n124 [0,2,0,0,0,0|1,0,0]=3