0 B9R1.8 N#CCC1=NC=CC=C1 BB53-1348 [0,0,0,0,0,0|1,0,2]=3 1 B9R1.8 O=C=NC1=CC=NC=C1 BB01-6559 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 BB56-0588 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.8 [C-]#[N+]CC1=CC=CN=C1 BB56-1200 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.1 CNCC1=CC=C(Cl)N=C1 BB53-1663 [0,1,0,0,0,0|3,0,0]=4 5 B10R1.1 CNCC1=CC=C(O)C=C1 BB12-1375 [0,1,0,0,0,0|2,0,0]=3 6 B10R1.1 CSCC1=CC=C(Cl)N=C1 BB53-1554 [0,1,0,0,0,0|3,0,0]=4 7 B10R1.1 N#CCC1=CC=C(N)C=C1 BB12-4851 [0,1,0,0,0,0|0,0,2]=3 8 B10R1.1 O\N=C\C1=CC=C(F)C=C1 BB12-1509 [0,1,0,0,0,0|2,0,1]=4 9 B10R1.1 [C-]#[N+]CC1=CC=C(Cl)C=C1 BB56-1770 [0,1,0,0,0,0|2,0,0]=3 10 B10R1.4 CC1=CC=CC=C1CCN BB12-2271 [0,1,0,0,0,0|0,0,0]=1 11 B10R1.4 CCNC1=CC=CC=C1N BB12-3022 [0,1,0,0,0,0|2,0,0]=3 12 B10R1.10 CC1=CC(\C=N\O)=CC=C1 BB20-3238 [0,1,0,0,0,0|2,0,1]=4 13 B10R1.10 CNCC1=CC(O)=CC=C1 BB12-1357 [0,1,0,0,0,0|2,0,0]=3 14 B10R1.15 CC(C=O)C1=CC=CC=C1 BB17-2274 [0,1,0,0,0,0|1,0,1]=3 15 B10R1.15 CCC(=O)C1=NC=CC=C1 BB12-2185 [0,1,0,0,0,0|2,0,1]=4 16 B10R1.15 CNC(C)C1=CC=CC=C1 BB12-1671 [0,1,0,0,0,0|2,0,0]=3 17 B10R1.15 N=C(NO)C1=CC=CC=C1 BB20-3129 [0,1,0,0,0,0|2,0,1]=4 18 B10R1.15 NC(CO)C1=CC=CC=C1 BB01-6618 [0,1,0,0,0,0|1,0,0]=2 19 B10R1.15 NCC(=O)C1=CC=CC=C1 BB26-0680 [0,1,0,0,0,0|0,0,1]=2 20 B10R1.15 NNC(=O)C1=CC=CC=C1 BB20-4243 [0,1,0,0,0,0|1,0,1]=3 21 B10R1.15 N\N=C(/N)C1=CC=CC=C1 BB10-1016 [0,1,0,0,0,0|1,0,1]=3 22 B10R1.15 [C-]#[N+]C(C)C1=CC=NC=C1 BB56-1680 [0,1,0,0,0,0|3,0,0]=4 23 B10R1.17 BrCCOC1=CC=CC=C1 BB17-1654 [0,1,0,0,0,0|1,0,0]=2 24 B10R1.17 N#CCCC1=NC=CC=C1 BB12-1756 [0,1,0,0,0,0|1,0,1]=3 25 B10R1.17 N#CNCC1=CN=CC=C1 BB12-1080 [0,1,0,0,0,0|1,0,2]=4 26 B10R1.17 NC\C=C\C1=CC=CC=C1 BB12-1612 [0,1,0,0,0,0|0,0,1]=2 27 B10R1.17 [C-]#[N+]CCC1=CC=NC=C1 BB56-1803 [0,1,0,0,0,0|1,0,1]=3 28 B10R2.7 C1=CC2=C(C=C1)NN=N2 BB01-6327 [0,0,0,1,0,0|2,0,0]=3 29 B10R2.7 C1=CC2=C(N=C1)NC=C2 BB12-3415 [0,0,0,1,0,0|1,0,2]=4 30 B8R1.8 BrCCN1C=CN=C1 BB12-2762 [0,0,0,0,1,0|3,0,0]=4 31 B8R1.8 CCCC1=CNN=C1 BB12-3540 [0,0,0,0,1,0|3,0,0]=4 32 B8R1.8 CCCN1C=CN=C1 BB12-1504 [0,0,0,0,1,0|3,0,0]=4 33 B8R1.8 N#CCC1=CSC=C1 BB20-4629 [0,0,0,0,1,0|1,0,2]=4 34 B8R1.8 NCCC1=CC=CO1 BB01-5388 [0,0,0,0,1,0|1,0,0]=2 35 B8R1.8 NCCN1C=CN=C1 BB56-2159 [0,0,0,0,1,0|2,0,0]=3 36 B8R1.8 NCCN1C=CN=C1 BB56-2917 [0,0,0,0,1,0|2,0,0]=3 37 B7R1.3 CC1=CC=NC=N1 BB17-0193 [2,0,0,0,0,0|2,0,0]=4 38 B9R1.1 CCC1=CN=C(O)N=C1 BB12-3538 [1,1,0,0,0,0|2,0,0]=4 39 B9R1.1 ClCC1=CC=C(Cl)N=C1 BB12-1167 [1,1,0,0,0,0|2,0,0]=4 40 B9R1.1 NCC1=CC=C(O)C=C1 BB12-1603 [1,1,0,0,0,0|0,0,0]=2 41 B9R1.1 NNC1=CC=C(I)C=C1 BB56-2534 [1,1,0,0,0,0|1,0,0]=3 42 B9R1.1 NNC1=CN=C(Cl)C=C1 BB12-1208 [1,1,0,0,0,0|2,0,0]=4 43 B9R1.1 NNC1=NC=C(F)C=C1 BB12-1190 [1,1,0,0,0,0|2,0,0]=4 44 B9R1.1 [C-]#[N+]C1=CC=C(Br)C=C1 BB56-0563 [1,1,0,0,0,0|1,0,1]=4 45 B9R1.1 [C-]#[N+]C1=CC=C(Cl)C=C1 BB56-1817 [1,1,0,0,0,0|1,0,1]=4 46 B9R1.1 [C-]#[N+]C1=CC=C(F)C=C1 BB56-1216 [1,1,0,0,0,0|1,0,1]=4 47 B9R1.2 CC1=CC(NN)=CC=C1 BB56-2532 [1,1,0,0,0,0|1,0,0]=3 48 B9R1.2 CCC1=CC=NC(N)=N1 BB12-3720 [1,1,0,0,0,0|2,0,0]=4 49 B9R1.2 CCC1=CC=NC(O)=N1 BB12-3719 [1,1,0,0,0,0|2,0,0]=4 50 B9R1.2 CNC1=CC(F)=CC=C1 BB01-7291 [1,1,0,0,0,0|1,0,0]=3 51 B9R1.2 N#CC1=CC(O)=CC=C1 BB20-4617 [1,1,0,0,0,0|0,0,2]=4 52 B9R1.2 NCC1=CC=CC(Cl)=C1 BB01-4636 [1,1,0,0,0,0|0,0,0]=2 53 B9R1.2 NCC1=CC=NC(N)=N1 BB12-1254 [1,1,0,0,0,0|2,0,0]=4 54 B9R1.2 NNC1=CC(Br)=CC=C1 BB56-0176 [1,1,0,0,0,0|1,0,0]=3 55 B9R1.2 NNC1=CC=CC(Cl)=C1 BB56-0328 [1,1,0,0,0,0|1,0,0]=3 56 B9R1.2 NNC1=CC=CC(F)=C1 BB56-0065 [1,1,0,0,0,0|1,0,0]=3 57 B9R1.2 [C-]#[N+]C1=CC=CC(Cl)=C1 BB56-1196 [1,1,0,0,0,0|1,0,1]=4 58 B9R1.6 NC(=S)C1=CC=NC=C1 BB12-3482 [1,1,0,0,0,0|1,0,1]=4 59 B9R1.6 NC(=S)C1=CN=CC=C1 BB12-3483 [1,1,0,0,0,0|1,0,1]=4 60 B9R1.15 CNC1=C(C)C=CC=C1 BB01-7286 [1,1,0,0,0,0|1,0,0]=3 61 B9R1.15 CNC1=CC=CC=C1N BB12-2750 [1,1,0,0,0,0|1,0,0]=3 62 B9R1.15 CNC1=CC=CN=C1N BB12-1643 [1,1,0,0,0,0|2,0,0]=4 63 B9R1.15 CNC1=NC=CC=C1Cl BB12-1745 [1,1,0,0,0,0|2,0,0]=4 64 B9R1.15 COC1=CC=CN=C1C BB17-0165 [1,1,0,0,0,0|2,0,0]=4 65 B9R1.15 NCC1=CC=CN=C1N BB12-1525 [1,1,0,0,0,0|1,0,0]=3 66 B9R1.15 NNC1=CC=CC=C1I BB56-0829 [1,1,0,0,0,0|1,0,0]=3 67 B9R1.15 NNC1=CC=CN=C1Cl BB10-0530 [1,1,0,0,0,0|2,0,0]=4 68 B9R1.15 OCC1=CC=CN=C1Cl BB12-3681 [1,1,0,0,0,0|2,0,0]=4 69 B9R1.15 [C-]#[N+]C1=C(I)C=CC=C1 BB56-0362 [1,1,0,0,0,0|1,0,1]=4 70 B9R1.12 NCCCN1C=CC=N1 BB56-2920 [0,1,0,0,1,0|2,0,0]=4 71 B9R1.13 N=C(N)CC1=CC=CS1 BB12-3709 [0,1,0,0,1,0|1,0,1]=4 72 B9R1.33 CC1=NC=CN1CCN BB53-1655 [0,1,0,0,1,0|2,0,0]=4 73 B9R1.33 CN1C=CC=C1CCO BB90-0117 [0,1,0,0,1,0|2,0,0]=4 74 B11R1.1 BrCCOC1=CC=C(Br)C=C1 BB17-1661 [0,2,0,0,0,0|1,0,0]=3 75 B11R1.1 C(=O)NCC1=CC=C(C)C=C1 BB20-3386 [0,2,0,0,0,0|1,0,1]=4 76 B11R1.1 CC1=CC=C(CNC#N)C=C1 BB12-1087 [0,2,0,0,0,0|0,0,2]=4 77 B11R1.1 CC1=CC=C(NCCO)C=C1 BB17-0653 [0,2,0,0,0,0|1,0,0]=3 78 B11R1.1 CC1=CC=C(SCCN)C=C1 BB53-1425 [0,2,0,0,0,0|0,0,0]=2 79 B11R1.1 ClC1=CC=C(OCCBr)C=C1 BB17-1649 [0,2,0,0,0,0|1,0,0]=3 80 B11R1.1 N#CNCC1=CC=C(Cl)C=C1 BB12-1085 [0,2,0,0,0,0|0,0,2]=4 81 B11R1.1 N#CNCC1=CC=C(F)C=C1 BB12-1083 [0,2,0,0,0,0|0,0,2]=4 82 B11R1.1 NCCOC1=CC=C(N)C=C1 BB53-1635 [0,2,0,0,0,0|0,0,0]=2 83 B11R1.1 NCCSC1=CC=C(Cl)C=C1 BB56-2705 [0,2,0,0,0,0|0,0,0]=2 84 B11R1.1 OCCNC1=CC=C(Cl)C=C1 BB17-0633 [0,2,0,0,0,0|1,0,0]=3 85 B11R1.20 CC1=CC=C(CC(N)=S)C=C1 BB20-4553 [0,2,0,0,0,0|0,0,1]=3 86 B11R1.20 FC(F)SC1=CC=C(Br)C=C1 BB53-1954 [0,2,0,0,0,0|2,0,0]=4 87 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB12-4748 [0,2,0,0,0,0|1,0,1]=4 88 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 BB53-4156 [0,2,0,0,0,0|1,0,1]=4 89 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 BB12-2577 [0,2,0,0,0,0|1,0,1]=4 90 B11R1.22 CC1=CC=C(C(N)CO)C=C1 BB56-2094 [0,2,0,0,0,0|1,0,0]=3 91 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 BB17-2353 [0,2,0,0,0,0|1,0,1]=4 92 B11R1.22 CNC(C)C1=CC=C(F)C=C1 BB12-1331 [0,2,0,0,0,0|2,0,0]=4 93 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 BB56-2167 [0,2,0,0,0,0|1,0,0]=3 94 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 BB56-2226 [0,2,0,0,0,0|1,0,0]=3 95 B11R1.22 NC(CO)C1=CC=C(F)C=C1 BB12-1444 [0,2,0,0,0,0|1,0,0]=3 96 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 BB26-0169 [0,2,0,0,0,0|0,0,1]=3 97 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 BB12-2695 [0,2,0,0,0,0|1,0,1]=4 98 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 BB17-2382 [0,2,0,0,0,0|1,0,1]=4 99 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 BB01-6328 [0,2,0,0,0,0|1,0,1]=4 100 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 BB53-4155 [0,2,0,0,0,0|1,0,1]=4 101 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 BB20-3112 [0,2,0,0,0,0|1,0,1]=4 102 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 BB01-6260 [0,2,0,0,0,0|1,0,1]=4 103 B11R1.22 [C-]#[N+]C(C)C1=CC=C(Cl)C=C1 BB56-1668 [0,2,0,0,0,0|2,0,0]=4 104 B11R1.81 CCNC1=CC=C(F)C=C1Cl BB01-7294 [0,2,0,0,0,0|2,0,0]=4 105 B11R1.81 CCOC1=C(N)C=C(C)C=C1 BB17-1893 [0,2,0,0,0,0|2,0,0]=4 106 B11R1.81 CCOC1=C(N)C=C(Cl)C=C1 BB17-1894 [0,2,0,0,0,0|2,0,0]=4 107 B11R1.83 [C-]#[N+]C1=CC=C(OCC)C=C1 BB56-1768 [0,2,0,0,0,0|2,0,0]=4 108 B11R1.83 [C-]#[N+]CC1=CC=C(OC)C=C1 BB56-2858 [0,2,0,0,0,0|2,0,0]=4 109 B11R1.17 CC1=CC=CC=C1CNC#N BB12-1086 [0,2,0,0,0,0|0,0,2]=4 110 B11R1.17 ClC1=C(OCCBr)C=CC=C1 BB17-1653 [0,2,0,0,0,0|1,0,0]=3 111 B11R1.17 N#CNCC1=CC=CC=C1Cl BB12-1084 [0,2,0,0,0,0|0,0,2]=4 112 B11R1.17 N#CNCC1=CC=CC=C1F BB12-1082 [0,2,0,0,0,0|0,0,2]=4 113 B11R1.41 CCOC1=CC=CC=C1NN BB56-0057 [0,2,0,0,0,0|2,0,0]=4 114 B11R1.182 CCNC1=CC(C)=CC=C1C BB01-7293 [0,2,0,0,0,0|2,0,0]=4 115 B11R1.222 NC(CO)C1=CC=CC=C1F BB56-2224 [0,2,0,0,0,0|1,0,0]=3 116 B11R1.23 CC1=CC(C(=O)NN)=CC=C1 BB12-2533 [0,2,0,0,0,0|1,0,1]=4 117 B11R1.23 [C-]#[N+]C(C)C1=CC(Cl)=CC=C1 BB56-1669 [0,2,0,0,0,0|2,0,0]=4 118 B11R1.24 CC1=CC=CC(OCCBr)=C1 BB17-1659 [0,2,0,0,0,0|1,0,0]=3 119 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 BB53-1496 [0,2,0,0,0,0|0,0,1]=3 120 B11R1.189 COC1=CC=CC(CCN)=C1 BB12-0768 [0,2,0,0,0,0|0,0,0]=2 121 B11R1.16 CC(N=C=O)C1=CC=CC=C1 BB12-1551 [0,2,0,0,0,0|1,0,1]=4 122 B11R1.16 CN(CCN)C1=CC=CC=C1 BB56-2834 [0,2,0,0,0,0|0,0,0]=2 123 B11R1.16 CNCC(O)C1=CC=CC=C1 BB12-2195 [0,2,0,0,0,0|0,0,0]=2 124 B11R1.16 OC(CCCl)C1=CC=CC=C1 BB12-1401 [0,2,0,0,0,0|1,0,0]=3 125 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 BB20-4534 [0,2,0,0,0,0|0,0,1]=3 126 B11R1.28 C=CCNCC1=CC=CC=C1 BB20-4594 [0,2,0,0,0,0|1,0,0]=3 127 B11R1.28 NCCSCC1=CC=CC=C1 BB53-1385 [0,2,0,0,0,0|0,0,0]=2 128 B11R1.28 OCCNCC1=CC=CC=C1 BB17-0809 [0,2,0,0,0,0|1,0,0]=3 129 B11R1.40 CCC(N)CC1=CC=CC=C1 BB17-0798 [0,2,0,0,0,0|0,0,0]=2 130 B11R1.40 NC(CO)CC1=CC=CC=C1 BB01-6619 [0,2,0,0,0,0|0,0,0]=2 131 B11R1.40 NNC(=O)CC1=NC=CC=C1 BB12-2162 [0,2,0,0,0,0|1,0,1]=4 132 B11R1.40 NNC(=S)NC1=CC=CC=C1 BB12-2786 [0,2,0,0,0,0|1,0,1]=4 133 B11R1.40 O=C(CS)NC1=CC=CC=C1 BB12-3947 [0,2,0,0,0,0|1,0,1]=4 134 B11R1.91 CC(N)\C=C\C1=CC=CC=C1 BB12-1707 [0,2,0,0,0,0|0,0,1]=3 135 B11R1.91 NC(=S)COC1=CC=CC=C1 BB20-4704 [0,2,0,0,0,0|0,0,1]=3 136 B11R1.91 NC(=S)COC1=CC=CN=C1 BB20-4557 [0,2,0,0,0,0|1,0,1]=4 137 B11R1.91 O=C(O)CNC1=CC=CC=C1 BB12-2585 [0,2,0,0,0,0|1,0,1]=4 138 B11R2.36 CC1=CC=C2N=CNC2=C1 BB12-4747 [0,1,0,1,0,0|1,0,1]=4 139 B11R2.36 CC1=CC=C2NN=NC2=C1 BB12-3006 [0,1,0,1,0,0|2,0,0]=4 140 B11R2.36 ClC1=CC=C2N=NNC2=C1 BB12-3008 [0,1,0,1,0,0|2,0,0]=4 141 B11R2.36 FC1=CC=C2NN=NC2=C1 BB12-3005 [0,1,0,1,0,0|2,0,0]=4 142 B11R2.36 NC1=CC=C2COCC2=C1 BB01-4521 [0,1,0,1,0,0|2,0,0]=4 143 B11R2.10 O=C1NC2=CC=CC=C2N1 BB12-1666 [0,1,0,1,0,0|1,0,1]=4 144 B11R2.106 CC1=C2N=NNC2=CC=C1 BB12-3009 [0,1,0,1,0,0|2,0,0]=4 145 B11R2.106 NC1=C2NC=NC2=CC=C1 BB12-1727 [0,1,0,1,0,0|1,0,1]=4 146 B11R2.106 NC1=C2NN=CC2=CC=C1 BB12-1725 [0,1,0,1,0,0|1,0,1]=4 147 B11R2.1 NC1=NNC2=C1C=CC=C2 BB26-0849 [0,1,0,1,0,0|1,0,1]=4 148 B7R1.1 CCC1=CNN=C1 BB12-3535 [1,0,0,0,1,0|2,0,0]=4 149 B7R1.1 CCC1=NNC=C1 BB12-3522 [1,0,0,0,1,0|2,0,0]=4 150 B7R1.1 NCC1=CC=NN1 BB01-4712 [1,0,0,0,1,0|2,0,0]=4 151 B7R1.1 NCC1=NC=CN1 BB12-2726 [1,0,0,0,1,0|2,0,0]=4 152 B7R1.1 OCC1=COC=C1 BB12-2281 [1,0,0,0,1,0|2,0,0]=4