0 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.6 CC(Cl)C1=NC=CN=C1 Z2354 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.6 CN(N)C1=CN=CC=N1 1013AJ [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [0,0,0,0,0,0|4,0,0]=4 4 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [0,0,0,0,0,0|4,0,0]=4 5 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [0,0,0,0,0,0|3,0,1]=4 6 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [0,0,0,0,0,0|1,0,1]=2 7 B9R1.6 C[C@H](N)C1=CC=NC=C1 4830AJ [0,0,0,0,0,0|3,0,1]=4 8 B9R1.6 ClB(Cl)C1=CC=CC=C1 Z8862 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 Y1609 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.6 N=C(N)C1=CC=CC=C1 9278AB [0,0,0,0,0,0|2,0,0]=2 11 B9R1.6 N=C(N)C1=NC=CC=N1 6289AB [0,0,0,0,0,0|4,0,0]=4 12 B9R1.6 NC(=O)C1=CC=NN=C1 Z3384 [0,0,0,0,0,0|1,0,0]=1 13 B9R1.6 NC(=O)C1=CN=CC=C1 1853AE [0,0,0,0,0,0|0,0,0]=0 14 B9R1.6 NC(=O)C1=CNCCC1 8430AE [0,0,0,0,0,0|0,0,4]=4 15 B9R1.6 NC(=O)C1=NC=CC=N1 Z3390 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.6 NC(=O)C1CC=CCC1 4123AE [0,0,0,0,0,0|1,0,3]=4 17 B9R1.6 O=C(O)C1C=CCC=C1 Y5447 [0,0,0,0,0,0|2,0,2]=4 18 B9R1.6 O=C(S)C1=CN=CC=C1 9152AL [0,0,0,0,0,0|1,0,0]=1 19 B9R1.6 O=C([O-])C1=CC=NC=N1 2020AH [0,0,0,0,0,0|4,0,0]=4 20 B9R1.6 O=C([O-])C1=NC=CC=C1 8839AL [0,0,0,0,0,0|3,0,0]=3 21 B9R1.6 OB(O)C1=CN=CN=C1 X3633 [0,0,0,0,0,0|3,0,1]=4 22 B8R1.2 Br[Se]C1=CC=CC=C1 8804AL [1,0,0,0,0,0|3,0,0]=4 23 B8R1.2 C=CC1=NC=CN=C1 R581 [1,0,0,0,0,0|2,0,0]=3 24 B8R1.2 CNC1=CN=CN=C1 5460AB [1,0,0,0,0,0|3,0,0]=4 25 B8R1.2 COC1=CC=NN=C1 Z5489 [1,0,0,0,0,0|3,0,0]=4 26 B8R1.2 ClCC1=NN=CC=C1 2587AB [1,0,0,0,0,0|2,0,1]=4 27 B8R1.2 ICC1=CN=CC=C1 5715AJ [1,0,0,0,0,0|1,0,1]=3 28 B8R1.2 N#CC1=CC=NN=C1 X2036 [1,0,0,0,0,0|1,0,2]=4 29 B8R1.2 NCC1=CC=CC=C1 7149AL [1,0,0,0,0,0|1,0,1]=3 30 B8R1.2 NCC1=CC=NN=C1 X9904 [1,0,0,0,0,0|1,0,1]=3 31 B8R1.2 NCC1=CN=NC=C1 0175AP [1,0,0,0,0,0|1,0,1]=3 32 B8R1.2 NNC1=CC=NC=C1 0864AQ [1,0,0,0,0,0|3,0,0]=4 33 B8R1.2 NNC1=NN=CC=C1 5599AB [1,0,0,0,0,0|2,0,0]=3 34 B8R1.2 NOC1=CC=CC=C1 X4801 [1,0,0,0,0,0|2,0,0]=3 35 B8R1.2 O=CC1=CN=NC=C1 7044AB [1,0,0,0,0,0|1,0,0]=2 36 B8R1.2 O=CC1=NC=CC=N1 Y3220 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.2 O=[As]C1=CC=CC=C1 7620AF [1,0,0,0,0,0|2,0,0]=3 38 B8R1.2 ONC1=CC=CC=C1 0019AQ [1,0,0,0,0,0|2,0,1]=4 39 B8R1.2 SCC1=CC=CN=C1 Z2753 [1,0,0,0,0,0|0,1,1]=3 40 B10R1.13 C=C(C)C1=CC=C(C)C=C1 3347AA [0,1,0,0,0,0|3,0,0]=4 41 B10R1.13 C=C(C)C1=CC=C(F)C=C1 2727AL [0,1,0,0,0,0|3,0,0]=4 42 B10R1.13 CC(=O)C1=CC=C(N)C=C1 6399AL [0,1,0,0,0,0|2,0,0]=3 43 B10R1.13 CC(=O)C1=CN=C(N)C=C1 0193AB [0,1,0,0,0,0|1,0,0]=2 44 B10R1.13 CC(=O)C1=CN=C(O)C=N1 2581AA [0,1,0,0,0,0|2,0,0]=3 45 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 0919AB [0,1,0,0,0,0|2,0,0]=3 46 B10R1.13 CC(C)C1=CN=C(N)C=C1 W7287 [0,1,0,0,0,0|2,0,1]=4 47 B10R1.13 CC(N)C1=CC=C(I)C=C1 4982AC [0,1,0,0,0,0|2,0,1]=4 48 B10R1.13 CC(N)C1=CC=C(N)C=C1 2415AJ [0,1,0,0,0,0|2,0,1]=4 49 B10R1.13 CC1=CC=C(C(=O)[O-])C=C1 8386AA [0,1,0,0,0,0|2,0,0]=3 50 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 5443AB [0,1,0,0,0,0|2,0,1]=4 51 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 N143 [0,1,0,0,0,0|3,0,0]=4 52 B10R1.13 CC1=CN=C(C(=N)N)C=N1 1246AC [0,1,0,0,0,0|2,0,0]=3 53 B10R1.13 CC1=CN=C(C(=N)N)C=N1 2786AA [0,1,0,0,0,0|2,0,0]=3 54 B10R1.13 CC1=NC=C(B(O)O)C=C1 Z7105 [0,1,0,0,0,0|2,0,1]=4 55 B10R1.13 CC1=NC=C([N+](=O)[O-])C=N1 6835AA [0,1,0,0,0,0|3,0,0]=4 56 B10R1.13 CC1=NN=C(C(=O)O)C=C1 Y9703 [0,1,0,0,0,0|2,0,0]=3 57 B10R1.13 CN(N)C1=CC=C(Cl)N=N1 9489AE [0,1,0,0,0,0|3,0,0]=4 58 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 X4561 [0,1,0,0,0,0|2,0,1]=4 59 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 X3988 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 7591AD [0,1,0,0,0,0|2,0,1]=4 61 B10R1.13 N=C(N)C1=CC=C(I)C=C1 2844AJ [0,1,0,0,0,0|2,0,0]=3 62 B10R1.13 N=C(N)C1=CC=C(N)C=C1 W8418 [0,1,0,0,0,0|2,0,0]=3 63 B10R1.13 NC(=O)C1=NC=C(N)C=N1 8288AB [0,1,0,0,0,0|3,0,0]=4 64 B10R1.13 NC(=O)C1=NN=C(O)C=C1 6449AJ [0,1,0,0,0,0|1,0,0]=2 65 B10R1.13 NC(=S)C1=CN=C(Cl)C=C1 3526AJ [0,1,0,0,0,0|0,1,0]=2 66 B10R1.13 NC(=S)C1=CN=C(N)C=C1 7552AB [0,1,0,0,0,0|0,1,0]=2 67 B10R1.13 NC1=CC=C(C(=O)O)C=N1 3422AJ [0,1,0,0,0,0|1,0,0]=2 68 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 7653AF [0,1,0,0,0,0|3,0,0]=4 69 B10R1.13 O=C(O)C1=CN=C(O)N=C1 W5910 [0,1,0,0,0,0|2,0,0]=3 70 B10R1.13 O=C([O-])C1=NN=C(Cl)C=C1 Y4602 [0,1,0,0,0,0|2,0,0]=3 71 B10R1.13 O=S(O)C1=CC=C(Br)C=C1 3348AA [0,1,0,0,0,0|3,0,0]=4 72 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=N1 X9187 [0,1,0,0,0,0|3,0,0]=4 73 B10R1.13 O=[PH](O)C1=CC=C(Br)C=C1 5127AB [0,1,0,0,0,0|3,0,0]=4 74 B10R1.15 C#CC(=O)C1=CC=CC=C1 0047AQ [0,1,0,0,0,0|2,0,0]=3 75 B10R1.15 C=C(CBr)C1=CC=CC=C1 Z4610 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.15 CCC(=O)C1=CC=NC=C1 8726AA [0,1,0,0,0,0|3,0,0]=4 77 B10R1.15 CCC(=O)C1=NC=CN=C1 7151AB [0,1,0,0,0,0|2,0,0]=3 78 B10R1.15 CCC(N)C1=CC=CC=C1 8188AD [0,1,0,0,0,0|2,0,1]=4 79 B10R1.15 CCC(N)C1=CC=CN=C1 4943AJ [0,1,0,0,0,0|1,0,1]=3 80 B10R1.15 CCC(N)C1=CC=CN=C1 4945AJ [0,1,0,0,0,0|1,0,1]=3 81 B10R1.15 CN(N=O)C1=CC=CC=C1 8617AL [0,1,0,0,0,0|3,0,0]=4 82 B10R1.15 COC(=N)C1=NC=CN=C1 9109AE [0,1,0,0,0,0|1,0,2]=4 83 B10R1.15 C\C(=N/N)C1=CC=CC=C1 1678AL [0,1,0,0,0,0|2,0,0]=3 84 B10R1.15 NC(CF)C1=CC=CC=C1 0514AQ [0,1,0,0,0,0|2,0,1]=4 85 B10R1.15 NC(CO)C1=CC=CN=C1 W5825 [0,1,0,0,0,0|0,0,2]=3 86 B10R1.15 NCC(=O)C1=CN=CC=C1 1455AJ [0,1,0,0,0,0|0,0,0]=1 87 B10R1.15 NCC(O)C1=CC=CN=C1 5133AH [0,1,0,0,0,0|0,0,2]=3 88 B10R1.15 NC[C@@H](F)C1=CC=CC=C1 0407AQ [0,1,0,0,0,0|2,0,1]=4 89 B10R1.15 NC[C@H](O)C1=CC=CN=C1 Z3832 [0,1,0,0,0,0|0,0,2]=3 90 B10R1.15 NNC(=O)C1=CC=NC=N1 Y5417 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.15 NNC(=O)C1=CN=CN=C1 5591AB [0,1,0,0,0,0|1,0,0]=2 92 B10R1.15 O=C(CBr)C1=CC=NC=C1 9348AB [0,1,0,0,0,0|3,0,0]=4 93 B10R1.15 O=C(CBr)C1=CN=CC=C1 9347AB [0,1,0,0,0,0|1,0,0]=2 94 B10R1.15 O=C(CBr)C1=NC=CN=C1 Z2340 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.15 O=C(CCl)C1=CC=NC=C1 5498AJ [0,1,0,0,0,0|3,0,0]=4 96 B10R1.15 O=C(N[O-])C1=CC=CC=C1 8985AL [0,1,0,0,0,0|1,0,0]=2 97 B10R1.28 CC(F)(F)C1=CN=CC=C1 9489AC [0,1,0,0,0,0|2,0,1]=4 98 B10R1.28 NS(=O)(=O)C1=CC=NC=C1 7561AE [0,1,0,0,0,0|3,0,0]=4 99 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 Z8042 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 5121AF [0,1,0,0,0,0|3,0,0]=4 101 B10R1.61 C=C(C)C1=C(C)C=CC=C1 5671AL [0,1,0,0,0,0|3,0,0]=4 102 B10R1.61 CC(=O)C1=C(O)C=NC=C1 Z4577 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.61 CC(=O)C1=CC=CNC1=O W7482 [0,1,0,0,0,0|1,0,1]=3 104 B10R1.61 CC(=O)C1=NC=CC=C1Cl 5776AA [0,1,0,0,0,0|3,0,0]=4 105 B10R1.61 CC(=O)C1=NC=CC=C1O Z4085 [0,1,0,0,0,0|3,0,0]=4 106 B10R1.61 CC(N)C1=CC=CC=C1Br Z7493 [0,1,0,0,0,0|2,0,1]=4 107 B10R1.61 CC(O)C1=CC=CN=C1N 9393AH [0,1,0,0,0,0|1,0,2]=4 108 B10R1.61 CC1=C(C(=N)N)N=CC=C1 2362AJ [0,1,0,0,0,0|3,0,0]=4 109 B10R1.61 CC1=C(C(=O)O)N=CC=C1 4521AA [0,1,0,0,0,0|3,0,0]=4 110 B10R1.61 CC1=C(C(N)=S)N=CC=C1 0825AQ [0,1,0,0,0,0|2,1,0]=4 111 B10R1.61 CC1=C([C@@H](C)N)C=CC=C1 3317AC [0,1,0,0,0,0|2,0,1]=4 112 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 3324AC [0,1,0,0,0,0|2,0,0]=3 113 B10R1.61 CC1=CC=CN=C1C(N)=O 3720AF [0,1,0,0,0,0|2,0,0]=3 114 B10R1.61 CC1=NC=CN=C1S(C)=O 7966AJ [0,1,0,0,0,0|3,0,0]=4 115 B10R1.61 CS(=O)C1=CC=CC=C1Br 8910AE [0,1,0,0,0,0|3,0,0]=4 116 B10R1.61 CS(=O)C1=CC=CC=C1O Z7171 [0,1,0,0,0,0|3,0,0]=4 117 B10R1.61 C[C@@H](N)C1=C(Br)C=CC=C1 8346AH [0,1,0,0,0,0|2,0,1]=4 118 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br 2344AA [0,1,0,0,0,0|2,0,1]=4 119 B10R1.61 C[C@@H](N)C1=CC=CC=C1F X9177 [0,1,0,0,0,0|2,0,1]=4 120 B10R1.61 C[C@H](N)C1=CC=CC=C1Br Z4151 [0,1,0,0,0,0|2,0,1]=4 121 B10R1.61 C[C@H](O)C1=CC=CN=C1N 5914AC [0,1,0,0,0,0|1,0,2]=4 122 B10R1.61 N=C(N)C1=C(Br)C=CC=C1 1622AJ [0,1,0,0,0,0|2,0,0]=3 123 B10R1.61 N=C(N)C1=C(F)C=CC=N1 2279AJ [0,1,0,0,0,0|3,0,0]=4 124 B10R1.61 N=C(N)C1=CC=CC=C1F 1049AC [0,1,0,0,0,0|2,0,0]=3 125 B10R1.61 N=C(N)C1=CC=CNC1=O 1879AF [0,1,0,0,0,0|1,0,1]=3 126 B10R1.61 NC(=O)C1=C(Br)N=CC=C1 W9002 [0,1,0,0,0,0|0,0,0]=1 127 B10R1.61 NC(=O)C1=C(Cl)C=CN=C1 Y3257 [0,1,0,0,0,0|0,0,0]=1 128 B10R1.61 NC(=O)C1=C(N)N=CN=C1 Z2814 [0,1,0,0,0,0|1,0,0]=2 129 B10R1.61 NC(=S)C1=CC=CC=C1Br 1055AQ [0,1,0,0,0,0|1,1,0]=3 130 B10R1.61 NC1=C(C(=O)O)N=CN=N1 Z5865 [0,1,0,0,0,0|3,0,0]=4 131 B10R1.61 O=C(O)C1=C(I)C=NC=C1 Y5476 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.61 O=C(O)C1=NC=CN=C1Br W9637 [0,1,0,0,0,0|2,0,0]=3 133 B10R1.61 O=C(O)C1=NC=CN=C1I W4424 [0,1,0,0,0,0|2,0,0]=3 134 B10R1.61 O=[N+]([O-])C1=C(F)C=CN=C1 Z7729 [0,1,0,0,0,0|2,0,0]=3 135 B10R1.61 O=[N+]([O-])C1=C(O)N=CN=C1 W4529 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.61 OB(O)C1=C(Br)C=CN=C1 X1325 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.61 OB(O)C1=C(Cl)C=CN=C1 X1531 [0,1,0,0,0,0|2,0,1]=4 138 B10R1.61 OB(O)C1=C(F)N=CC=C1 3384AD [0,1,0,0,0,0|2,0,1]=4 139 B10R1.113 C=C(C)C1=CN=CC(Br)=C1 W6093 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.113 CC(=O)C1=CC(F)=CN=C1 3535AA [0,1,0,0,0,0|1,0,0]=2 141 B10R1.113 CC(=O)C1=NC(F)=CC=C1 6832AB [0,1,0,0,0,0|3,0,0]=4 142 B10R1.113 CC(N)C1=CC(O)=CC=C1 Y9690 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 V5733 [0,1,0,0,0,0|2,0,1]=4 144 B10R1.113 CC1=CC(C(=N)N)=CC=C1 2354AJ [0,1,0,0,0,0|2,0,0]=3 145 B10R1.113 CC1=CC(C(N)=O)=NC=C1 5258AE [0,1,0,0,0,0|2,0,0]=3 146 B10R1.113 CC1=CC(C(N)=S)=NC=C1 5196AD [0,1,0,0,0,0|2,1,0]=4 147 B10R1.113 CC1=CC([N+](=O)[O-])=CN=C1 Y9848 [0,1,0,0,0,0|2,0,0]=3 148 B10R1.113 CC1=NC(C(N)=O)=NC=C1 6042AA [0,1,0,0,0,0|3,0,0]=4 149 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 W5401 [0,1,0,0,0,0|2,0,1]=4 150 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 Z5107 [0,1,0,0,0,0|2,0,1]=4 151 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 W5400 [0,1,0,0,0,0|2,0,1]=4 152 B10R1.113 C[N+]1=CC(C(=O)O)=CC=C1 7814AH [0,1,0,0,0,0|1,0,1]=3 153 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 2211AJ [0,1,0,0,0,0|2,0,0]=3 154 B10R1.113 NC(=O)C1=NC(F)=CC=C1 V5539 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.113 NC(=S)C1=CC(N)=NC=C1 4163AC [0,1,0,0,0,0|2,1,0]=4 156 B10R1.113 O=C(Cl)C1=CC(F)=NC=C1 Z2563 [0,1,0,0,0,0|3,0,0]=4 157 B10R1.113 O=C(O)C1=CN=CC(I)=C1 Z4205 [0,1,0,0,0,0|1,0,0]=2 158 B10R1.113 O=C(O)C1=NC=CC(F)=C1 W9141 [0,1,0,0,0,0|3,0,0]=4 159 B10R1.113 O=C([O-])C1=CC(O)=CC=C1 8975AL [0,1,0,0,0,0|2,0,0]=3 160 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 6772AE [0,1,0,0,0,0|3,0,0]=4 161 B10R1.113 O=S([O-])C1=CC=CC(Br)=C1 V8824 [0,1,0,0,0,0|3,0,0]=4 162 B10R1.113 OB(O)C1=CC(O)=CN=C1 3644AA [0,1,0,0,0,0|2,0,1]=4 163 B8R1.7 C=C(C)C1=NC=CS1 5670AL [0,0,0,0,1,0|3,0,0]=4 164 B8R1.7 CC(=O)C1=CC=NO1 4156AC [0,0,0,0,1,0|2,0,0]=3 165 B8R1.7 CC(=O)C1=CN=CS1 5381AC [0,0,0,0,1,0|2,0,0]=3 166 B8R1.7 CC(=O)C1=NC=CO1 W8389 [0,0,0,0,1,0|2,0,0]=3 167 B8R1.7 CC(=O)C1=NC=NN1 4769AD [0,0,0,0,1,0|3,0,0]=4 168 B8R1.7 CC(=O)C1=NOC=C1 4155AC [0,0,0,0,1,0|2,0,0]=3 169 B8R1.7 CC(N)C1=CC=CS1 9580AB [0,0,0,0,1,0|2,0,1]=4 170 B8R1.7 CC(N)C1=CSC=C1 0073AD [0,0,0,0,1,0|2,0,1]=4 171 B8R1.7 CC(N)C1=CSC=N1 4743AH [0,0,0,0,1,0|2,0,1]=4 172 B8R1.7 N=C(N)C1=COC=C1 5391AE [0,0,0,0,1,0|2,0,0]=3 173 B8R1.7 NC(=O)C1=CC=CN1 V6031 [0,0,0,0,1,0|0,0,1]=2 174 B8R1.7 NC(=O)C1=CN=CO1 Y7670 [0,0,0,0,1,0|1,0,0]=2 175 B8R1.7 NC(=O)C1=CNC=C1 1113AC [0,0,0,0,1,0|0,0,1]=2 176 B8R1.7 NC(=O)C1=CNC=N1 2439AB [0,0,0,0,1,0|1,0,0]=2 177 B8R1.7 NC(=O)C1=CNN=C1 3575AE [0,0,0,0,1,0|1,0,0]=2 178 B8R1.7 NC(=O)C1=COC=N1 Z4456 [0,0,0,0,1,0|1,0,0]=2 179 B8R1.7 NC(=O)C1=CSC=N1 Y5399 [0,0,0,0,1,0|1,0,0]=2 180 B8R1.7 NC(=O)C1=NC=CS1 X5637 [0,0,0,0,1,0|1,0,0]=2 181 B8R1.7 NC(=O)[C@@H]1C=CCN1 5249AH [0,0,0,0,1,0|0,0,3]=4 182 B8R1.7 NC(=S)C1=CC=NN1 Y5736 [0,0,0,0,1,0|1,1,0]=3 183 B8R1.7 NC(=S)C1=CN=CO1 Y4507 [0,0,0,0,1,0|1,1,0]=3 184 B8R1.7 NC(=S)C1=CN=CS1 Y5427 [0,0,0,0,1,0|1,1,0]=3 185 B8R1.7 NC(=S)C1=CNC=N1 Y4857 [0,0,0,0,1,0|1,1,0]=3 186 B8R1.7 NC(=S)C1=CSC=N1 Y5562 [0,0,0,0,1,0|1,1,0]=3 187 B8R1.7 NC(=S)C1=NC=CO1 4442AJ [0,0,0,0,1,0|1,1,0]=3 188 B8R1.7 NC(=S)C1=NC=CS1 7785AH [0,0,0,0,1,0|1,1,0]=3 189 B8R1.7 O=C(O)C1=NC=CO1 Z1844 [0,0,0,0,1,0|2,0,0]=3 190 B8R1.7 O=C(O)C1=NSC=C1 6302AB [0,0,0,0,1,0|2,0,0]=3 191 B8R1.7 O=C(O)N1C=CC=C1 Z3516 [0,0,0,0,1,0|2,0,0]=3 192 B8R1.7 O=C([O-])C1=NC=CS1 4281AE [0,0,0,0,1,0|2,0,0]=3 193 B8R1.7 O=[N+]([O-])C1=CON=C1 X8994 [0,0,0,0,1,0|3,0,0]=4 194 B10R1.18 CC(=O)CC1=CN=CC=C1 9974AH [0,0,0,0,0,1|1,0,0]=2 195 B10R1.18 CC(=O)CC1=NC=CN=C1 0450AC [0,0,0,0,0,1|2,0,0]=3 196 B10R1.18 CC(=S)NC1=CC=CC=C1 8077AF [0,0,0,0,0,1|2,1,0]=4 197 B10R1.18 CC(C)=CC1=CC=CC=C1 1982AC [0,0,0,0,0,1|3,0,0]=4 198 B10R1.18 CC(N)CC1=CN=CC=N1 4220AC [0,0,0,0,0,1|2,0,1]=4 199 B10R1.18 N=C(N)CC1=CC=CC=C1 1942AB [0,0,0,0,0,1|2,0,0]=3 200 B10R1.18 N=C(N)CC1=NC=CC=C1 0398AD [0,0,0,0,0,1|3,0,0]=4 201 B10R1.18 NC(=S)CC1=CC=CC=C1 7353AE [0,0,0,0,0,1|1,1,0]=3 202 B10R1.18 O=C(O)CC1=NC=CC=C1 Y7391 [0,0,0,0,0,1|3,0,0]=4 203 B10R1.18 S=C(Cl)SC1=CC=CC=C1 5446AD [0,0,0,0,0,1|2,1,0]=4 204 B7R0.4 C\C=C\C=C\C(=O)Cl Y2082 [1,0,1,0,0,0|1,0,1]=4 205 B7R1.3 CC1=CC=CN=N1 X0232 [2,0,0,0,0,0|1,0,1]=4 206 B7R1.3 ClC1=NN=CC=C1 X0225 [2,0,0,0,0,0|2,0,0]=4 207 B7R1.3 FC1=CN=CN=C1 W7798 [2,0,0,0,0,0|2,0,0]=4 208 B7R1.3 SC1=NC=CN=C1 2178AE [2,0,0,0,0,0|1,1,0]=4 209 B7R1.3 [SeH]C1=CC=CC=C1 8806AL [2,0,0,0,0,0|1,1,0]=4 210 B9R1.1 BrCC1=CN=C(Br)C=C1 Y3534 [1,1,0,0,0,0|1,0,1]=4 211 B9R1.1 CC1=NC=C(CCl)C=C1 Y9334 [1,1,0,0,0,0|1,0,1]=4 212 B9R1.1 CC1=NC=C(CN)C=N1 6982AA [1,1,0,0,0,0|1,0,1]=4 213 B9R1.1 CC1=NN=C(NN)C=C1 W5942 [1,1,0,0,0,0|2,0,0]=4 214 B9R1.1 CSC1=CN=C(Br)C=C1 Z0124 [1,1,0,0,0,0|2,0,0]=4 215 B9R1.1 ClC1=NC=C(CBr)C=C1 3738AB [1,1,0,0,0,0|1,0,1]=4 216 B9R1.1 N#CC1=CN=C(I)C=C1 V4938 [1,1,0,0,0,0|0,0,2]=4 217 B9R1.1 NCC1=CN=C(Cl)C=N1 1378AA [1,1,0,0,0,0|1,0,1]=4 218 B9R1.1 NCC1=CNC(=O)C=C1 5770AA [1,1,0,0,0,0|0,0,2]=4 219 B9R1.1 NNC1=NC=C(Br)N=C1 0093AA [1,1,0,0,0,0|2,0,0]=4 220 B9R1.1 O=CC1=CC=[N+]([O-])C=C1 0867AQ [1,1,0,0,0,0|2,0,0]=4 221 B9R1.2 C#CC1=CN=CC(Cl)=C1 X7082 [1,1,0,0,0,0|1,0,1]=4 222 B9R1.2 C=CC1=CC(Br)=CN=C1 9938AA [1,1,0,0,0,0|1,0,0]=3 223 B9R1.2 C=CC1=CC(C)=CC=C1 6123AL [1,1,0,0,0,0|2,0,0]=4 224 B9R1.2 CC1=CC(C#N)=CN=C1 5922AB [1,1,0,0,0,0|0,0,2]=4 225 B9R1.2 CC1=CC(CN)=CN=C1 2036AC [1,1,0,0,0,0|0,0,1]=3 226 B9R1.2 CC1=CN=CC(C=O)=N1 2745AA [1,1,0,0,0,0|1,0,0]=3 227 B9R1.2 CC1=NC=CC(C=O)=C1 9828AC [1,1,0,0,0,0|2,0,0]=4 228 B9R1.2 COC1=CC(C)=CN=C1 2251AC [1,1,0,0,0,0|2,0,0]=4 229 B9R1.2 COC1=CN=CC(F)=C1 Y3600 [1,1,0,0,0,0|2,0,0]=4 230 B9R1.2 COC1=CN=CC(I)=C1 1202AF [1,1,0,0,0,0|2,0,0]=4 231 B9R1.2 COC1=CN=CC(N)=C1 2136AJ [1,1,0,0,0,0|2,0,0]=4 232 B9R1.2 ClCC1=CC(Cl)=CN=C1 2237AJ [1,1,0,0,0,0|1,0,1]=4 233 B9R1.2 ClCC1=CN=CC(Br)=C1 Z8207 [1,1,0,0,0,0|1,0,1]=4 234 B9R1.2 ClCC1=CN=CC(Cl)=C1 2236AJ [1,1,0,0,0,0|1,0,1]=4 235 B9R1.2 N#CC1=CC(F)=CN=C1 V1360 [1,1,0,0,0,0|0,0,2]=4 236 B9R1.2 NC1=CC(CO)=CN=C1 Z2689 [1,1,0,0,0,0|0,0,2]=4 237 B9R1.2 NC1=CC=CC(C=O)=C1 X3987 [1,1,0,0,0,0|1,0,0]=3 238 B9R1.2 NC1=CC=CC(C=O)=N1 3868AB [1,1,0,0,0,0|2,0,0]=4 239 B9R1.2 NCC1=CC(Cl)=CN=C1 5679AJ [1,1,0,0,0,0|0,0,1]=3 240 B9R1.2 NCC1=CC=C[N+]([O-])=C1 2361AL [1,1,0,0,0,0|0,0,2]=4 241 B9R1.2 O=CC1=CC(F)=NC=C1 X9807 [1,1,0,0,0,0|2,0,0]=4 242 B9R1.2 O=CC1=CC(I)=CN=C1 1479AF [1,1,0,0,0,0|0,0,0]=2 243 B9R1.2 O=CC1=CC=CC(=O)N1 4493AB [1,1,0,0,0,0|2,0,0]=4 244 B9R1.2 O=CC1=CC=CC(F)=N1 N399 [1,1,0,0,0,0|2,0,0]=4 245 B9R1.2 O=CC1=NC(Cl)=CN=C1 3835AC [1,1,0,0,0,0|1,0,0]=3 246 B9R1.8 CNCC1=CC=CC=C1 3855AD [1,1,0,0,0,0|1,0,1]=4 247 B9R1.8 CNCC1=NC=CN=C1 X9439 [1,1,0,0,0,0|1,0,1]=4 248 B9R1.8 CNNC1=CC=CC=C1 V2456 [1,1,0,0,0,0|2,0,0]=4 249 B9R1.8 C\C=C\C1=CC=CC=C1 7209AE [1,1,0,0,0,0|2,0,0]=4 250 B9R1.8 NCCC1=CC=CN=C1 5033AC [1,1,0,0,0,0|0,0,1]=3 251 B9R1.8 NCCC1=CN=CC=N1 1878AJ [1,1,0,0,0,0|1,0,1]=4 252 B9R1.8 NCCC1=NC=CN=C1 Y9352 [1,1,0,0,0,0|1,0,1]=4 253 B9R1.8 NNCC1=CN=CN=C1 2736AD [1,1,0,0,0,0|1,0,1]=4 254 B9R1.8 NOCC1=CC=CN=C1 7306AJ [1,1,0,0,0,0|0,0,1]=3 255 B9R1.8 O=C=NC1=CC=CN=C1 Y9342 [1,1,0,0,0,0|0,0,1]=3 256 B9R1.8 O=CNC1=NC=CC=C1 1807AL [1,1,0,0,0,0|2,0,0]=4 257 B9R1.15 C#CC1=CC=CN=C1F 5833AC [1,1,0,0,0,0|1,0,1]=4 258 B9R1.15 C#CC1=CC=CN=C1N 0364AC [1,1,0,0,0,0|1,0,1]=4 259 B9R1.15 C=CC1=C(C)C=CC=C1 8079AF [1,1,0,0,0,0|2,0,0]=4 260 B9R1.15 C=CC1=CC=CC=C1N 3518AA [1,1,0,0,0,0|2,0,0]=4 261 B9R1.15 CC1=C(CBr)C=NC=C1 Y7235 [1,1,0,0,0,0|1,0,1]=4 262 B9R1.15 CC1=C(NN)C=NC=C1 2421AC [1,1,0,0,0,0|1,0,0]=3 263 B9R1.15 CC1=C(NN)N=CC=N1 0201AB [1,1,0,0,0,0|2,0,0]=4 264 B9R1.15 CC1=NC=CC=C1CCl 8680AB [1,1,0,0,0,0|1,0,1]=4 265 B9R1.15 CCC1=C(Br)C=CN=C1 0440AA [1,1,0,0,0,0|1,0,1]=4 266 B9R1.15 CNC1=CC=CN=C1N 8234AB [1,1,0,0,0,0|2,0,0]=4 267 B9R1.15 COC1=C(Br)C=CN=C1 X8928 [1,1,0,0,0,0|2,0,0]=4 268 B9R1.15 COC1=CC=CN=C1I Y4758 [1,1,0,0,0,0|2,0,0]=4 269 B9R1.15 COC1=CN=CC=C1O 9525AB [1,1,0,0,0,0|2,0,0]=4 270 B9R1.15 N#CC1=C(Br)C=CN=C1 B519 [1,1,0,0,0,0|0,0,2]=4 271 B9R1.15 NC1=C(C=O)C=CN=C1 2155AJ [1,1,0,0,0,0|2,0,0]=4 272 B9R1.15 NC1=C(CO)C=NC=C1 W3010 [1,1,0,0,0,0|0,0,2]=4 273 B9R1.15 NC1=CN=CC=C1C=O 3083AA [1,1,0,0,0,0|2,0,0]=4 274 B9R1.15 NC1=NC=CN=C1C=O W5450 [1,1,0,0,0,0|1,0,0]=3 275 B9R1.15 NCC1=C(F)N=CC=C1 3392AC [1,1,0,0,0,0|0,0,1]=3 276 B9R1.15 NCC1=C(I)C=CC=C1 1744AJ [1,1,0,0,0,0|1,0,1]=4 277 B9R1.15 NCC1=CC=CC=C1N W5201 [1,1,0,0,0,0|1,0,1]=4 278 B9R1.15 NCC1=CC=CN=C1Br 0546AB [1,1,0,0,0,0|0,0,1]=3 279 B9R1.15 NCC1=CC=CN=C1Cl 8496AH [1,1,0,0,0,0|0,0,1]=3 280 B9R1.15 NCC1=CC=CN=C1Cl Y8187 [1,1,0,0,0,0|0,0,1]=3 281 B9R1.15 NCC1=CC=CN=C1F W4328 [1,1,0,0,0,0|0,0,1]=3 282 B9R1.15 NCC1=CC=CNC1=O 3266AC [1,1,0,0,0,0|0,0,2]=4 283 B9R1.15 NNC1=CC=CC=C1I W6607 [1,1,0,0,0,0|2,0,0]=4 284 B9R1.15 O=CC1=C(Br)C=CN=C1 Y5203 [1,1,0,0,0,0|0,0,0]=2 285 B9R1.15 O=CC1=CN=CC=C1Br W3357 [1,1,0,0,0,0|0,0,0]=2 286 B9R1.15 O=CC1=CN=CC=C1O Z1966 [1,1,0,0,0,0|0,0,0]=2 287 B9R1.15 OCC1=C(Cl)C=CN=C1 V0669 [1,1,0,0,0,0|0,0,2]=4 288 B9R1.11 CCC(=O)C1=CC=CO1 Z5507 [0,1,0,0,1,0|2,0,0]=4 289 B9R1.11 COC(=O)C1=CNN=C1 9533AA [0,1,0,0,1,0|2,0,0]=4 290 B9R1.11 COC(=O)C1=NC=CO1 3452AB [0,1,0,0,1,0|2,0,0]=4 291 B9R1.11 CSC(=O)C1=CSC=N1 V9051 [0,1,0,0,1,0|2,0,0]=4 292 B9R1.11 N#CC(=O)C1=CC=CO1 9015AB [0,1,0,0,1,0|1,0,1]=4 293 B9R1.11 N#CC(=O)C1=CC=CS1 6481AE [0,1,0,0,1,0|1,0,1]=4 294 B9R1.11 NNC(=O)C1=CC=NN1 8723AD [0,1,0,0,1,0|1,0,0]=3 295 B9R1.11 NNC(=O)C1=CN=CO1 7607AH [0,1,0,0,1,0|1,0,0]=3 296 B9R1.11 NNC(=O)C1=COC=N1 Y5608 [0,1,0,0,1,0|1,0,0]=3 297 B9R1.11 NNC(=O)C1=CSC=C1 2321AE [0,1,0,0,1,0|1,0,0]=3 298 B9R1.11 NNC(=O)C1=NC=CS1 Y7769 [0,1,0,0,1,0|1,0,0]=3 299 B9R1.11 N\C(=N/O)C1=CC=CO1 2252AB [0,1,0,0,1,0|1,0,1]=4 300 B9R1.11 N\C(=N/O)C1=CSC=C1 6240AE [0,1,0,0,1,0|1,0,1]=4 301 B9R1.11 O=C(CBr)C1=CSC=N1 3999AJ [0,1,0,0,1,0|2,0,0]=4 302 B9R1.11 O=C(CBr)C1=NC=CS1 6733AD [0,1,0,0,1,0|2,0,0]=4 303 B9R1.11 O=C(CCl)C1=NC=CO1 1641AJ [0,1,0,0,1,0|2,0,0]=4 304 B9R1.11 O=CC(=O)C1=CC=CO1 8783AA [0,1,0,0,1,0|2,0,0]=4 305 B9R1.11 O=CC(=O)C1=CC=CS1 W3018 [0,1,0,0,1,0|2,0,0]=4 306 B9R1.35 CC(=O)C1=CC(Cl)=CS1 W5634 [0,1,0,0,1,0|2,0,0]=4 307 B9R1.35 CC(=O)C1=CC=C(Br)O1 3520AB [0,1,0,0,1,0|2,0,0]=4 308 B9R1.35 CC(=O)C1=NC(C)=CN1 2011AB [0,1,0,0,1,0|2,0,0]=4 309 B9R1.35 CC(=O)C1=NC(C)=CO1 5140AC [0,1,0,0,1,0|2,0,0]=4 310 B9R1.35 CC(=O)C1=NC=C(Br)S1 2132AC [0,1,0,0,1,0|2,0,0]=4 311 B9R1.35 CC1=CC(C(=O)O)=CN1 X8465 [0,1,0,0,1,0|1,0,1]=4 312 B9R1.35 CC1=CC(C(N)=O)=NN1 Z2991 [0,1,0,0,1,0|1,0,0]=3 313 B9R1.35 CC1=CC(C(N)=S)=NO1 9564AE [0,1,0,0,1,0|1,1,0]=4 314 B9R1.35 CC1=CC=C(C(=O)O)N1 4808AB [0,1,0,0,1,0|1,0,1]=4 315 B9R1.35 CC1=CN=C(C(=O)O)O1 X6429 [0,1,0,0,1,0|2,0,0]=4 316 B9R1.35 CC1=CNC(C(=O)O)=C1 V0508 [0,1,0,0,1,0|1,0,1]=4 317 B9R1.35 CC1=CNC(C(=O)O)=N1 Y9876 [0,1,0,0,1,0|2,0,0]=4 318 B9R1.35 CC1=COC(C(=O)O)=N1 X6324 [0,1,0,0,1,0|2,0,0]=4 319 B9R1.35 CC1=NC(C(=N)N)=CS1 6347AD [0,1,0,0,1,0|2,0,0]=4 320 B9R1.35 CC1=NC(C(N)=O)=CO1 X5248 [0,1,0,0,1,0|1,0,0]=3 321 B9R1.35 CC1=NC(C(N)=O)=CS1 Y5140 [0,1,0,0,1,0|1,0,0]=3 322 B9R1.35 CC1=NC(C(N)=S)=CS1 W3802 [0,1,0,0,1,0|1,1,0]=4 323 B9R1.35 N=C(N)C1=CC=C(Cl)S1 6827AD [0,1,0,0,1,0|2,0,0]=4 324 B9R1.35 NC(=O)C1=CC(Br)=NO1 4565AA [0,1,0,0,1,0|1,0,0]=3 325 B9R1.35 NC(=O)C1=CC=C(Br)N1 9191AA [0,1,0,0,1,0|0,0,1]=3 326 B9R1.35 NC(=O)C1=NNC(Br)=N1 0998AD [0,1,0,0,1,0|2,0,0]=4 327 B9R1.35 NC(=O)C1=NNC(Cl)=N1 5398AE [0,1,0,0,1,0|2,0,0]=4 328 B9R1.35 NC1=CSC(C(=O)O)=C1 6089AJ [0,1,0,0,1,0|2,0,0]=4 329 B9R1.35 NC1=NC(C(=O)O)=CS1 Y7076 [0,1,0,0,1,0|2,0,0]=4 330 B9R1.35 NC1=NC=C(C(=O)O)O1 V8587 [0,1,0,0,1,0|2,0,0]=4 331 B9R1.35 O=C(O)C1=CC(Cl)=NO1 0612AB [0,1,0,0,1,0|2,0,0]=4 332 B9R1.35 O=C(O)C1=CC(F)=CS1 3617AB [0,1,0,0,1,0|2,0,0]=4 333 B9R1.35 O=C(O)C1=CC=C(I)O1 6244AD [0,1,0,0,1,0|2,0,0]=4 334 B9R1.35 O=C(O)C1=COC(Cl)=N1 Y9881 [0,1,0,0,1,0|2,0,0]=4 335 B9R1.35 O=C(O)C1=COC(I)=N1 4876AA [0,1,0,0,1,0|2,0,0]=4 336 B9R1.35 O=C(O)C1=NC(Br)=CO1 X6341 [0,1,0,0,1,0|2,0,0]=4 337 B9R1.35 O=C(O)C1=NC=C(Cl)S1 Y6782 [0,1,0,0,1,0|2,0,0]=4 338 B9R1.41 CC(=O)C1=C(C)C=CS1 Z5455 [0,1,0,0,1,0|2,0,0]=4 339 B9R1.41 CC(=O)C1=C(C)NN=C1 4180AF [0,1,0,0,1,0|2,0,0]=4 340 B9R1.41 CC(=O)C1=C(N)C=CS1 3514AB [0,1,0,0,1,0|2,0,0]=4 341 B9R1.41 CC(=O)N1C=CC=C1Br 5036AJ [0,1,0,0,1,0|2,0,0]=4 342 B9R1.41 CC1=C(C(=O)O)NC=C1 W9332 [0,1,0,0,1,0|1,0,1]=4 343 B9R1.41 CC1=C(C(=O)O)ON=C1 2244AB [0,1,0,0,1,0|2,0,0]=4 344 B9R1.41 CC1=C(C(N)=O)C=CS1 0775AQ [0,1,0,0,1,0|1,0,0]=3 345 B9R1.41 CC1=CON=C1C(=O)O 0980AB [0,1,0,0,1,0|2,0,0]=4 346 B9R1.41 CN1C=CN=C1C(=N)N 0619AF [0,1,0,0,1,0|2,0,0]=4 347 B9R1.41 NC(=O)C1=C(Br)SC=C1 9864AA [0,1,0,0,1,0|1,0,0]=3 348 B9R1.41 NC(=O)C1=C(N)C=NN1 0332AC [0,1,0,0,1,0|1,0,0]=3 349 B9R1.41 NC(=O)C1=C(N)ON=C1 6396AC [0,1,0,0,1,0|1,0,0]=3 350 B9R1.41 NC(=O)C1=CSC=C1Br 0861AQ [0,1,0,0,1,0|1,0,0]=3 351 B9R1.41 NC(=O)C1=NON=C1N 3786AD [0,1,0,0,1,0|2,0,0]=4 352 B9R1.41 NC1=C(C(=O)O)NC=N1 6671AB [0,1,0,0,1,0|2,0,0]=4 353 B9R1.41 O=C(O)C1=C(Br)OC=C1 Z5486 [0,1,0,0,1,0|2,0,0]=4 354 B9R1.41 O=C(O)C1=C(I)C=NN1 W7746 [0,1,0,0,1,0|2,0,0]=4 355 B11R1.20 CC(=O)NC1=CC=C(Br)N=C1 Y8599 [0,1,0,0,0,1|1,0,0]=3 356 B11R1.20 CC(=O)NC1=CN=C(Cl)C=C1 V5002 [0,1,0,0,0,1|1,0,0]=3 357 B11R1.20 CC(=O)OC1=CC=C(Cl)C=C1 X5399 [0,1,0,0,0,1|2,0,0]=4 358 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 V4105 [0,1,0,0,0,1|1,0,0]=3 359 B11R1.20 CC1=CC=C(N=C(N)N)C=C1 7745AB [0,1,0,0,0,1|2,0,0]=4 360 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 4423AJ [0,1,0,0,0,1|2,0,0]=4 361 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 6863AE [0,1,0,0,0,1|1,0,0]=3 362 B11R1.20 N=C(N)CC1=CC=C(Br)C=C1 6320AE [0,1,0,0,0,1|2,0,0]=4 363 B11R1.20 N=C(N)NC1=CC=C(F)C=C1 0100AC [0,1,0,0,0,1|2,0,0]=4 364 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 1746AL [0,1,0,0,0,1|1,0,0]=3 365 B11R1.20 NC(=O)NC1=CC=C(O)C=C1 7848AA [0,1,0,0,0,1|1,0,0]=3 366 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 4488AD [0,1,0,0,0,1|1,1,0]=4 367 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 2203AE [0,1,0,0,0,1|2,0,0]=4 368 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 6322AB [0,1,0,0,0,1|2,0,0]=4 369 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 5213AB [0,1,0,0,0,1|1,0,0]=3 370 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 E850 [0,1,0,0,0,1|2,0,0]=4 371 B11R1.36 CN(C(=O)Cl)C1=CC=CC=C1 Y1505 [0,1,0,0,0,1|2,0,0]=4 372 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 9111AE [0,1,0,0,0,1|1,0,0]=3 373 B11R1.36 O=C(O)C(=O)C1=CC=CN=C1 5219AB [0,1,0,0,0,1|1,0,0]=3 374 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 7920AA [0,1,0,0,0,1|2,0,0]=4 375 B11R1.40 CC(CN)OC1=CC=CN=C1 2002AF [0,1,0,0,0,1|1,0,1]=4 376 B11R1.40 CCC(=O)OC1=CC=CC=C1 8795AL [0,1,0,0,0,1|2,0,0]=4 377 B11R1.40 CNC(=O)CC1=CN=CC=C1 8304AC [0,1,0,0,0,1|0,0,0]=2 378 B11R1.40 CNC(=S)NC1=CC=CC=C1 S792 [0,1,0,0,0,1|1,1,0]=4 379 B11R1.40 COC(=O)CC1=CC=CN=C1 7040AJ [0,1,0,0,0,1|1,0,0]=3 380 B11R1.40 NCC(=O)NC1=CC=CC=C1 4165AE [0,1,0,0,0,1|1,0,0]=3 381 B11R1.40 NNC(=O)CC1=CC=NC=C1 Y5522 [0,1,0,0,0,1|2,0,0]=4 382 B11R1.40 NNC(=S)NC1=CC=CN=C1 4273AB [0,1,0,0,0,1|0,1,0]=3 383 B11R1.40 O=C(CCl)NC1=CC=CN=C1 2248AC [0,1,0,0,0,1|1,0,0]=3 384 B11R1.86 CC(=O)CC1=CC=CC=C1C 7072AB [0,1,0,0,0,1|2,0,0]=4 385 B11R1.86 CC(=O)CC1=CC=CC=C1O 5670AA [0,1,0,0,0,1|2,0,0]=4 386 B11R1.86 CC(=O)NC1=C(Br)N=CC=C1 8863AJ [0,1,0,0,0,1|1,0,0]=3 387 B11R1.86 CC(=O)NC1=CC=CNC1=O 9389AE [0,1,0,0,0,1|1,0,1]=4 388 B11R1.86 CC(=O)NC1=NN=CC=C1C 5765AJ [0,1,0,0,0,1|2,0,0]=4 389 B11R1.86 CC1=C(NC(=N)N)C=CC=C1 7575AH [0,1,0,0,0,1|2,0,0]=4 390 B11R1.86 CC1=C(NC(=N)N)C=CC=C1 7576AH [0,1,0,0,0,1|2,0,0]=4 391 B11R1.86 N=C(N)CC1=CC=CC=C1Br 3452AD [0,1,0,0,0,1|2,0,0]=4 392 B11R1.86 N=C(N)NC1=C(F)C=CC=C1 5657AB [0,1,0,0,0,1|2,0,0]=4 393 B11R1.86 NC(=S)CC1=CC=CC=C1Br Z6609 [0,1,0,0,0,1|1,1,0]=4 394 B11R1.86 NC(=S)NC1=CC=CC=C1Br V6496 [0,1,0,0,0,1|1,1,0]=4 395 B11R1.86 NC1=NC=CC=C1CC(=O)O 0495AA [0,1,0,0,0,1|1,0,0]=3 396 B11R1.86 O=C(O)CC1=C(Cl)N=CN=C1 5063AB [0,1,0,0,0,1|2,0,0]=4 397 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 Z4417 [0,1,0,0,0,1|2,0,0]=4 398 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 6862AA [0,1,0,0,0,1|2,0,0]=4 399 B11R1.157 CC(=O)NC1=NN=CC(C)=C1 5766AJ [0,1,0,0,0,1|2,0,0]=4 400 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 9927AB [0,1,0,0,0,1|2,0,0]=4 401 B11R1.157 N=C(N)NC1=CC(Cl)=CC=C1 9218AB [0,1,0,0,0,1|2,0,0]=4 402 B11R1.157 NC(=O)NC1=CC(N)=CC=C1 2129AB [0,1,0,0,0,1|1,0,0]=3 403 B11R1.157 O=C(O)CC1=CC(S)=CC=C1 9631AB [0,1,0,0,0,1|2,0,0]=4 404 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 9483AH [0,2,0,0,0,0|2,0,0]=4 405 B11R1.3 CC(=O)C1=CN=C(C#N)C=N1 5435AC [0,2,0,0,0,0|2,0,0]=4 406 B11R1.3 CCC1=NC=C([N+](=O)[O-])C=C1 3415AB [0,2,0,0,0,0|2,0,0]=4 407 B11R1.3 COC1=CN=C(C(N)=O)C=C1 V8588 [0,2,0,0,0,0|2,0,0]=4 408 B11R1.3 COC1=NC=C(C(=O)O)C=N1 Z0528 [0,2,0,0,0,0|2,0,0]=4 409 B11R1.3 CSC1=CC=C(C(=O)Cl)C=C1 0486AQ [0,2,0,0,0,0|2,0,0]=4 410 B11R1.3 N#CC1=NC=C(C(=O)O)C=N1 5532AJ [0,2,0,0,0,0|2,0,0]=4 411 B11R1.3 O=C(Br)C1=CC=C(CBr)C=C1 Z2833 [0,2,0,0,0,0|2,0,0]=4 412 B11R1.3 O=C(O)C1=CC=C(CO)N=C1 2161AC [0,2,0,0,0,0|1,0,0]=3 413 B11R1.19 NC1=CC=C(S(N)(=O)=O)C=N1 2988AL [0,2,0,0,0,0|1,0,0]=3 414 B11R1.19 NC1=NC=C(S(N)(=O)=O)C=N1 Y4892 [0,2,0,0,0,0|2,0,0]=4 415 B11R1.21 CC(=O)C1=CC(I)=C(N)C=C1 X7016 [0,2,0,0,0,0|2,0,0]=4 416 B11R1.21 CC(=O)C1=CC(I)=C(O)C=C1 1108AQ [0,2,0,0,0,0|2,0,0]=4 417 B11R1.21 CC(=O)C1=CC(N)=C(Br)C=C1 1073AQ [0,2,0,0,0,0|2,0,0]=4 418 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 8759AA [0,2,0,0,0,0|2,0,0]=4 419 B11R1.21 CC(=O)C1=CC=C(C)C(O)=C1 W5512 [0,2,0,0,0,0|2,0,0]=4 420 B11R1.21 CC(=O)C1=CN=C(C)C(C)=N1 7817AB [0,2,0,0,0,0|2,0,0]=4 421 B11R1.21 CC1=C(C)C=C(C(N)=S)C=C1 2091AJ [0,2,0,0,0,0|1,1,0]=4 422 B11R1.21 CC1=C(C)N=C(C(N)=O)C=N1 4144AB [0,2,0,0,0,0|1,0,0]=3 423 B11R1.21 CC1=C(Cl)N=CC(C(N)=O)=C1 7444AE [0,2,0,0,0,0|0,0,0]=2 424 B11R1.21 CC1=C(F)C=C(C(N)=S)C=C1 5832AD [0,2,0,0,0,0|1,1,0]=4 425 B11R1.21 CC1=CC(C(=O)O)=CNC1=O 0272AC [0,2,0,0,0,0|1,0,1]=4 426 B11R1.21 CC1=CC=C(C(=N)N)C=C1C 5252AH [0,2,0,0,0,0|2,0,0]=4 427 B11R1.21 CC1=NC(C(N)=O)=CC=C1Br Y3916 [0,2,0,0,0,0|2,0,0]=4 428 B11R1.21 N=C(N)C1=CC(Cl)=C(F)C=C1 2235AJ [0,2,0,0,0,0|2,0,0]=4 429 B11R1.21 N=C(N)C1=CC(Cl)=C(F)C=C1 5315AH [0,2,0,0,0,0|2,0,0]=4 430 B11R1.21 N=C(N)C1=CC=C(F)C(Br)=C1 Y4731 [0,2,0,0,0,0|2,0,0]=4 431 B11R1.21 N=C(N)C1=CC=C(F)C(F)=C1 2075AJ [0,2,0,0,0,0|2,0,0]=4 432 B11R1.21 NC(=O)C1=CC(N)=C(F)C=C1 6127AC [0,2,0,0,0,0|1,0,0]=3 433 B11R1.21 NC(=O)C1=CC(O)=C(O)C=C1 9447AJ [0,2,0,0,0,0|1,0,0]=3 434 B11R1.21 NC(=O)C1=CC=C(Br)C(Cl)=C1 Z8676 [0,2,0,0,0,0|1,0,0]=3 435 B11R1.21 NC(=O)C1=CC=C(Cl)C(Br)=C1 V7781 [0,2,0,0,0,0|1,0,0]=3 436 B11R1.21 NC(=O)C1=CC=C(Cl)C(Cl)=C1 8805AD [0,2,0,0,0,0|1,0,0]=3 437 B11R1.21 NC(=O)C1=CC=C(N)C(N)=C1 8382AE [0,2,0,0,0,0|1,0,0]=3 438 B11R1.21 NC(=O)C1=CN=C(Cl)C(Cl)=C1 9219AE [0,2,0,0,0,0|0,0,0]=2 439 B11R1.21 NC1=C(I)C=C(C(=O)O)C=N1 5309AE [0,2,0,0,0,0|1,0,0]=3 440 B11R1.21 NC1=CC(C(=O)O)=CC=C1F V5597 [0,2,0,0,0,0|2,0,0]=4 441 B11R1.21 NC1=CC(C(=O)O)=CC=C1O D461 [0,2,0,0,0,0|2,0,0]=4 442 B11R1.21 NC1=CC([N+](=O)[O-])=CN=C1N Y8840 [0,2,0,0,0,0|2,0,0]=4 443 B11R1.21 NC1=NC=C(C(=O)O)N=C1Br 4575AC [0,2,0,0,0,0|2,0,0]=4 444 B11R1.21 NC1=NC=C([N+](=O)[O-])C=C1O Z5323 [0,2,0,0,0,0|2,0,0]=4 445 B11R1.21 O=C(O)C1=CC(Cl)=C(F)N=C1 4922AB [0,2,0,0,0,0|1,0,0]=3 446 B11R1.21 O=C(O)C1=CC(F)=C(F)N=C1 Y4245 [0,2,0,0,0,0|1,0,0]=3 447 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 X6546 [0,2,0,0,0,0|2,0,0]=4 448 B11R1.21 O=C(O)C1=CN=C(Cl)C(I)=C1 Y6596 [0,2,0,0,0,0|1,0,0]=3 449 B11R1.21 O=C([O-])C1=CC=C(F)C(F)=C1 3820AL [0,2,0,0,0,0|2,0,0]=4 450 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(I)N=C1 6647AB [0,2,0,0,0,0|2,0,0]=4 451 B11R1.21 O=[N+]([O-])C1=CC(I)=C(Br)N=C1 8471AD [0,2,0,0,0,0|2,0,0]=4 452 B11R1.21 O=[N+]([O-])C1=CN=C(Cl)C(I)=C1 5015AH [0,2,0,0,0,0|2,0,0]=4 453 B11R1.21 O=[N+]([O-])C1=CN=C(F)C(F)=C1 W9741 [0,2,0,0,0,0|2,0,0]=4 454 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 7203AB [0,2,0,0,0,0|2,0,0]=4 455 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 7936AB [0,2,0,0,0,0|1,0,0]=3 456 B11R1.22 CC1=CN=C(C(=O)NN)C=N1 1913AE [0,2,0,0,0,0|1,0,0]=3 457 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 1437AL [0,2,0,0,0,0|2,0,0]=4 458 B11R1.22 CNC(=O)C1=CC=C(O)C=C1 2642AB [0,2,0,0,0,0|1,0,0]=3 459 B11R1.22 CNC(=O)C1=CN=C(Cl)N=C1 6428AA [0,2,0,0,0,0|1,0,0]=3 460 B11R1.22 COC(=O)C1=CC=C(N)C=C1 3562AL [0,2,0,0,0,0|2,0,0]=4 461 B11R1.22 COC(=O)C1=CN=C(C)N=C1 5600AE [0,2,0,0,0,0|2,0,0]=4 462 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 W5141 [0,2,0,0,0,0|2,0,0]=4 463 B11R1.22 COC(=O)C1=CN=C(I)C=C1 V3781 [0,2,0,0,0,0|1,0,0]=3 464 B11R1.22 COC(=O)C1=CNC(=O)N=C1 6987AB [0,2,0,0,0,0|2,0,0]=4 465 B11R1.22 COC(=O)C1=NN=C(C)C=C1 8321AC [0,2,0,0,0,0|2,0,0]=4 466 B11R1.22 N#CC(=O)C1=CC=C(Br)C=C1 2661AL [0,2,0,0,0,0|1,0,1]=4 467 B11R1.22 N#CC(=O)C1=CC=C(F)C=C1 7543AE [0,2,0,0,0,0|1,0,1]=4 468 B11R1.22 N=C(NO)C1=CC=C(Br)C=C1 9499AJ [0,2,0,0,0,0|2,0,0]=4 469 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 2630AL [0,2,0,0,0,0|2,0,0]=4 470 B11R1.22 NCC(=O)C1=CC=C(I)C=C1 9286AB [0,2,0,0,0,0|1,0,0]=3 471 B11R1.22 NNC(=O)C1=CC=C(Cl)C=N1 7212AA [0,2,0,0,0,0|2,0,0]=4 472 B11R1.22 NNC(=O)C1=CN=C(N)C=C1 Z3023 [0,2,0,0,0,0|0,0,0]=2 473 B11R1.22 NNC(=O)C1=NC=C(F)C=C1 Z4030 [0,2,0,0,0,0|2,0,0]=4 474 B11R1.22 NNC(=O)C1=NC=C(O)C=C1 Z2983 [0,2,0,0,0,0|2,0,0]=4 475 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 W6566 [0,2,0,0,0,0|1,0,1]=4 476 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 W7901 [0,2,0,0,0,0|1,0,1]=4 477 B11R1.22 O=C(CBr)C1=CC=C(Br)N=C1 Y6042 [0,2,0,0,0,0|1,0,0]=3 478 B11R1.22 O=C(CBr)C1=CN=C(Cl)N=C1 0273AA [0,2,0,0,0,0|2,0,0]=4 479 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 9573AB [0,2,0,0,0,0|2,0,0]=4 480 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 Y8738 [0,2,0,0,0,0|2,0,0]=4 481 B11R1.22 O=C(CO)C1=CC=C(Br)C=C1 3895AB [0,2,0,0,0,0|2,0,0]=4 482 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 2338AC [0,2,0,0,0,0|2,0,0]=4 483 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 A977 [0,2,0,0,0,0|2,0,0]=4 484 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 5627AH [0,2,0,0,0,0|2,0,0]=4 485 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 W4184 [0,2,0,0,0,0|2,0,0]=4 486 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 1378AL [0,2,0,0,0,0|2,0,0]=4 487 B11R1.166 CC(=O)C1=C(C)C=C(Cl)C=C1 5596AH [0,2,0,0,0,0|2,0,0]=4 488 B11R1.166 CC(=O)C1=CC=C(Br)C=C1N X9573 [0,2,0,0,0,0|2,0,0]=4 489 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl 2069AF [0,2,0,0,0,0|1,0,0]=3 490 B11R1.166 CC(=O)C1=CNC(=O)N=C1C X9048 [0,2,0,0,0,0|2,0,0]=4 491 B11R1.166 CC1=C(C(=N)N)C=CC(Cl)=C1 1883AF [0,2,0,0,0,0|2,0,0]=4 492 B11R1.166 CC1=C(C(=O)O)C=NC(O)=N1 7953AJ [0,2,0,0,0,0|2,0,0]=4 493 B11R1.166 CC1=C(C(N)=S)C=CC(Cl)=C1 8169AD [0,2,0,0,0,0|1,1,0]=4 494 B11R1.166 CC1=CC(Br)=CN=C1C(N)=O V3028 [0,2,0,0,0,0|2,0,0]=4 495 B11R1.166 CC1=CC(F)=C(C(=O)O)C=N1 1357AA [0,2,0,0,0,0|1,0,0]=3 496 B11R1.166 CC1=CC(N)=C(C(N)=O)N=C1 1002AD [0,2,0,0,0,0|2,0,0]=4 497 B11R1.166 CC1=CC=C(C(=O)O)C(Br)=N1 1620AJ [0,2,0,0,0,0|1,0,0]=3 498 B11R1.166 CC1=CN=C(C(=O)O)C(C)=N1 Z5384 [0,2,0,0,0,0|2,0,0]=4 499 B11R1.166 CC1=NC(N)=CC=C1C(=O)O 0478AC [0,2,0,0,0,0|1,0,0]=3 500 B11R1.166 CC1=NC=C(C(=O)O)C(=O)N1 6219AD [0,2,0,0,0,0|2,0,0]=4 501 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=N1 5812AC [0,2,0,0,0,0|2,0,0]=4 502 B11R1.166 CC1=NC=C(C(=O)O)C(N)=C1 X9715 [0,2,0,0,0,0|1,0,0]=3 503 B11R1.166 N=C(N)C1=C(F)C=C(Br)C=C1 2690AJ [0,2,0,0,0,0|2,0,0]=4 504 B11R1.166 N=C(N)C1=CC=C(Br)C=C1F 3281AH [0,2,0,0,0,0|2,0,0]=4 505 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1Cl 1384AJ [0,2,0,0,0,0|2,0,0]=4 506 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1F 5593AH [0,2,0,0,0,0|2,0,0]=4 507 B11R1.166 N=C(N)C1=CC=C(F)C=C1Cl 5020AH [0,2,0,0,0,0|2,0,0]=4 508 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=N1 2582AB [0,2,0,0,0,0|2,0,0]=4 509 B11R1.166 NC(=O)C1=C(O)C=C(Cl)C=C1 4852AB [0,2,0,0,0,0|1,0,0]=3 510 B11R1.166 NC(=O)C1=CC=C(Br)C=C1Cl V5905 [0,2,0,0,0,0|1,0,0]=3 511 B11R1.166 NC(=O)C1=CN=C(O)C=C1O 6041AJ [0,2,0,0,0,0|0,0,0]=2 512 B11R1.166 NC1=C(C(=O)O)C=NC(S)=N1 1291AF [0,2,0,0,0,0|2,0,0]=4 513 B11R1.166 NC1=CC(Br)=NC=C1[N+](=O)[O-] Y4181 [0,2,0,0,0,0|2,0,0]=4 514 B11R1.166 NC1=CC(N)=NC=C1[N+](=O)[O-] 2158AB [0,2,0,0,0,0|2,0,0]=4 515 B11R1.166 NC1=CC(O)=NC=C1C(=O)O Z5190 [0,2,0,0,0,0|1,0,0]=3 516 B11R1.166 NC1=CC(O)=NC=C1[N+](=O)[O-] W9874 [0,2,0,0,0,0|2,0,0]=4 517 B11R1.166 NC1=NC(Cl)=C([N+](=O)[O-])C=C1 W8714 [0,2,0,0,0,0|2,0,0]=4 518 B11R1.166 O=C(Cl)C1=CC=C(Cl)N=C1Cl Z0711 [0,2,0,0,0,0|1,0,0]=3 519 B11R1.166 O=C(O)C1=C(Cl)N=C(F)C=C1 3712AA [0,2,0,0,0,0|1,0,0]=3 520 B11R1.166 O=C(O)C1=C(F)C=C(F)N=C1 3121AC [0,2,0,0,0,0|1,0,0]=3 521 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Cl 1385AA [0,2,0,0,0,0|1,0,0]=3 522 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Br 1384AA [0,2,0,0,0,0|1,0,0]=3 523 B11R1.166 O=C(O)C1=CC=C(I)C=C1O 8615AA [0,2,0,0,0,0|2,0,0]=4 524 B11R1.166 O=[N+]([O-])C1=CC=C(O)N=C1O W3475 [0,2,0,0,0,0|2,0,0]=4 525 B11R1.16 CCCC(N)C1=CN=CC=C1 4944AJ [0,2,0,0,0,0|1,0,1]=4 526 B11R1.16 CCOC(=O)C1=CC=NN=C1 5094AB [0,2,0,0,0,0|2,0,0]=4 527 B11R1.16 C\C=C\C(=O)C1=CC=CC=C1 6705AB [0,2,0,0,0,0|2,0,0]=4 528 B11R1.16 N#CNC(=O)C1=CC=CC=C1 4699AD [0,2,0,0,0,0|1,0,0]=3 529 B11R1.16 N#C\N=C(/N)C1=CC=CC=C1 5678AD [0,2,0,0,0,0|2,0,0]=4 530 B11R1.16 N#C\N=C(/N)C1=NC=CN=C1 8204AC [0,2,0,0,0,0|2,0,0]=4 531 B11R1.16 O=C(\C=C\Cl)C1=CC=CC=C1 0138AQ [0,2,0,0,0,0|2,0,0]=4 532 B11R1.23 CC1=CC=CC(C(=O)C#N)=C1 5362AH [0,2,0,0,0,0|1,0,1]=4 533 B11R1.23 CC1=CC=CC(C(=O)CBr)=C1 7064AB [0,2,0,0,0,0|2,0,0]=4 534 B11R1.23 CNC(=O)C1=CC(Br)=NC=C1 V5272 [0,2,0,0,0,0|2,0,0]=4 535 B11R1.23 CNC(=O)C1=CC(Cl)=CC=C1 8051AJ [0,2,0,0,0,0|1,0,0]=3 536 B11R1.23 CNC(=O)C1=CC=CC(O)=C1 2288AJ [0,2,0,0,0,0|1,0,0]=3 537 B11R1.23 CNC(=O)C1=NC(Br)=CC=C1 V5271 [0,2,0,0,0,0|2,0,0]=4 538 B11R1.23 COC(=O)C1=CN=CC(O)=C1 7119AJ [0,2,0,0,0,0|1,0,0]=3 539 B11R1.23 N#CC(=O)C1=CC(F)=CC=C1 2278AJ [0,2,0,0,0,0|1,0,1]=4 540 B11R1.23 N=C(NO)C1=CC=CC(Br)=C1 V3789 [0,2,0,0,0,0|2,0,0]=4 541 B11R1.23 N=C(NO)C1=CC=CC(Cl)=C1 W4576 [0,2,0,0,0,0|2,0,0]=4 542 B11R1.23 NCC(=O)C1=CC(Br)=CC=C1 9285AB [0,2,0,0,0,0|1,0,0]=3 543 B11R1.23 NCC(=O)C1=CC(F)=CC=C1 5755AC [0,2,0,0,0,0|1,0,0]=3 544 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 V2280 [0,2,0,0,0,0|1,0,0]=3 545 B11R1.23 NNC(=O)C1=CC(Cl)=NC=C1 6071AE [0,2,0,0,0,0|2,0,0]=4 546 B11R1.23 NNC(=O)C1=NC(Cl)=CC=C1 4594AF [0,2,0,0,0,0|2,0,0]=4 547 B11R1.23 NNC(=O)C1=NC(I)=CC=C1 0675AF [0,2,0,0,0,0|2,0,0]=4 548 B11R1.23 O=C(CCl)C1=CC=CC(F)=C1 7664AB [0,2,0,0,0,0|2,0,0]=4 549 B11R1.23 O=CC(=O)C1=CC=CC(Br)=C1 X8794 [0,2,0,0,0,0|2,0,0]=4 550 B11R1.222 CC1=C(C(=O)NN)C=CC=N1 6633AD [0,2,0,0,0,0|0,0,0]=2 551 B11R1.222 CC1=C(\C(N)=N\O)C=CC=C1 2680AE [0,2,0,0,0,0|1,0,1]=4 552 B11R1.222 CC1=CC=CC=C1C(=O)C#N S734 [0,2,0,0,0,0|1,0,1]=4 553 B11R1.222 CC1=CC=CC=C1C(=O)CN X6576 [0,2,0,0,0,0|1,0,0]=3 554 B11R1.222 CCC(=O)C1=CC=CN=C1Cl 5775AA [0,2,0,0,0,0|1,0,0]=3 555 B11R1.222 CNC(=O)C1=NC=CN=C1N 4576AB [0,2,0,0,0,0|1,0,0]=3 556 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 9708AB [0,2,0,0,0,0|1,0,0]=3 557 B11R1.222 COC(=O)C1=CC=CN=C1S 9094AE [0,2,0,0,0,0|1,0,0]=3 558 B11R1.222 COC(=O)C1=CN=CC=C1Cl X9905 [0,2,0,0,0,0|1,0,0]=3 559 B11R1.222 COC(=O)C1=CN=CC=C1O V7225 [0,2,0,0,0,0|1,0,0]=3 560 B11R1.222 COC(=O)C1=NC=CN=C1I W3780 [0,2,0,0,0,0|2,0,0]=4 561 B11R1.222 N=C(NO)C1=C(Br)C=CC=C1 9398AJ [0,2,0,0,0,0|2,0,0]=4 562 B11R1.222 N=C(NO)C1=CC=CC=C1Cl 9402AJ [0,2,0,0,0,0|2,0,0]=4 563 B11R1.222 NC1=CC=CC=C1C(=O)NO 5665AE [0,2,0,0,0,0|1,0,0]=3 564 B11R1.222 NNC(=O)C1=C(N)C=NC=C1 7290AE [0,2,0,0,0,0|2,0,0]=4 565 B11R1.222 NNC(=O)C1=CC=CC=C1I 0066AE [0,2,0,0,0,0|1,0,0]=3 566 B11R1.222 NNC(=O)C1=CC=CN=C1N Y9355 [0,2,0,0,0,0|0,0,0]=2 567 B11R1.222 NNC(=O)C1=NC=CC=C1F 1032AA [0,2,0,0,0,0|2,0,0]=4 568 B11R1.222 NNC(=O)C1=NC=CN=C1N Y9794 [0,2,0,0,0,0|1,0,0]=3 569 B11R1.222 N\C(=N/O)C1=C(Cl)N=CC=C1 6396AB [0,2,0,0,0,0|0,0,1]=3 570 B11R1.222 N\C(=N\O)C1=CC=CC=C1F 9412AJ [0,2,0,0,0,0|1,0,1]=4 571 B11R1.222 O=C(CO)C1=C(Cl)C=CC=C1 4897AJ [0,2,0,0,0,0|2,0,0]=4 572 B11R1.87 NC1=C(S(=O)(=O)O)C=NC=C1 2654AJ [0,2,0,0,0,0|2,0,0]=4 573 B11R1.87 NC1=C(S(N)(=O)=O)C=NC=C1 Y5101 [0,2,0,0,0,0|1,0,0]=3 574 B11R1.87 O=S(=O)(Cl)C1=CC=CN=C1Cl 5030AH [0,2,0,0,0,0|2,0,0]=4 575 B11R1.155 CC1=CC(S(N)(=O)=O)=CC=C1 V3660 [0,2,0,0,0,0|2,0,0]=4 576 B11R1.155 O=S(=O)(Cl)C1=CC(Br)=CN=C1 V9053 [0,2,0,0,0,0|2,0,0]=4 577 B11R1.53 C#CC1=C(C(C)=O)C=CC=C1 1385AL [0,2,0,0,0,0|2,0,0]=4 578 B11R1.53 C=CC1=CC=CC=C1C(=O)O 2578AB [0,2,0,0,0,0|2,0,0]=4 579 B11R1.53 CNC1=C(C(=O)O)C=CC=N1 3608AB [0,2,0,0,0,0|1,0,0]=3 580 B11R1.53 COC1=C(C(=O)O)C=NC=N1 6197AJ [0,2,0,0,0,0|2,0,0]=4 581 B11R1.53 COC1=C(C(N)=O)C=NC=C1 1526AC [0,2,0,0,0,0|0,0,0]=2 582 B11R1.53 COC1=CC=CC=C1C(=N)N 1766AJ [0,2,0,0,0,0|2,0,0]=4 583 B11R1.53 COC1=CC=CC=C1C(=N)N 4779AE [0,2,0,0,0,0|2,0,0]=4 584 B11R1.53 CSC1=C(C(N)=O)C=CC=N1 Y7856 [0,2,0,0,0,0|0,0,0]=2 585 B11R1.53 CSC1=CC=CC=C1C(C)=O W3214 [0,2,0,0,0,0|2,0,0]=4 586 B11R1.53 N#CC1=C(C(=O)O)C=CC=N1 1354AC [0,2,0,0,0,0|1,0,0]=3 587 B11R1.53 N#CC1=C(C(=O)O)C=NC=C1 Z0867 [0,2,0,0,0,0|1,0,0]=3 588 B11R1.53 NCC1=CC=CC=C1C(=O)O 7123AC [0,2,0,0,0,0|2,0,0]=4 589 B11R1.53 NNC1=C(C(=O)O)C=CC=N1 3348AE [0,2,0,0,0,0|1,0,0]=3 590 B11R1.53 O=C(Br)C1=C(CBr)C=CC=C1 2821AE [0,2,0,0,0,0|2,0,0]=4 591 B11R1.53 O=CC1=C(C(=O)O)C=CC=N1 1604AB [0,2,0,0,0,0|1,0,0]=3 592 B11R1.53 O=[N+]([O-])C1=C(SCl)N=CC=C1 0378AQ [0,2,0,0,0,0|2,0,0]=4 593 B11R1.53 O=[N+]([O-])C1=CC=CN=C1CO 4749AJ [0,2,0,0,0,0|2,0,0]=4 594 B11R1.156 CC(=O)C1=C(C)C=CC=C1O 5570AJ [0,2,0,0,0,0|2,0,0]=4 595 B11R1.156 CC1=C(C(=O)O)C(O)=NC=C1 4902AB [0,2,0,0,0,0|1,0,0]=3 596 B11R1.156 CC1=C(C(N)=O)C(Cl)=CC=C1 0333AA [0,2,0,0,0,0|1,0,0]=3 597 B11R1.156 CC1=CC=NC(Cl)=C1C(=O)O 6948AA [0,2,0,0,0,0|1,0,0]=3 598 B11R1.156 CC1=CC=NC(F)=C1[N+](=O)[O-] N388 [0,2,0,0,0,0|2,0,0]=4 599 B11R1.156 CC1=NC=CC(Br)=C1C(=O)O 1355AA [0,2,0,0,0,0|1,0,0]=3 600 B11R1.156 CC1=NC=CC(C)=C1C(=O)O 8068AB [0,2,0,0,0,0|1,0,0]=3 601 B11R1.156 N=C(N)C1=C(Cl)C=CC=C1Cl 1411AJ [0,2,0,0,0,0|2,0,0]=4 602 B11R1.156 N=C(N)C1=C(F)C=CC=C1Cl 1668AJ [0,2,0,0,0,0|2,0,0]=4 603 B11R1.156 N=C(N)C1=C(F)C=CC=C1Cl 5026AH [0,2,0,0,0,0|2,0,0]=4 604 B11R1.156 N=C(N)C1=C(F)C=CC=C1F 1413AJ [0,2,0,0,0,0|2,0,0]=4 605 B11R1.156 NC(=O)C1=C(Cl)N=CC=C1Cl 8467AE [0,2,0,0,0,0|0,0,0]=2 606 B11R1.156 NC1=CC=CC(O)=C1C(=O)O W7041 [0,2,0,0,0,0|2,0,0]=4 607 B11R1.156 NC1=CC=NC(N)=C1[N+](=O)[O-] 3245AH [0,2,0,0,0,0|2,0,0]=4 608 B11R1.156 O=C(Cl)C1=C(Cl)C=CN=C1Cl 0732AQ [0,2,0,0,0,0|1,0,0]=3 609 B11R1.156 O=C(O)C1=C(Br)C=CC=C1O 5040AB [0,2,0,0,0,0|2,0,0]=4 610 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1Br Y3602 [0,2,0,0,0,0|1,0,0]=3 611 B11R1.159 CC(=O)C1=C(N)C(Br)=CC=C1 Q602 [0,2,0,0,0,0|2,0,0]=4 612 B11R1.159 CC(=O)C1=CC=CC(O)=C1F Z8077 [0,2,0,0,0,0|2,0,0]=4 613 B11R1.159 CC1=C(Br)C=NC=C1C(=O)O Z0772 [0,2,0,0,0,0|1,0,0]=3 614 B11R1.159 CC1=C(C(=O)O)C=NC=C1N 3079AJ [0,2,0,0,0,0|1,0,0]=3 615 B11R1.159 CC1=C(O)C(C(N)=O)=CC=C1 5564AJ [0,2,0,0,0,0|1,0,0]=3 616 B11R1.159 CC1=C([O-])C(C(=O)O)=CC=C1 3660AB [0,2,0,0,0,0|2,0,0]=4 617 B11R1.159 N=C(N)C1=CC=CC(Cl)=C1Cl 1343AJ [0,2,0,0,0,0|2,0,0]=4 618 B11R1.159 NC(=O)C1=CC=CC(N)=C1N Y6362 [0,2,0,0,0,0|1,0,0]=3 619 B11R1.159 NC(=S)C1=C(Cl)C(Cl)=CC=C1 0542AF [0,2,0,0,0,0|1,1,0]=4 620 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O Z4830 [0,2,0,0,0,0|1,0,0]=3 621 B11R1.159 NC1=C(C(=O)O)C=CC=C1O 6062AL [0,2,0,0,0,0|2,0,0]=4 622 B11R1.159 NC1=C(Cl)C=NC=C1[N+](=O)[O-] W9222 [0,2,0,0,0,0|2,0,0]=4 623 B11R1.159 NC1=C(I)C=CC=C1C(=O)O X2788 [0,2,0,0,0,0|2,0,0]=4 624 B11R1.159 NC1=CC=CC(C(=O)O)=C1I 0474AQ [0,2,0,0,0,0|2,0,0]=4 625 B11R1.159 NC1=CN=CC([N+](=O)[O-])=C1N 5974AB [0,2,0,0,0,0|2,0,0]=4 626 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I 4447AA [0,2,0,0,0,0|2,0,0]=4 627 B11R1.159 O=C(O)C1=CC=CC(O)=C1Br 5445AC [0,2,0,0,0,0|2,0,0]=4 628 B11R1.159 O=C(O)C1=CC=CC(O)=C1F Z1094 [0,2,0,0,0,0|2,0,0]=4 629 B11R1.159 O=C(O)C1=CN=CC(Br)=C1I 0608AQ [0,2,0,0,0,0|1,0,0]=3 630 B11R1.159 O=C(O)C1=CN=CC(Cl)=C1Cl 4093AE [0,2,0,0,0,0|1,0,0]=3 631 B11R1.159 O=[N+]([O-])C1=C(O)C(I)=CN=C1 8393AC [0,2,0,0,0,0|2,0,0]=4 632 B11R1.167 CC(=O)C1=C(Br)C=CC(C)=C1 X7080 [0,2,0,0,0,0|2,0,0]=4 633 B11R1.167 CC(=O)C1=CC(C)=CN=C1Cl 1794AF [0,2,0,0,0,0|1,0,0]=3 634 B11R1.167 CC(=O)C1=CC(F)=CC=C1C X8233 [0,2,0,0,0,0|2,0,0]=4 635 B11R1.167 CC(=O)C1=CC(F)=CN=C1Cl 3519AA [0,2,0,0,0,0|1,0,0]=3 636 B11R1.167 CC1=C(C(=O)O)C=C(I)C=N1 0904AQ [0,2,0,0,0,0|1,0,0]=3 637 B11R1.167 CC1=C(C(=O)O)C=C(N)C=N1 1797AA [0,2,0,0,0,0|1,0,0]=3 638 B11R1.167 CC1=C(C(N)=O)C=[N+](C)C=C1 8765AC [0,2,0,0,0,0|0,0,1]=3 639 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 X7039 [0,2,0,0,0,0|1,0,0]=3 640 B11R1.167 CC1=CC=C(Cl)C=C1C(N)=O Y5855 [0,2,0,0,0,0|1,0,0]=3 641 B11R1.167 CC1=CC=C(F)C=C1C(=N)N 1880AF [0,2,0,0,0,0|2,0,0]=4 642 B11R1.167 CC1=CC=C(F)C=C1C(=N)N 5851AH [0,2,0,0,0,0|2,0,0]=4 643 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 Y3581 [0,2,0,0,0,0|1,0,0]=3 644 B11R1.167 CC1=NC=C(Cl)C=C1C(=O)O Y5175 [0,2,0,0,0,0|1,0,0]=3 645 B11R1.167 N=C(N)C1=C(F)C=CC(Cl)=C1 0380AC [0,2,0,0,0,0|2,0,0]=4 646 B11R1.167 N=C(N)C1=C(F)C=CC(Cl)=C1 5824AH [0,2,0,0,0,0|2,0,0]=4 647 B11R1.167 N=C(N)C1=CC(Br)=CC=C1F 5799AH [0,2,0,0,0,0|2,0,0]=4 648 B11R1.167 N=C(N)C1=CC(F)=CC=C1F 1401AJ [0,2,0,0,0,0|2,0,0]=4 649 B11R1.167 NC(=O)C1=C(Br)N=CC(Br)=C1 Z1272 [0,2,0,0,0,0|0,0,0]=2 650 B11R1.167 NC(=O)C1=C(Cl)C=CC(Cl)=N1 7688AA [0,2,0,0,0,0|2,0,0]=4 651 B11R1.167 NC(=O)C1=C(F)C=CC(Cl)=C1 2259AB [0,2,0,0,0,0|1,0,0]=3 652 B11R1.167 NC(=O)C1=CC(Br)=CN=C1F Z0071 [0,2,0,0,0,0|0,0,0]=2 653 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1Cl Y3868 [0,2,0,0,0,0|2,0,0]=4 654 B11R1.167 NC(=O)C1=CC(Cl)=NN=C1Cl 2606AB [0,2,0,0,0,0|1,0,0]=3 655 B11R1.167 NC(=O)C1=NC(Br)=CC=C1Cl 2973AD [0,2,0,0,0,0|2,0,0]=4 656 B11R1.167 NC(=O)C1=NC(Cl)=CC=C1Br 5390AA [0,2,0,0,0,0|2,0,0]=4 657 B11R1.167 NC(=O)C1=NC(Cl)=CN=C1Cl 0605AA [0,2,0,0,0,0|1,0,0]=3 658 B11R1.167 NC(=O)C1=NC(Cl)=CN=C1N 2193AA [0,2,0,0,0,0|1,0,0]=3 659 B11R1.167 NC(=O)C1=NC(F)=CN=C1F 4464AB [0,2,0,0,0,0|1,0,0]=3 660 B11R1.167 NC(=S)C1=C(Cl)C=CC(Cl)=C1 8311AE [0,2,0,0,0,0|1,1,0]=4 661 B11R1.167 NC1=C(C(=O)O)C=C(F)C=N1 Z8105 [0,2,0,0,0,0|1,0,0]=3 662 B11R1.167 NC1=CC(C(=O)O)=C(N)C=C1 9139AB [0,2,0,0,0,0|2,0,0]=4 663 B11R1.167 NC1=NC=C(I)N=C1C(=O)O 3890AC [0,2,0,0,0,0|2,0,0]=4 664 B11R1.167 O=C(O)C1=CC(Br)=CC=C1S X6084 [0,2,0,0,0,0|2,0,0]=4 665 B11R1.167 O=C(O)C1=CC(Cl)=NN=C1O W6594 [0,2,0,0,0,0|2,0,0]=4 666 B11R1.167 O=C(O)C1=NC(Br)=CN=C1O 4958AA [0,2,0,0,0,0|2,0,0]=4 667 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Br Z4046 [0,2,0,0,0,0|2,0,0]=4 668 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Cl 4461AB [0,2,0,0,0,0|2,0,0]=4 669 B11R1.167 O=[N+]([O-])C1=CC(Br)=CN=C1S V8671 [0,2,0,0,0,0|2,0,0]=4 670 B11R1.167 O=[N+]([O-])C1=CC(I)=CN=C1Br 3188AE [0,2,0,0,0,0|2,0,0]=4 671 B11R1.74 N=C(N)C1=CC(Cl)=CC(Cl)=C1 2098AJ [0,2,0,0,0,0|2,0,0]=4 672 B11R1.74 N=C(N)C1=CC(F)=CC(F)=C1 8619AB [0,2,0,0,0,0|2,0,0]=4 673 B11R1.74 NC(=O)C1=CC(N)=CC(F)=C1 0881AA [0,2,0,0,0,0|1,0,0]=3 674 B11R1.74 NC(=O)C1=CC(O)=CC(Br)=C1 Z8779 [0,2,0,0,0,0|1,0,0]=3 675 B11R1.74 NC(=O)C1=CC(O)=CC(O)=C1 W5351 [0,2,0,0,0,0|1,0,0]=3 676 B11R1.74 NC(=O)C1=CC(O)=NC(O)=C1 5359AJ [0,2,0,0,0,0|2,0,0]=4 677 B11R1.266 C#CC1=CC(C(C)=O)=CC=C1 6794AA [0,2,0,0,0,0|2,0,0]=4 678 B11R1.266 C#CC1=CC=CC(C(N)=O)=C1 8729AB [0,2,0,0,0,0|1,0,0]=3 679 B11R1.266 CC(=O)C1=CC=CC(CCl)=C1 W6202 [0,2,0,0,0,0|2,0,0]=4 680 B11R1.266 CCC1=CC(C(C)=O)=CC=C1 1395AB [0,2,0,0,0,0|2,0,0]=4 681 B11R1.266 CCC1=CC=CC(C(N)=O)=N1 2254AC [0,2,0,0,0,0|2,0,0]=4 682 B11R1.266 COC1=CC([N+](=O)[O-])=CN=C1 5408AA [0,2,0,0,0,0|2,0,0]=4 683 B11R1.266 COC1=CN=CC(C(C)=O)=C1 X7999 [0,2,0,0,0,0|1,0,0]=3 684 B11R1.266 COC1=NC=CC(C(N)=O)=C1 Z6815 [0,2,0,0,0,0|2,0,0]=4 685 B11R1.266 N#CC1=CC(C(=O)O)=CN=C1 4593AC [0,2,0,0,0,0|1,0,0]=3 686 B11R1.266 NC(=O)C1=NC(CO)=CC=C1 5693AB [0,2,0,0,0,0|2,0,0]=4 687 B11R1.266 O=C(Br)C1=CC=CC(CBr)=C1 7128AD [0,2,0,0,0,0|2,0,0]=4 688 B9R1.13 NC(=O)CC1=CSC=C1 V2784 [0,0,1,1,0,0|1,0,1]=4 689 B9R1.13 NC(=O)CN1C=CN=C1 0131AC [0,0,1,1,0,0|1,0,1]=4 690 B9R1.69 O=C1NC(Cl)=CC=C1Br 3079AC [0,0,1,1,0,0|2,0,0]=4 691 B11R2.10 BrC1=CC2=C(C=CN=C2)S1 6083AC [0,0,0,1,0,1|1,1,0]=4 692 B11R2.10 BrC1=CC2=C(N=CC=C2)N1 1677AA [0,0,0,1,0,1|1,0,0]=3 693 B11R2.10 BrC1=CC2=NC=CC=C2S1 6065AC [0,0,0,1,0,1|2,0,0]=4 694 B11R2.10 CC1=CC2=NC=CC=C2N1 W8141 [0,0,0,1,0,1|2,0,0]=4 695 B11R2.10 CC1=NC2=C(N=CN=C2)N1 Z5362 [0,0,0,1,0,1|2,0,0]=4 696 B11R2.10 ClC1=NC2=C(C=CN=C2)S1 W9080 [0,0,0,1,0,1|1,1,0]=4 697 B11R2.10 ClC1=NC2=CC=CN=C2O1 8050AA [0,0,0,1,0,1|1,0,1]=4 698 B11R2.10 ClC1=NC2=NC=CC=C2O1 0645AP [0,0,0,1,0,1|1,0,1]=4 699 B11R2.10 ClC1=NC2=NC=CC=C2S1 3260AA [0,0,0,1,0,1|1,0,1]=4 700 B11R2.10 IC1=CC2=CC=CC=C2N1 2333AB [0,0,0,1,0,1|2,0,0]=4 701 B11R2.10 IC1=CC2=CC=CN=C2N1 X9534 [0,0,0,1,0,1|1,0,0]=3 702 B11R2.10 NC1=NC2=C(C=CC=N2)S1 6382AA [0,0,0,1,0,1|1,0,0]=3 703 B11R2.10 NC1=NC2=C(C=NC=N2)N1 0404AB [0,0,0,1,0,1|2,0,0]=4 704 B11R2.10 NC1=NC2=C(N=CC=C2)S1 3479AB [0,0,0,1,0,1|0,1,0]=3 705 B11R2.10 NC1=NC2=C(N=CN=C2)S1 5546AC [0,0,0,1,0,1|1,1,0]=4 706 B11R2.10 NC1=NC2=CN=CC=C2N1 0486AC [0,0,0,1,0,1|1,0,0]=3 707 B11R2.10 NC1=NC2=NC=CC=C2O1 V5829 [0,0,0,1,0,1|1,0,0]=3 708 B11R2.10 NC1=NN2C=CC=NC2=N1 0218AD [0,0,0,1,0,1|2,0,0]=4 709 B11R2.10 O=C1C=C2C=CC=CN2N1 8937AB [0,0,0,1,0,1|2,0,0]=4 710 B11R2.10 O=C1NC2=C(C=NC=C2)O1 0581AC [0,0,0,1,0,1|0,0,0]=2 711 B11R2.10 O=C1OC2=C(C=CC=C2)O1 1033AB [0,0,0,1,0,1|2,0,0]=4 712 B11R2.10 OC1=CC2=CC=CN=C2N1 5064AA [0,0,0,1,0,1|0,0,1]=3 713 B11R2.10 S=C1CC2=C(C=CC=C2)N1 6726AB [0,0,0,1,0,1|1,1,0]=4 714 B11R2.1 BrC1=CNC2=C1C=NC=C2 Y8381 [0,1,0,1,0,0|1,0,0]=3 715 B11R2.1 BrC1=CNC2=C1N=CC=N2 W6987 [0,1,0,1,0,0|2,0,0]=4 716 B11R2.1 BrC1=NNC2=C1C=NC=C2 W7532 [0,1,0,1,0,0|1,0,0]=3 717 B11R2.1 BrC1=NNC2=NC=CC=C12 Z2701 [0,1,0,1,0,0|1,0,0]=3 718 B11R2.1 ClC1=CNC2=NC=CC=C12 Y5559 [0,1,0,1,0,0|1,0,0]=3 719 B11R2.1 ClC1=NNC2=C1C=CC=N2 2394AL [0,1,0,1,0,0|1,0,0]=3 720 B11R2.1 IC1=CNC2=C1C=NC=C2 W9006 [0,1,0,1,0,0|1,0,0]=3 721 B11R2.1 NC1=C2C=CC=NC2=NS1 2145AJ [0,1,0,1,0,0|0,1,0]=3 722 B11R2.1 NC1=CSC2=C1C=NC=C2 X4948 [0,1,0,1,0,0|0,1,0]=3 723 B11R2.1 NC1=CSC2=CC=CC=C12 W5550 [0,1,0,1,0,0|1,1,0]=4 724 B11R2.1 NC1=CSC2=CC=CC=C12 Y5306 [0,1,0,1,0,0|1,1,0]=4 725 B11R2.1 NC1=CSC2=NC=CN=C12 8938AB [0,1,0,1,0,0|1,1,0]=4 726 B11R2.1 NC1=NOC2=NC=CC=C12 V9236 [0,1,0,1,0,0|0,0,1]=3 727 B11R2.1 O=C1C=CC2=C1C=CC=C2 Y5096 [0,1,0,1,0,0|2,0,0]=4 728 B11R2.1 O=C1CCC2=NC=CC=C12 4182AA [0,1,0,1,0,0|1,0,0]=3 729 B11R2.1 O=C1NCC2=C1C=CN=C2 1363AJ [0,1,0,1,0,0|2,0,0]=4 730 B11R2.1 O=C1NNC2=CC=CN=C12 7206AB [0,1,0,1,0,0|2,0,0]=4 731 B11R2.1 O=C1NNC2=NC=CC=C12 Z4567 [0,1,0,1,0,0|0,0,0]=2 732 B11R2.40 NC1(C2=CN=CC=C2)CC1 6906AB [0,1,0,1,0,0|1,0,1]=4 733 B7R1.1 NCC1=CC=CN1 W7617 [1,0,0,0,1,0|0,0,2]=4 734 B7R1.1 NCC1=CC=NN1 4193AH [1,0,0,0,1,0|1,0,1]=4 735 B7R1.1 NCC1=COC=C1 Y7389 [1,0,0,0,1,0|1,0,1]=4 736 B7R1.1 NCC1=COC=C1 Y9148 [1,0,0,0,1,0|1,0,1]=4 737 B7R1.1 NCC1=COC=N1 Y1477 [1,0,0,0,1,0|1,0,1]=4 738 B7R1.1 NCC1=CON=C1 3103AA [1,0,0,0,1,0|1,0,1]=4 739 B7R1.1 NCC1=CON=C1 8976AA [1,0,0,0,1,0|1,0,1]=4 740 B7R1.1 NCC1=CSC=C1 Z3907 [1,0,0,0,1,0|1,0,1]=4 741 B7R1.1 NCC1=CSC=N1 0159AD [1,0,0,0,1,0|1,0,1]=4 742 B7R1.1 NCC1=NC=CN1 1371AB [1,0,0,0,1,0|1,0,1]=4 743 B7R1.1 NCC1=NC=CO1 0960AA [1,0,0,0,1,0|1,0,1]=4 744 B7R1.1 O=CC1=CC=C[Se]1 5634AL [1,0,0,0,1,0|1,0,0]=3 745 B7R1.1 O=CC1=CNN=N1 Z5678 [1,0,0,0,1,0|2,0,0]=4 746 B7R1.1 O=CC1=NC=CO1 7478AE [1,0,0,0,1,0|1,0,0]=3 747 B11R1.91 N=C(N)CCC1=CC=CC=C1 8227AD [0,0,0,0,0,2|2,0,0]=4 748 B11R1.91 N=C(N)COC1=CC=CC=C1 0368AC [0,0,0,0,0,2|2,0,0]=4 749 B11R1.91 N=C(N)\C=C\C1=CC=CC=C1 2381AJ [0,0,0,0,0,2|2,0,0]=4 750 B11R1.91 N=C(N)\C=C\C1=CC=CC=C1 2382AJ [0,0,0,0,0,2|2,0,0]=4 751 B11R1.91 NC(=O)C#CC1=CC=CC=C1 2477AL [0,0,0,0,0,2|1,0,0]=3 752 B11R1.91 NC(=O)CCC1=NC=CC=C1 5628AJ [0,0,0,0,0,2|2,0,0]=4 753 B11R1.91 NC(=O)CNC1=CC=CC=C1 V4420 [0,0,0,0,0,2|1,0,0]=3 754 B11R1.91 NC(N)=NCC1=CC=CC=C1 7568AD [0,0,0,0,0,2|2,0,0]=4 755 B11R1.91 O=C(O)C#CC1=CC=CN=C1 5647AJ [0,0,0,0,0,2|1,0,0]=3 756 B11R1.91 O=C([O-])C#CC1=CC=CC=C1 8155AF [0,0,0,0,0,2|2,0,0]=4 757 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CN=C1 Y6136 [0,0,0,0,0,2|2,0,0]=4 758 B11R1.91 O=[N+]([O-])\C=C\C1=CN=CC=C1 0002AE [0,0,0,0,0,2|2,0,0]=4