0 B9R1.8 C#C[I+]C1=CC=CC=C1 7930AL [0,0,0,0,0,0|2,0,1]=3 1 B9R1.8 CNCC1=CC=NC=N1 4986AA [0,0,0,0,0,0|4,0,0]=4 2 B9R1.8 CNCC1=CN=CC=C1 7435AH [0,0,0,0,0,0|3,0,0]=3 3 B9R1.8 ClC#CC1=CC=CC=C1 0032AQ [0,0,0,0,0,0|1,0,2]=3 4 B9R1.8 ClCCC1=CC=NC=C1 2738AB [0,0,0,0,0,0|2,0,1]=3 5 B9R1.8 ClCCC1=CN=CC=C1 5261AB [0,0,0,0,0,0|2,0,1]=3 6 B9R1.8 Cl[Mg]CC1=CC=CC=C1 8408AJ [0,0,0,0,0,0|2,0,0]=2 7 B9R1.8 IC#CC1=CC=CC=C1 0175AQ [0,0,0,0,0,0|1,0,2]=3 8 B9R1.8 N#CCC1=CN=NC=C1 9481AC [0,0,0,0,0,0|3,0,1]=4 9 B9R1.8 NCCC1=CN=CN=C1 3332AC [0,0,0,0,0,0|3,0,1]=4 10 B9R1.8 NCCC1=NC=CC=N1 4806AC [0,0,0,0,0,0|3,0,1]=4 11 B9R1.8 NCCC1=NC=NC=C1 1885AJ [0,0,0,0,0,0|3,0,1]=4 12 B9R1.8 NCCC1=NC=NC=C1 1886AJ [0,0,0,0,0,0|3,0,1]=4 13 B9R1.8 NNCC1=CC=CC=N1 4874AC [0,0,0,0,0,0|3,0,0]=3 14 B9R1.8 NNCC1=NC=CN=C1 1808AL [0,0,0,0,0,0|4,0,0]=4 15 B9R1.8 NNCC1=NC=CN=C1 5211AA [0,0,0,0,0,0|4,0,0]=4 16 B9R1.8 O=C=NC1=CC=NC=C1 Z2906 [0,0,0,0,0,0|2,0,1]=3 17 B9R1.8 O=CCC1=CC=CN=C1 5877AB [0,0,0,0,0,0|1,0,0]=1 18 B9R1.8 OCCC1=NC=CC=N1 1887AJ [0,0,0,0,0,0|2,0,2]=4 19 B9R1.8 OCCC1=NC=NC=C1 0497AC [0,0,0,0,0,0|2,0,2]=4 20 B9R1.8 O\N=C/C1=CC=CC=C1 9354AB [0,0,0,0,0,0|1,0,2]=3 21 B8R1.2 BrCC1=CN=CN=C1 1987AB [1,0,0,0,0,0|3,0,0]=4 22 B8R1.2 BrCC1=NC=NC=C1 6571AA [1,0,0,0,0,0|3,0,0]=4 23 B8R1.2 BrCC1=NC=NC=C1 7791AB [1,0,0,0,0,0|3,0,0]=4 24 B8R1.2 BrCC1=NN=CC=C1 X0198 [1,0,0,0,0,0|3,0,0]=4 25 B8R1.2 ClCC1=CC=CC=N1 V2306 [1,0,0,0,0,0|2,0,0]=3 26 B8R1.2 ClCC1=NC=CN=C1 Y8973 [1,0,0,0,0,0|3,0,0]=4 27 B8R1.2 ClCC1=NC=NC=C1 7792AB [1,0,0,0,0,0|3,0,0]=4 28 B8R1.2 ClCC1=NN=CC=C1 5659AB [1,0,0,0,0,0|3,0,0]=4 29 B8R1.2 NCC1=CN=CN=C1 W4845 [1,0,0,0,0,0|3,0,0]=4 30 B8R1.2 NCC1=NC=CC=N1 4855AH [1,0,0,0,0,0|3,0,0]=4 31 B8R1.2 NCC1=NC=CN=C1 9838AJ [1,0,0,0,0,0|3,0,0]=4 32 B8R1.2 NNC1=CC=CN=C1 Z1664 [1,0,0,0,0,0|3,0,0]=4 33 B8R1.2 O=CC1=CC=NC=N1 W4791 [1,0,0,0,0,0|2,0,0]=3 34 B8R1.2 OCC1=CC=NC=C1 D932 [1,0,0,0,0,0|1,0,1]=3 35 B8R1.2 OCC1=NC=CC=C1 D931 [1,0,0,0,0,0|1,0,1]=3 36 B10R1.1 C=COC1=CC=C(N)C=C1 7199AC [0,1,0,0,0,0|2,0,0]=3 37 B10R1.1 CC1=CC=C(N=[N+]=[N-])C=C1 0054AQ [0,1,0,0,0,0|3,0,0]=4 38 B10R1.1 CC1=NC=C(CNN)C=C1 0436AA [0,1,0,0,0,0|3,0,0]=4 39 B10R1.1 CC1=NC=C(N=C=O)C=C1 Z2986 [0,1,0,0,0,0|2,0,1]=4 40 B10R1.1 CNCC1=CN=C(Cl)C=C1 9683AL [0,1,0,0,0,0|3,0,0]=4 41 B10R1.1 CSCC1=CN=C(Cl)C=C1 7608AC [0,1,0,0,0,0|3,0,0]=4 42 B10R1.1 NCCC1=CN=C(Br)C=C1 5186AC [0,1,0,0,0,0|2,0,1]=4 43 B10R1.1 NCCC1=CN=C(Cl)C=C1 7778AB [0,1,0,0,0,0|2,0,1]=4 44 B10R1.1 O=CNC1=CC=C(Br)C=C1 1242AQ [0,1,0,0,0,0|1,0,0]=2 45 B10R1.1 O=CNC1=CC=C(Cl)C=N1 3661AL [0,1,0,0,0,0|2,0,0]=3 46 B10R1.1 [N-]=[N+]=NC1=CC=C(Br)C=C1 0041AQ [0,1,0,0,0,0|3,0,0]=4 47 B10R1.1 [N-]=[N+]=NC1=CC=C(Cl)C=C1 0043AQ [0,1,0,0,0,0|3,0,0]=4 48 B10R1.1 [N-]=[N+]=NC1=CC=C(F)C=C1 0045AQ [0,1,0,0,0,0|3,0,0]=4 49 B10R1.4 C=CCC1=C(Cl)C=CC=C1 7969AA [0,1,0,0,0,0|1,0,0]=2 50 B10R1.4 C=CCC1=C(F)C=CC=C1 5696AE [0,1,0,0,0,0|1,0,0]=2 51 B10R1.4 CC1=CC=CC=C1CC=O 7409AC [0,1,0,0,0,0|0,0,0]=1 52 B10R1.4 CC1=CC=CC=C1N=[N+]=[N-] 0050AQ [0,1,0,0,0,0|3,0,0]=4 53 B10R1.4 ClCOC1=C(Cl)C=CC=C1 8609AB [0,1,0,0,0,0|2,0,1]=4 54 B10R1.4 NC1=NC=CC=C1CCO 6447AC [0,1,0,0,0,0|1,0,2]=4 55 B10R1.4 NCCC1=C(F)C=CC=N1 1108AJ [0,1,0,0,0,0|2,0,1]=4 56 B10R1.4 NCCN1C=CC=CC1=O Y8846 [0,1,0,0,0,0|2,0,1]=4 57 B10R1.4 NOCC1=CC=CC=C1Br 7199AB [0,1,0,0,0,0|2,0,0]=3 58 B10R1.4 O=C1C=CC=CN1CCCl 7140AB [0,1,0,0,0,0|2,0,1]=4 59 B10R1.4 O=CCC1=CC=CC=C1Br X2126 [0,1,0,0,0,0|0,0,0]=1 60 B10R1.4 O=CCC1=CC=CC=C1Cl 5867AB [0,1,0,0,0,0|0,0,0]=1 61 B10R1.10 C=CCC1=CC(O)=CC=C1 5771AJ [0,1,0,0,0,0|1,0,0]=2 62 B10R1.10 C=CCC1=CC=CC(C)=C1 0989AQ [0,1,0,0,0,0|1,0,0]=2 63 B10R1.10 CC1=CC(CC=O)=CC=C1 8853AE [0,1,0,0,0,0|0,0,0]=1 64 B10R1.10 CC1=NC=CC(CCN)=C1 Y9654 [0,1,0,0,0,0|2,0,1]=4 65 B10R1.10 CC1=NC=CC(CNN)=C1 2499AD [0,1,0,0,0,0|3,0,0]=4 66 B10R1.10 CCCC1=CC(F)=CC=C1 2809AB [0,1,0,0,0,0|1,0,1]=3 67 B10R1.10 CCCC1=CC(N)=NC=C1 2921AJ [0,1,0,0,0,0|2,0,1]=4 68 B10R1.10 CCCC1=NC=CC(Cl)=C1 2766AJ [0,1,0,0,0,0|2,0,1]=4 69 B10R1.10 CCCC1=NC=CC(Cl)=C1 Z2848 [0,1,0,0,0,0|2,0,1]=4 70 B10R1.10 CNCC1=CC(Cl)=NC=C1 9152AE [0,1,0,0,0,0|3,0,0]=4 71 B10R1.10 N#CCC1=CC(N)=CC=C1 2233AA [0,1,0,0,0,0|1,0,1]=3 72 B10R1.10 NCCC1=CC(Br)=CN=C1 1207AJ [0,1,0,0,0,0|2,0,1]=4 73 B10R1.10 NCCC1=NC(Cl)=CC=C1 5821AC [0,1,0,0,0,0|2,0,1]=4 74 B10R1.10 NNCC1=CC=CC(O)=C1 W8565 [0,1,0,0,0,0|2,0,0]=3 75 B10R1.10 NOCC1=CC(Br)=CC=C1 7993AA [0,1,0,0,0,0|2,0,0]=3 76 B10R1.10 O=CCC1=CC(Cl)=CC=C1 3014AE [0,1,0,0,0,0|0,0,0]=1 77 B10R1.10 O=CCC1=CC(F)=CC=C1 9224AE [0,1,0,0,0,0|0,0,0]=1 78 B10R1.10 O=CCC1=CC=CC(Br)=C1 Y7020 [0,1,0,0,0,0|0,0,0]=1 79 B10R1.10 O=CCC1=NC(Br)=CC=C1 3706AA [0,1,0,0,0,0|1,0,0]=2 80 B10R1.15 C#CC(O)C1=CC=NC=C1 1743AA [0,1,0,0,0,0|2,0,1]=4 81 B10R1.15 C=C(CBr)C1=CC=CC=C1 Z4610 [0,1,0,0,0,0|1,0,2]=4 82 B10R1.15 C[C@@H](NO)C1=CC=CC=C1 1195AL [0,1,0,0,0,0|1,0,1]=3 83 B10R1.15 N#C[C@@H](O)C1=CC=CC=C1 2803AB [0,1,0,0,0,0|1,0,1]=3 84 B10R1.15 NC(CO)C1=CC=CC=N1 1469AJ [0,1,0,0,0,0|1,0,2]=4 85 B10R1.15 NC(CO)C1=CC=NC=C1 1231AC [0,1,0,0,0,0|1,0,2]=4 86 B10R1.15 NCC(O)C1=CC=CC=C1 3929AE [0,1,0,0,0,0|1,0,1]=3 87 B10R1.15 NCC(O)C1=CC=NC=C1 1456AJ [0,1,0,0,0,0|2,0,1]=4 88 B10R1.15 NC[C@@H](F)C1=CC=CC=C1 0407AQ [0,1,0,0,0,0|1,0,1]=3 89 B10R1.15 O=CC(Br)C1=CC=CC=C1 8662AA [0,1,0,0,0,0|0,0,0]=1 90 B10R1.17 BrCCCC1=CN=CC=C1 8653AC [0,1,0,0,0,0|2,0,1]=4 91 B10R1.17 C#CCNC1=CC=CC=C1 6094AD [0,1,0,0,0,0|1,0,1]=3 92 B10R1.17 COCOC1=CC=CC=C1 0189AF [0,1,0,0,0,0|2,0,0]=3 93 B10R1.17 N#CNCC1=CN=CC=C1 6277AD [0,1,0,0,0,0|2,0,1]=4 94 B10R1.17 NC\C=C\C1=CC=CC=C1 5624AE [0,1,0,0,0,0|1,0,1]=3 95 B10R1.17 O=C\C=C\C1=CC=NC=C1 7159AL [0,1,0,0,0,0|1,0,1]=3 96 B10R1.17 OC\C=C/C1=CC=NC=C1 5667AJ [0,1,0,0,0,0|1,0,2]=4 97 B10R1.18 C=C(C)CC1=NC=CC=C1 3662AF [0,1,0,0,0,0|2,0,0]=3 98 B10R1.18 CC(=O)CC1=CN=CC=C1 4586AH [0,1,0,0,0,0|1,0,0]=2 99 B10R1.18 CC(O)CC1=CC=CC=N1 5034AE [0,1,0,0,0,0|1,0,2]=4 100 B10R1.18 N=C(N)CC1=CN=CC=C1 4101AE [0,1,0,0,0,0|2,0,0]=3 101 B10R1.18 N=C(N)NC1=CC=NC=C1 4425AJ [0,1,0,0,0,0|3,0,0]=4 102 B10R1.18 O=C([O-])CC1=NC=CC=C1 0459AC [0,1,0,0,0,0|1,0,0]=2 103 B10R2.6 C1=CC(C2CC2)=CN=C1 Y1556 [0,0,0,1,0,0|2,0,1]=4 104 B10R2.7 C1=CC2=C(C=N1)CCC2 7574AB [0,0,0,1,0,0|2,0,1]=4 105 B10R2.7 C1=CC2=C(C=N1)CCN2 1362AJ [0,0,0,1,0,0|2,0,1]=4 106 B10R2.7 C1=CC2=C(C=N1)OC=C2 Y5330 [0,0,0,1,0,0|1,0,2]=4 107 B10R2.7 C1=CC2=C(N=C1)SC=N2 2596AB [0,0,0,1,0,0|2,1,0]=4 108 B10R2.7 C1=CC=C2SCOC2=C1 2605AB [0,0,0,1,0,0|1,0,2]=4 109 B8R1.8 BrCCC1=CC=CO1 1031AJ [0,0,0,0,1,0|2,0,1]=4 110 B8R1.8 O=CCN1C=CC=N1 6960AC [0,0,0,0,1,0|2,0,0]=3 111 B7R1.3 [O-]C1=CC=CN=C1 P818 [2,0,0,0,0,0|1,0,1]=4 112 B9R1.1 CCC1=CN=C(Cl)C=C1 1065AA [1,1,0,0,0,0|1,0,1]=4 113 B9R1.1 CCC1=NC=C(C)C=C1 9500AA [1,1,0,0,0,0|1,0,1]=4 114 B9R1.1 ClC1=CN=C(CBr)C=C1 9045AB [1,1,0,0,0,0|2,0,0]=4 115 B9R1.1 FC1=NC=C(CBr)C=C1 Y6935 [1,1,0,0,0,0|2,0,0]=4 116 B9R1.1 NC1=CC=C(C=O)C=C1 L628 [1,1,0,0,0,0|0,0,0]=2 117 B9R1.1 NCC1=CC=C(Br)N=C1 4185AA [1,1,0,0,0,0|2,0,0]=4 118 B9R1.1 NCC1=CN=C(Cl)C=C1 8881AH [1,1,0,0,0,0|2,0,0]=4 119 B9R1.1 NCC1=CN=C(N)C=C1 4936AD [1,1,0,0,0,0|2,0,0]=4 120 B9R1.1 O=CC1=CC=[N+]([O-])C=C1 0867AQ [1,1,0,0,0,0|1,0,0]=3 121 B9R1.1 O=CC1=NC=C(Br)C=N1 6187AC [1,1,0,0,0,0|2,0,0]=4 122 B9R1.1 O=CC1=NC=C(F)C=N1 3220AJ [1,1,0,0,0,0|2,0,0]=4 123 B9R1.2 C=CC1=CC=CC(Cl)=N1 6792AA [1,1,0,0,0,0|1,0,1]=4 124 B9R1.2 C=CC1=NC(Br)=CC=C1 5762AC [1,1,0,0,0,0|1,0,1]=4 125 B9R1.2 C=CC1=NC(F)=CC=C1 3676AC [1,1,0,0,0,0|1,0,1]=4 126 B9R1.2 C=CC1=NC=CC(Br)=C1 6873AB [1,1,0,0,0,0|1,0,1]=4 127 B9R1.2 CCC1=CC(Cl)=CC=C1 9311AB [1,1,0,0,0,0|0,0,1]=3 128 B9R1.2 CCC1=CC=NC(Cl)=C1 5411AB [1,1,0,0,0,0|1,0,1]=4 129 B9R1.2 ClCC1=CC(I)=CC=C1 8955AB [1,1,0,0,0,0|1,0,0]=3 130 B9R1.2 NC1=NC=CC(C=O)=C1 4853AC [1,1,0,0,0,0|1,0,0]=3 131 B9R1.2 NC1=NC=CC(CCl)=C1 3800AC [1,1,0,0,0,0|2,0,0]=4 132 B9R1.2 NCC1=CC(O)=CN=C1 Y1979 [1,1,0,0,0,0|2,0,0]=4 133 B9R1.2 NCC1=NC=CC(F)=C1 Y4340 [1,1,0,0,0,0|2,0,0]=4 134 B9R1.2 O=CC1=CC(Cl)=NC=N1 X4366 [1,1,0,0,0,0|2,0,0]=4 135 B9R1.2 O=CC1=CC=NC(Cl)=N1 1678AJ [1,1,0,0,0,0|2,0,0]=4 136 B9R1.2 O=CC1=NC=CC(Cl)=N1 6188AC [1,1,0,0,0,0|2,0,0]=4 137 B9R1.2 O=CC1=NC=CC(F)=C1 1362AA [1,1,0,0,0,0|1,0,0]=3 138 B9R1.2 OCC1=NC(O)=CC=C1 1325AE [1,1,0,0,0,0|1,0,1]=4 139 B9R1.6 C=C(F)C1=CC=CC=C1 1021AL [1,1,0,0,0,0|0,0,1]=3 140 B9R1.6 CC(=N)C1=CC=CN=C1 Y6078 [1,1,0,0,0,0|2,0,0]=4 141 B9R1.6 CC(Cl)C1=NC=CC=C1 Z2355 [1,1,0,0,0,0|1,0,1]=4 142 B9R1.6 CC(O)C1=CC=NC=C1 W4712 [1,1,0,0,0,0|1,0,1]=4 143 B9R1.15 C=CC1=CC=CNC1=O 5186AB [1,1,0,0,0,0|1,0,1]=4 144 B9R1.15 C=CC1=NC=CC=C1Br 2479AC [1,1,0,0,0,0|1,0,1]=4 145 B9R1.15 CC1=CN=CC=C1CO 4896AB [1,1,0,0,0,0|1,0,1]=4 146 B9R1.15 CC1=NC=CC=C1CBr X4783 [1,1,0,0,0,0|2,0,0]=4 147 B9R1.15 CC1=NC=CC=C1CO X2884 [1,1,0,0,0,0|1,0,1]=4 148 B9R1.15 NCC1=C(F)N=CC=C1 3392AC [1,1,0,0,0,0|2,0,0]=4 149 B9R1.15 NCC1=C(N)C=CC=N1 5249AJ [1,1,0,0,0,0|2,0,0]=4 150 B9R1.15 NCC1=C(N)C=NC=C1 7105AA [1,1,0,0,0,0|2,0,0]=4 151 B9R1.15 NCC1=CC=CN=C1N 4362AD [1,1,0,0,0,0|2,0,0]=4 152 B9R1.15 NCC1=CC=CNC1=O Y1980 [1,1,0,0,0,0|2,0,0]=4 153 B9R1.15 O=CC1=C(F)C=CN=C1 Y1524 [1,1,0,0,0,0|1,0,0]=3 154 B9R1.15 O=CC1=NC=NC=C1Br 5827AC [1,1,0,0,0,0|2,0,0]=4 155 B9R1.15 OCC1=C(O)C=NC=C1 X7917 [1,1,0,0,0,0|1,0,1]=4 156 B9R1.13 NC(=O)CC1=CSC=N1 4708AE [0,1,0,0,1,0|2,0,0]=4 157 B9R1.13 O=C(O)CC1=CN=CS1 7407AB [0,1,0,0,1,0|2,0,0]=4 158 B9R1.13 O=C(O)CC1=COC=C1 4503AA [0,1,0,0,1,0|1,0,0]=3 159 B11R1.1 C=CCCC1=CC=C(Br)C=C1 4835AD [0,2,0,0,0,0|1,0,0]=3 160 B11R1.1 C=CCCC1=CC=C(Cl)C=C1 9629AD [0,2,0,0,0,0|1,0,0]=3 161 B11R1.1 CC1=CC=C(OCC#N)C=C1 6210AJ [0,2,0,0,0,0|1,0,1]=4 162 B11R1.1 CCOCC1=CC=C(O)C=C1 Z4904 [0,2,0,0,0,0|1,0,1]=4 163 B11R1.1 CNCCC1=CC=C(C)C=C1 1463AB [0,2,0,0,0,0|1,0,1]=4 164 B11R1.1 COCOC1=CC=C(C)C=C1 2069AB [0,2,0,0,0,0|2,0,0]=4 165 B11R1.1 N#CNCC1=CC=C(Cl)C=C1 0136AE [0,2,0,0,0,0|1,0,1]=4 166 B11R1.1 NC1=CC=C(CCCO)C=C1 2833AC [0,2,0,0,0,0|0,0,2]=4 167 B11R1.1 O=CCCC1=CC=C(Cl)C=C1 1755AC [0,2,0,0,0,0|0,0,0]=2 168 B11R1.20 C=C(Br)CC1=CC=C(Cl)C=C1 3636AF [0,2,0,0,0,0|1,0,0]=3 169 B11R1.20 CC(N)CC1=CC=C(O)C=C1 2498AL [0,2,0,0,0,0|1,0,1]=4 170 B11R1.22 CC(CN)C1=CC=C(Cl)C=C1 1725AC [0,2,0,0,0,0|1,0,1]=4 171 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 1423AL [0,2,0,0,0,0|1,0,1]=4 172 B11R1.22 CN(C=O)C1=CC=C(Cl)C=C1 6455AL [0,2,0,0,0,0|1,0,0]=3 173 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 X3150 [0,2,0,0,0,0|0,0,2]=4 174 B11R1.81 C=CCC1=CC=C(Br)N=C1Cl 9176AC [0,2,0,0,0,0|2,0,0]=4 175 B11R1.81 O=CCC1=CC=C(Br)C=C1F 3153AF [0,2,0,0,0,0|0,0,0]=2 176 B11R1.83 N#CCC1=CC=C(CCl)C=C1 A717 [0,2,0,0,0,0|1,0,1]=4 177 B11R1.83 O=CC1=CC=C(CCO)C=C1 8288AA [0,2,0,0,0,0|0,0,2]=4 178 B11R1.192 CC1=CC=C(CCN)C=C1C 8902AA [0,2,0,0,0,0|1,0,1]=4 179 B11R1.192 N#CCC1=CC(Br)=C(N)C=C1 1571AF [0,2,0,0,0,0|1,0,1]=4 180 B11R1.192 N#CCC1=CC=C(I)C(F)=C1 5668AC [0,2,0,0,0,0|1,0,1]=4 181 B11R1.13 CC1=C(N=C=O)C=CC=C1F 6495AE [0,2,0,0,0,0|1,0,1]=4 182 B11R1.13 NOCC1=C(Cl)C(Cl)=CC=C1 0054AE [0,2,0,0,0,0|2,0,0]=4 183 B11R1.13 O=CCC1=C(Cl)C(Cl)=CC=C1 2420AA [0,2,0,0,0,0|0,0,0]=2 184 B11R1.13 O=CCC1=CC=CC(F)=C1F 3598AC [0,2,0,0,0,0|0,0,0]=2 185 B11R1.17 C=CCCC1=C(Br)C=CC=C1 8652AE [0,2,0,0,0,0|1,0,0]=3 186 B11R1.17 C=CCCC1=C(Cl)C=CC=C1 9630AD [0,2,0,0,0,0|1,0,0]=3 187 B11R1.17 C=CCCC1=CC=CC=C1F 8653AE [0,2,0,0,0,0|1,0,0]=3 188 B11R1.17 CC1=CC=CC=C1CCC=O 6596AD [0,2,0,0,0,0|0,0,0]=2 189 B11R1.17 CCNCC1=C(O)C=CC=C1 5372AJ [0,2,0,0,0,0|1,0,1]=4 190 B11R1.17 CNCCC1=C(Cl)C=CC=C1 4940AE [0,2,0,0,0,0|1,0,1]=4 191 B11R1.17 CNCCC1=CC=CC=C1C 9270AE [0,2,0,0,0,0|1,0,1]=4 192 B11R1.17 COCOC1=CC=CC=C1Cl Z0465 [0,2,0,0,0,0|2,0,0]=4 193 B11R1.17 N#CCCC1=CC=CC=C1Cl 1363AC [0,2,0,0,0,0|1,0,1]=4 194 B11R1.17 NCCCC1=C(Br)C=CC=C1 5612AJ [0,2,0,0,0,0|1,0,1]=4 195 B11R1.17 NCCCC1=CC=CC=C1Cl 6271AD [0,2,0,0,0,0|1,0,1]=4 196 B11R1.17 O=CCCC1=CC=CC=C1Cl 7894AA [0,2,0,0,0,0|0,0,0]=2 197 B11R1.41 C=CCC1=CC=CC=C1OC 0626AQ [0,2,0,0,0,0|1,0,0]=3 198 B11R1.41 N#CC1=CC=CC=C1CCO 5830AB [0,2,0,0,0,0|0,0,2]=4 199 B11R1.86 CC(=O)CC1=CC=CC=C1O 5670AA [0,2,0,0,0,0|0,0,0]=2 200 B11R1.86 CC(=O)NC1=C(O)C=NC=C1 8398AE [0,2,0,0,0,0|2,0,0]=4 201 B11R1.86 CC(C)CC1=CC=CC=C1O 5740AB [0,2,0,0,0,0|1,0,1]=4 202 B11R1.86 NC1=C(CC(=O)O)C=CN=C1 3994AC [0,2,0,0,0,0|1,0,0]=3 203 B11R1.86 NC1=C(CC(=O)O)C=NC=C1 4341AA [0,2,0,0,0,0|1,0,0]=3 204 B11R1.86 NC1=CC=CN=C1CC(=O)O 2520AC [0,2,0,0,0,0|1,0,0]=3 205 B11R1.182 C=CCC1=CC(C)=CN=C1Cl 0874AD [0,2,0,0,0,0|2,0,0]=4 206 B11R1.222 CC[C@@H](N)C1=CC=CC=C1Cl 3808AA [0,2,0,0,0,0|1,0,1]=4 207 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 1575AB [0,2,0,0,0,0|1,0,1]=4 208 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 5504AB [0,2,0,0,0,0|1,0,1]=4 209 B11R1.222 NCC(O)C1=CC=CC=C1I 0299AA [0,2,0,0,0,0|1,0,1]=4 210 B11R1.605 NC1=C(CCO)C(F)=CC=C1 6001AA [0,2,0,0,0,0|0,0,2]=4 211 B11R1.23 CC[C@@H](N)C1=CC=CC(Cl)=C1 X9178 [0,2,0,0,0,0|1,0,1]=4 212 B11R1.23 OCC(Cl)C1=CC=CC(Cl)=C1 2029AL [0,2,0,0,0,0|0,0,2]=4 213 B11R1.24 CC1=CC(CCC=O)=CC=C1 4286AF [0,2,0,0,0,0|0,0,0]=2 214 B11R1.24 CNCCC1=CC(Br)=CC=C1 9730AE [0,2,0,0,0,0|1,0,1]=4 215 B11R1.24 N#CCCC1=CC(F)=CC=C1 2070AB [0,2,0,0,0,0|1,0,1]=4 216 B11R1.24 N#CCCC1=CC=CC(Cl)=C1 1006AB [0,2,0,0,0,0|1,0,1]=4 217 B11R1.24 NC1=CC=CC(C\C=N\O)=N1 3559AF [0,2,0,0,0,0|1,0,1]=4 218 B11R1.24 O=CNCC1=CC=CC(F)=C1 W3915 [0,2,0,0,0,0|0,0,0]=2 219 B11R1.157 CC(=O)CC1=CC=CC(C)=C1 9812AA [0,2,0,0,0,0|0,0,0]=2 220 B11R1.157 CC(=O)NC1=CC=CC(N)=C1 C941 [0,2,0,0,0,0|1,0,0]=3 221 B11R1.157 CC(=O)NC1=NC=CC(I)=C1 3311AC [0,2,0,0,0,0|2,0,0]=4 222 B11R1.157 CN(C)CC1=CC(S)=CC=C1 3501AD [0,2,0,0,0,0|2,0,0]=4 223 B11R1.157 NC1=CC=CC(CC(=O)O)=N1 1884AJ [0,2,0,0,0,0|1,0,0]=3 224 B11R1.157 O=C(O)CC1=CC(S)=CC=C1 9631AB [0,2,0,0,0,0|0,0,0]=2 225 B11R1.189 COC1=CC(CC=O)=CC=C1 9995AB [0,2,0,0,0,0|0,0,0]=2 226 B11R1.189 COCC1=CC(CN)=CC=C1 7382AA [0,2,0,0,0,0|2,0,0]=4 227 B11R1.189 N#CC1=CC=CC(CC=O)=C1 1836AA [0,2,0,0,0,0|0,0,0]=2 228 B11R1.7 CC(N)(CO)C1=CC=CC=C1 Y6483 [0,2,0,0,0,0|0,0,2]=4 229 B11R1.7 CCC(F)(F)C1=CC=CC=C1 9060AE [0,2,0,0,0,0|1,0,1]=4 230 B11R1.12 C=CC(OC)C1=CC=CC=C1 1389AB [0,2,0,0,0,0|1,0,0]=3 231 B11R1.12 CCC(CC)C1=CC=CC=C1 3981AL [0,2,0,0,0,0|1,0,1]=4 232 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 3045AC [0,2,0,0,0,0|0,0,2]=4 233 B11R1.16 C=CCC(O)C1=CC=CC=C1 4955AL [0,2,0,0,0,0|1,0,0]=3 234 B11R1.16 C=CC[C@@H](N)C1=CC=CC=C1 1033AL [0,2,0,0,0,0|1,0,0]=3 235 B11R1.16 C=CC[C@@H](N)C1=NC=CC=C1 1031AL [0,2,0,0,0,0|2,0,0]=4 236 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 2792AC [0,2,0,0,0,0|0,0,2]=4 237 B11R1.16 O=C(CCBr)C1=CC=CC=C1 Y1959 [0,2,0,0,0,0|1,0,1]=4 238 B11R1.16 O=C(\C=C\Cl)C1=CC=CC=C1 0138AQ [0,2,0,0,0,0|1,0,1]=4 239 B11R1.36 CC(=O)N(C)C1=NC=CC=C1 1819AL [0,2,0,0,0,0|2,0,0]=4 240 B11R1.36 CC(=O)N(Cl)C1=CC=CC=C1 8525AL [0,2,0,0,0,0|1,0,0]=3 241 B11R1.36 CC(C)C(C)C1=CC=CC=C1 3972AL [0,2,0,0,0,0|1,0,1]=4 242 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 W7886 [0,2,0,0,0,0|1,0,1]=4 243 B11R1.36 CC(C1=CC=CC=C1)C(F)F 8474AB [0,2,0,0,0,0|1,0,1]=4 244 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 Z5914 [0,2,0,0,0,0|1,0,0]=3 245 B11R1.36 NC(C(=O)O)C1=NC=CN=C1 7986AC [0,2,0,0,0,0|2,0,0]=4 246 B11R1.36 O=C(Cl)C(Cl)C1=CC=CC=C1 8039AF [0,2,0,0,0,0|0,0,0]=2 247 B11R1.28 CC#CCNC1=CC=CC=C1 0461AD [0,2,0,0,0,0|1,0,1]=4 248 B11R1.40 COC(=O)CC1=CC=CN=C1 7040AJ [0,2,0,0,0,0|1,0,0]=3 249 B11R1.40 COC(=O)CC1=CC=CN=N1 Y1677 [0,2,0,0,0,0|2,0,0]=4 250 B11R1.40 COC(=O)CC1=NC=NC=C1 Y1676 [0,2,0,0,0,0|2,0,0]=4 251 B11R1.40 O=C(CF)CC1=CC=CC=C1 7647AA [0,2,0,0,0,0|0,0,0]=2 252 B11R1.40 O=C(CO)CC1=CC=CC=C1 6761AB [0,2,0,0,0,0|0,0,0]=2 253 B11R1.91 CC(=N)SCC1=CC=CC=C1 3158AL [0,2,0,0,0,0|1,0,0]=3 254 B11R1.91 CC(=O)SCC1=CC=CN=C1 Z2639 [0,2,0,0,0,0|1,0,0]=3 255 B11R1.91 CC(=O)SCC1=NC=CC=C1 Z3404 [0,2,0,0,0,0|1,0,0]=3 256 B11R1.91 CC(=O)\N=N\C1=CC=CC=C1 3867AD [0,2,0,0,0,0|1,0,0]=3 257 B11R1.91 N=C(N)NCC1=CC=NC=C1 6320AB [0,2,0,0,0,0|2,0,0]=4 258 B11R1.91 NC(=O)CCC1=CC=CN=C1 5646AJ [0,2,0,0,0,0|1,0,0]=3 259 B11R1.91 NC(=O)CCC1=CC=NC=C1 5669AJ [0,2,0,0,0,0|1,0,0]=3 260 B11R1.91 O=C(O)C#CC1=CC=NC=C1 5670AJ [0,2,0,0,0,0|1,0,1]=4 261 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 4465AB [0,2,0,0,0,0|2,0,0]=4 262 B11R1.509 O=S(=O)(Cl)CC1=NC=CC=C1 7757AB [0,2,0,0,0,0|2,0,0]=4 263 B9R1.89 N#CC1C=CC=CC=C1 6441AA [0,0,1,1,0,0|1,0,1]=4 264 B11R2.34 ClC1=CC=C(C2CO2)C=C1 0625AQ [0,1,0,1,0,0|0,0,2]=4 265 B11R2.36 ClC1=CC=C2CCOC2=C1 3499AJ [0,1,0,1,0,0|0,0,2]=4 266 B11R2.36 IC1=CC=C2CNCC2=C1 5068AC [0,1,0,1,0,0|2,0,0]=4 267 B11R2.36 NC1=CC2=C(C=C1)CCC2 2198AC [0,1,0,1,0,0|1,0,1]=4 268 B11R2.36 NC1=CC2=C(C=C1)NCC2 5784AH [0,1,0,1,0,0|1,0,1]=4 269 B11R2.10 FC1=NC2=CC=CC=C2S1 Y7071 [0,1,0,1,0,0|1,1,0]=4 270 B11R2.10 IC1=CC2=C(C=CC=C2)S1 7957AJ [0,1,0,1,0,0|0,1,1]=4 271 B11R2.10 IC1=NC2=C(C=CC=C2)N1 1741AJ [0,1,0,1,0,0|2,0,0]=4 272 B11R2.10 NC1=CC2=C(C=CC=C2)N1 X2016 [0,1,0,1,0,0|1,0,1]=4 273 B11R2.10 O=C1C=C2C=CC=CN2N1 8937AB [0,1,0,1,0,0|1,0,1]=4 274 B11R2.10 O=C1CC2=C(C=NC=C2)N1 W6869 [0,1,0,1,0,0|1,0,0]=3 275 B11R2.10 O=C1NC2=C(N=CC=C2)O1 3093AA [0,1,0,1,0,0|2,0,0]=4 276 B11R2.10 O=C1NC2=C(N=CC=C2)S1 4991AC [0,1,0,1,0,0|2,0,0]=4 277 B11R2.20 C1=CC2=C(C=C1)CNCC2 1479AL [0,1,0,1,0,0|1,0,1]=4 278 B11R2.106 CC1=CC=CC2=C1C=CS2 7012AA [0,1,0,1,0,0|0,1,1]=4 279 B11R2.106 ClC1=C2OC=NC2=CC=C1 4590AA [0,1,0,1,0,0|1,0,1]=4 280 B11R2.106 ClC1=CC=CC2=C1SC=C2 5048AC [0,1,0,1,0,0|0,1,1]=4 281 B11R2.106 FC1=C2C=COC2=CC=C1 Y8415 [0,1,0,1,0,0|0,0,2]=4 282 B11R2.106 IC1=C2N=CNC2=CC=C1 7128AB [0,1,0,1,0,0|2,0,0]=4 283 B11R2.106 NC1=C2NCCC2=CC=C1 1351AJ [0,1,0,1,0,0|1,0,1]=4 284 B11R2.988 N#CC1CC2=C1C=CC=C2 8027AE [0,1,0,1,0,0|1,0,1]=4 285 B11R2.988 O=CC1CC2=CC=CC=C21 9778AE [0,1,0,1,0,0|0,0,0]=2 286 B11R2.468 O=C1CC2=CC=CC(F)=C12 Y5936 [0,1,0,1,0,0|0,0,0]=2 287 B11R2.1 ClC1CCC2=C1C=CC=C2 X6210 [0,1,0,1,0,0|1,0,1]=4 288 B11R2.1 NC1=C2C=CC=CC2=NO1 0380AB [0,1,0,1,0,0|2,0,0]=4 289 B11R2.1 O=C1CCC2=C1C=NC=C2 3226AJ [0,1,0,1,0,0|1,0,0]=3 290 B11R2.1 O=C1CCC2=CN=CC=C12 6876AA [0,1,0,1,0,0|1,0,0]=3 291 B11R2.1 O=C1N=NC2=CC=CC=C12 8326AB [0,1,0,1,0,0|1,0,0]=3 292 B11R2.1 O=C1NNC2=C1C=NC=C2 3671AB [0,1,0,1,0,0|2,0,0]=4 293 B11R2.1 O=C1NNC2=CC=CN=C12 7206AB [0,1,0,1,0,0|2,0,0]=4 294 B11R2.1 O=C1OCC2=C1C=CN=C2 6459AB [0,1,0,1,0,0|1,0,0]=3 295 B11R2.1 OC1OCC2=C1C=CC=C2 8920AB [0,1,0,1,0,0|0,0,2]=4 296 B11R2.239 C1=CC=C(C2CNC2)C=C1 2383AJ [0,1,0,1,0,0|1,0,1]=4 297 B11R2.239 C1=CC=C(C2CNC2)C=C1 6027AB [0,1,0,1,0,0|1,0,1]=4 298 B11R2.239 C1=CC=C(C2COC2)C=C1 0754AA [0,1,0,1,0,0|0,0,2]=4 299 B7R1.1 BrCC1=COC=C1 Z5546 [1,0,0,0,1,0|2,0,0]=4 300 B7R1.1 O=CN1C=CN=C1 4713AH [1,0,0,0,1,0|2,0,0]=4