0 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 5351AA [0,0,0,0,0,0|2,0,0]=2 1 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 7156AL [0,0,0,0,0,0|2,0,0]=2 2 B11R1.509 C[Si](C)(C)OC1=CC=CC=C1 9306AL [0,0,0,0,0,0|2,1,0]=3 3 B11R1.509 C[Si](C)(Cl)CC1=CC=CC=C1 7150AL [0,0,0,0,0,0|1,1,0]=2 4 B11R1.509 O=P(O)(O)OC1=CC=CC=C1 8803AL [0,0,0,0,0,0|4,0,0]=4 5 B10R1.18 CC(=O)CC1=CN=CC=C1 9974AH [1,0,0,0,0,0|1,0,2]=4 6 B10R1.18 CC(=S)NC1=CC=CC=C1 8077AF [1,0,0,0,0,0|1,1,1]=4 7 B10R1.18 CC(C)=CC1=CC=CC=C1 1982AC [1,0,0,0,0,0|0,0,2]=3 8 B10R1.18 CC(C)CC1=CC=CC=N1 9571AB [1,0,0,0,0,0|1,0,0]=2 9 B10R1.18 CC(C)CC1=CC=NC=C1 6191AJ [1,0,0,0,0,0|1,0,0]=2 10 B10R1.18 CC(C)CC1=NC=CN=C1 R582 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.18 CC(N)CC1=CC=CC=N1 4560AE [1,0,0,0,0,0|2,0,0]=3 12 B10R1.18 CC(N)CC1=CN=CC=N1 4220AC [1,0,0,0,0,0|3,0,0]=4 13 B10R1.18 CC(O)CC1=CC=CC=N1 5034AE [1,0,0,0,0,0|1,0,0]=2 14 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 7881AA [1,0,0,0,0,0|0,0,0]=1 15 B10R1.18 C[C@H](O)CC1=CC=CC=C1 7611AA [1,0,0,0,0,0|0,0,0]=1 16 B10R1.18 N=C(N)CC1=CC=CC=C1 1942AB [1,0,0,0,0,0|2,0,1]=4 17 B10R1.18 NC(=S)CC1=CC=CC=C1 7353AE [1,0,0,0,0,0|1,1,1]=4 18 B10R1.18 O=C(O)CC1=NC=CC=C1 Y7391 [1,0,0,0,0,0|2,0,1]=4 19 B12R1.106 CC(C)(C)NC1=CC=C(Br)C=N1 2220AD [0,1,0,0,0,0|3,0,0]=4 20 B12R1.106 CC(C)(C)SC1=CC=C(Br)C=C1 V4719 [0,1,0,0,0,0|2,0,0]=3 21 B12R1.106 CC(C)(N)CC1=CC=C(F)C=C1 3475AA [0,1,0,0,0,0|1,0,0]=2 22 B12R1.106 CC(C)(O)CC1=CC=C(Cl)C=C1 Q321 [0,1,0,0,0,0|0,0,0]=1 23 B12R1.106 CC1=CC=C(OC(C)(C)C)C=C1 1467AL [0,1,0,0,0,0|2,0,0]=3 24 B12R1.106 CS(=O)(=O)CC1=CC=C(N)C=C1 8158AD [0,1,0,0,0,0|2,0,1]=4 25 B12R1.106 NC1=CC=C(CP(=O)(O)O)C=C1 0102AQ [0,1,0,0,0,0|3,0,0]=4 26 B12R1.106 O=P(O)(O)CC1=CC=C(Br)C=C1 1129AQ [0,1,0,0,0,0|3,0,0]=4 27 B12R1.106 O=P(O)(O)CC1=CC=C(O)C=C1 1141AQ [0,1,0,0,0,0|3,0,0]=4 28 B12R1.119 CC(C)(C)NC1=NC=CC(Br)=C1 X9636 [0,1,0,0,0,0|3,0,0]=4 29 B12R1.119 CC(C)(C)SC1=CC(Br)=CC=C1 V2517 [0,1,0,0,0,0|2,0,0]=3 30 B12R1.119 O=P(O)(O)CC1=CC(Br)=CC=C1 1093AQ [0,1,0,0,0,0|3,0,0]=4 31 B12R1.151 CC(C)(C)SC1=CN=CC=C1N 9692AE [0,1,0,0,0,0|3,0,0]=4 32 B12R1.194 CC(C)(C#N)NC1=CC=CC=C1 7424AD [0,1,0,0,0,0|2,0,0]=3 33 B12R1.194 CC(C)(C=O)SC1=CC=CC=C1 7249AE [0,1,0,0,0,0|1,0,1]=3 34 B12R1.564 FC(F)(F)C(Br)C1=CC=CC=C1 3336AE [0,1,0,0,0,0|3,0,0]=4 35 B12R1.564 N[C@@H](C1=CC=CC=C1)C(F)(F)F 9123AH [0,1,0,0,0,0|3,0,0]=4 36 B12R1.564 N[C@H](C1=CC=CC=C1)C(F)(F)F W4548 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.564 O[C@H](C1=CC=CC=C1)C(F)(F)F 4126AL [0,1,0,0,0,0|3,0,0]=4 38 B12R2.94 NC1(CC2=CC=CC=C2)CC1 8899AD [0,0,0,1,0,0|1,0,0]=2 39 B10R1.28 CC(C)(N)C1=CC=NC=C1 5311AJ [0,0,0,0,1,0|2,0,0]=3 40 B10R1.28 CC(F)(F)C1=CC=NC=C1 9493AC [0,0,0,0,1,0|3,0,0]=4 41 B10R1.28 CC(F)(F)C1=CN=CC=C1 9489AC [0,0,0,0,1,0|3,0,0]=4 42 B10R1.28 CC(F)(F)C1=NC=CC=C1 9488AC [0,0,0,0,1,0|3,0,0]=4 43 B10R1.28 C[Sn](C)(C)C1=CC=CC=N1 9304AL [0,0,0,0,1,0|3,0,0]=4 44 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 Z8042 [0,0,0,0,1,0|3,0,0]=4 45 B12R1.891 C[Si](C)(C)NCC1=CC=CC=C1 8511AL [0,0,0,0,0,1|1,1,0]=3 46 B12R1.891 C[Si](C)(C)\N=C\C1=CC=CC=C1 0548AQ [0,0,0,0,0,1|1,1,1]=4 47 B12R1.891 O=P(O)(O)CCC1=CC=CC=C1 4042AL [0,0,0,0,0,1|3,0,0]=4 48 B9R1.8 BrCCC1=CC=CC=N1 5125AB [2,0,0,0,0,0|2,0,0]=4 49 B9R1.8 CCC[N+]1=CC=CC=C1 4961AL [2,0,0,0,0,0|1,0,0]=3 50 B9R1.8 CCC[N+]1=CC=CC=C1 K559 [2,0,0,0,0,0|1,0,0]=3 51 B9R1.8 CNCC1=CC=CC=C1 3855AD [2,0,0,0,0,0|1,0,0]=3 52 B9R1.8 CNCC1=CC=CC=N1 7146AD [2,0,0,0,0,0|2,0,0]=4 53 B9R1.8 CNNC1=CC=CC=C1 V2456 [2,0,0,0,0,0|2,0,0]=4 54 B9R1.8 C\C=C\C1=CC=CC=C1 7209AE [2,0,0,0,0,0|0,0,2]=4 55 B9R1.8 ClCCC1=NC=CC=C1 X6257 [2,0,0,0,0,0|2,0,0]=4 56 B9R1.8 NCCC1=CC=CN=C1 5033AC [2,0,0,0,0,0|2,0,0]=4 57 B9R1.8 OCCC1=CN=CN=C1 W8980 [2,0,0,0,0,0|2,0,0]=4 58 B9R1.8 OCCC1=NC=CN=C1 Z5014 [2,0,0,0,0,0|2,0,0]=4 59 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 V3609 [1,1,0,0,0,0|1,0,0]=3 60 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Z0614 [1,1,0,0,0,0|1,0,0]=3 61 B11R1.20 CC(C)OC1=NC=C(Cl)C=C1 Z0473 [1,1,0,0,0,0|2,0,0]=4 62 B11R1.20 CC(C)OC1=NC=C(F)C=C1 Z9507 [1,1,0,0,0,0|2,0,0]=4 63 B11R1.20 CC(C)OC1=NC=C(I)C=C1 Z1054 [1,1,0,0,0,0|2,0,0]=4 64 B11R1.36 CC(C)C(N)C1=CC=CC=C1 1780AB [1,1,0,0,0,0|0,0,0]=2 65 B11R1.36 CC(C)C(N)C1=CC=CC=N1 9319AH [1,1,0,0,0,0|1,0,0]=3 66 B11R1.36 CC(C)C(N)C1=CC=NC=C1 1775AJ [1,1,0,0,0,0|1,0,0]=3 67 B11R1.36 CC(C)[C@H](O)C1=CC=CC=C1 N145 [1,1,0,0,0,0|0,0,0]=2 68 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 7920AA [1,1,0,0,0,0|1,0,1]=4 69 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 Y7506 [1,1,0,0,0,0|1,0,1]=4 70 B11R1.40 CC(C#N)NC1=CC=CC=C1 5308AJ [1,1,0,0,0,0|1,0,1]=4 71 B11R1.40 CC(CN)CC1=CC=CC=C1 2217AC [1,1,0,0,0,0|0,0,0]=2 72 B11R1.40 CC(CN)OC1=CC=CC=C1 Y9709 [1,1,0,0,0,0|1,0,0]=3 73 B11R1.40 CC(CN)OC1=CC=CN=C1 2002AF [1,1,0,0,0,0|2,0,0]=4 74 B11R1.40 CNC(C)CC1=NC=CN=C1 3718AF [1,1,0,0,0,0|2,0,0]=4 75 B11R1.40 C\C(=C/C1=CC=CC=C1)CO 5715AL [1,1,0,0,0,0|0,0,2]=4 76 B11R1.86 CC(=O)CC1=CC=CC=C1C 7072AB [1,1,0,0,0,0|0,0,2]=4 77 B11R1.86 CC(=O)CC1=CC=CC=C1O 5670AA [1,1,0,0,0,0|0,0,2]=4 78 B11R1.86 CC(C)CC1=C(N)C=CC=C1 5195AJ [1,1,0,0,0,0|0,0,0]=2 79 B11R1.86 CC1=CC=CN=C1CC(C)O 9155AE [1,1,0,0,0,0|1,0,0]=3 80 B11R1.86 CN(C)CC1=C(F)C=CC=C1 1557AB [1,1,0,0,0,0|1,0,0]=3 81 B11R1.86 CN(C)CC1=C(N)C=CC=C1 9911AA [1,1,0,0,0,0|1,0,0]=3 82 B11R1.86 CN(C)CC1=C(O)C=CC=C1 8448AD [1,1,0,0,0,0|1,0,0]=3 83 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 Z4417 [1,1,0,0,0,0|0,0,2]=4 84 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 6862AA [1,1,0,0,0,0|0,0,2]=4 85 B11R1.157 CC(C)NC1=NC(Br)=CC=C1 V8760 [1,1,0,0,0,0|2,0,0]=4 86 B11R1.157 CC(C)OC1=CC=CC(Br)=N1 V6058 [1,1,0,0,0,0|2,0,0]=4 87 B11R1.157 CC1=CC=CC(CC(C)N)=N1 1063AC [1,1,0,0,0,0|2,0,0]=4 88 B11R1.157 CC1=CC=CC(CC(C)O)=N1 7595AE [1,1,0,0,0,0|1,0,0]=3 89 B11R1.157 O=C(O)CC1=CC(S)=CC=C1 9631AB [1,1,0,0,0,0|1,0,1]=4 90 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 3361AA [0,1,0,0,1,0|1,0,0]=3 91 B11R1.7 CC(C)(C#N)C1=CC=NC=C1 9873AE [0,1,0,0,1,0|2,0,0]=4 92 B11R1.7 CC(C)(CN)C1=CC=CC=C1 0879AB [0,1,0,0,1,0|1,0,0]=3 93 B11R1.7 CC(N)(CO)C1=CC=CC=C1 Y6483 [0,1,0,0,1,0|1,0,0]=3 94 B11R1.7 CC(O)(CN)C1=CC=CC=C1 4663AH [0,1,0,0,1,0|0,0,0]=2 95 B11R1.7 CCC(F)(F)C1=CC=CC=C1 9060AE [0,1,0,0,1,0|2,0,0]=4 96 B11R1.7 FC(F)(CBr)C1=CC=CC=C1 Y7004 [0,1,0,0,1,0|2,0,0]=4 97 B11R1.19 CC(C)(C)C1=CC=C(Br)N=C1 1609AJ [0,1,0,0,1,0|2,0,0]=4 98 B11R1.19 CC(C)(C)C1=CC=C(F)C=C1 V7377 [0,1,0,0,1,0|1,0,0]=3 99 B11R1.19 CC(C)(C)C1=CC=[N+]([O-])C=C1 7969AD [0,1,0,0,1,0|2,0,0]=4 100 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 5952AD [0,1,0,0,1,0|1,0,0]=3 101 B11R1.19 CC(C)(O)C1=CC=C(F)C=C1 V5764 [0,1,0,0,1,0|0,0,0]=2 102 B11R1.19 CC(C)(O)C1=NC=C(Br)C=C1 W5164 [0,1,0,0,1,0|1,0,0]=3 103 B11R1.19 CC(C)(O)C1=NC=C(Cl)C=C1 5454AB [0,1,0,0,1,0|1,0,0]=3 104 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 0092AA [0,1,0,0,1,0|2,0,0]=4 105 B11R1.19 C[Si](C)(C)C1=CC=C(F)C=C1 1626AL [0,1,0,0,1,0|1,1,0]=4 106 B11R1.87 CC(C)(N)C1=C(Br)C=CC=C1 8926AA [0,1,0,0,1,0|1,0,0]=3 107 B11R1.87 CC(C)(O)C1=C(Cl)C=NC=C1 2090AC [0,1,0,0,1,0|1,0,0]=3 108 B11R1.87 CC(C)(O)C1=CC=CC=C1F V5135 [0,1,0,0,1,0|0,0,0]=2 109 B11R1.87 CC(F)(F)C1=CC=CC=C1Br 0997AQ [0,1,0,0,1,0|2,0,0]=4 110 B11R1.87 CC1=C(C(C)(C)C)C=CC=C1 1688AL [0,1,0,0,1,0|1,0,0]=3 111 B11R1.155 CC(C)(C)C1=CC(=O)C=CO1 1594AC [0,1,0,0,1,0|2,0,0]=4 112 B11R1.155 CC(C)(C)C1=NC=CC(Br)=C1 1718AA [0,1,0,0,1,0|2,0,0]=4 113 B11R1.155 CC(C)(C)C1=NC=CC(N)=C1 V5730 [0,1,0,0,1,0|2,0,0]=4 114 B11R1.155 CC(C)(O)C1=CC=CC(F)=C1 V5757 [0,1,0,0,1,0|0,0,0]=2 115 B11R1.155 CC1=CC=CC(C(C)(C)C)=C1 6162AL [0,1,0,0,1,0|1,0,0]=3 116 B13R1.254 CC(C)(CO)OCC1=CC=CC=C1 3234AF [0,1,0,0,0,1|0,0,0]=2 117 B13R1.353 CC(C)(N)C(=O)NC1=CC=CC=C1 1534AD [0,1,0,0,0,1|1,0,1]=4 118 B13R1.512 CC(C)(C)NCC1=CC=C(Br)C=C1 Z8266 [0,1,0,0,0,1|1,0,0]=3 119 B13R1.512 CC(C)(C)OCC1=CC=C(Br)C=C1 V4524 [0,1,0,0,0,1|1,0,0]=3 120 B13R1.512 CC(C)(O)C#CC1=CC=C(F)C=C1 2534AL [0,1,0,0,0,1|0,0,1]=3 121 B13R1.838 CC(C)(N)CNC1=CC(Cl)=CC=C1 0774AF [0,1,0,0,0,1|1,0,0]=3 122 B13R1.4 CC(C)(C)OC1=CC=C(CN)C=C1 3022AC [0,2,0,0,0,0|2,0,0]=4 123 B13R1.4 CC(C)(C)SC1=CC=C(C=O)C=C1 1747AF [0,2,0,0,0,0|2,0,0]=4 124 B13R1.249 CC(C)(C#N)NC1=CC=C(F)C=C1 1027AD [0,2,0,0,0,0|2,0,0]=4 125 B13R1.249 CC(C)(C=O)SC1=CC=C(Cl)C=C1 5707AE [0,2,0,0,0,0|1,0,1]=4 126 B13R1.525 CC(C)(C)C(=O)C1=CC=C(Cl)C=C1 3162AB [0,2,0,0,0,0|1,0,1]=4 127 B13R1.883 CC(C)(C)OC1=CC=C(Br)C=C1Br Z9281 [0,2,0,0,0,0|2,0,0]=4 128 B13R1.80 CC(C)(C)OC1=CC=CC(CO)=C1 5924AJ [0,2,0,0,0,0|2,0,0]=4 129 B13R1.894 CC(C)(C)NC1=C(N)C=CC(Br)=C1 Z7774 [0,2,0,0,0,0|2,0,0]=4 130 B13R1.3421 CC(C)(C)OC1=CC(Br)=CC(F)=C1 Z1027 [0,2,0,0,0,0|2,0,0]=4 131 B13R1.3492 CC(C)(C)C(=O)C1=CC(Br)=CC=C1 8154AD [0,2,0,0,0,0|1,0,1]=4 132 B13R1.3492 CC1=CC(C(=O)C(C)(C)C)=CC=C1 V6253 [0,2,0,0,0,0|1,0,1]=4 133 B13R1.276 CC1=CC=CC=C1[C@@H](N)C(C)(C)C 0292AQ [0,2,0,0,0,0|1,0,0]=3 134 B13R1.3080 COP(=O)(CC1=CC=CC=C1)OC I556 [0,2,0,0,0,0|1,0,1]=4 135 B11R2.4 NC1CC1C2=CC=CC=C2 2168AL [1,0,0,1,0,0|1,0,0]=3 136 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8297AH [1,0,0,1,0,0|1,0,0]=3 137 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8412AH [1,0,0,1,0,0|1,0,0]=3 138 B11R2.10 CC1=CC2=C(C=CC=C2)O1 X5959 [1,0,0,1,0,0|0,0,2]=4 139 B11R2.40 NC1(C2=CN=CC=C2)CC1 6906AB [0,0,0,1,1,0|2,0,0]=4 140 B11R2.40 NC1(C2=NC=CC=C2)CC1 6037AB [0,0,0,1,1,0|2,0,0]=4 141 B13R2.222 CC1(C)CC2=CC=CC=C2CN1 7696AA [0,0,0,1,0,1|1,0,0]=3 142 B13R2.222 CC1(C)NC2=CC=CC=C2CO1 7357AB [0,0,0,1,0,1|1,0,0]=3 143 B13R2.3051 CC1(C)OC2=CC=C(N)C=C2O1 V7610 [0,1,0,1,0,0|1,0,0]=3 144 B13R2.217 OC1(CC2=C(Cl)C=CC=C2)CC1 5029AJ [0,1,0,1,0,0|0,0,0]=2 145 B13R2.243 C[N+]1(C)CC2=C(C=CC=C2)[Pd]1Cl 7726AL [0,1,0,1,0,0|2,0,0]=4 146 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [1,0,0,0,1,0|1,0,0]=3 147 B9R1.6 CN(C)C1=CC=NC=C1 6487AL [1,0,0,0,1,0|2,0,0]=4 148 B9R1.6 CN(C)C1=NC=CC=C1 8318AB [1,0,0,0,1,0|2,0,0]=4 149 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [1,0,0,0,1,0|1,0,0]=3 150 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [1,0,0,0,1,0|2,0,0]=4 151 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [1,0,0,0,1,0|2,0,0]=4 152 B9R1.6 C[C@H](N)C1=CC=NC=C1 4830AJ [1,0,0,0,1,0|2,0,0]=4 153 B9R1.13 CC(C)CN1C=CC=N1 Z0808 [1,0,0,0,1,0|2,0,0]=4 154 B9R1.13 CC(N)CC1=CC=CO1 8493AB [1,0,0,0,1,0|2,0,0]=4 155 B9R1.13 CC(O)CC1=CC=CO1 6519AJ [1,0,0,0,1,0|1,0,0]=3 156 B9R1.13 CN(C)C=C1C=CC=C1 0768AC [1,0,0,0,1,0|1,0,1]=4 157 B9R1.13 CN(C)CC1=CC=CS1 2203AB [1,0,0,0,1,0|2,0,0]=4 158 B9R1.19 CC(C)(C)C1=CC=CO1 0781AQ [0,0,0,0,2,0|2,0,0]=4 159 B9R1.19 CC(C)(C)C1=CC=CS1 Z5471 [0,0,0,0,2,0|2,0,0]=4 160 B9R1.19 CC(C)(C)N1C=CC=C1 8329AD [0,0,0,0,2,0|2,0,0]=4 161 B9R1.19 CC(C)(O)C1=NC=CS1 V3604 [0,0,0,0,2,0|2,0,0]=4 162 B11R1.91 CC(=N)NCC1=CC=CC=C1 1916AH [1,0,0,0,0,1|1,0,1]=4 163 B11R1.91 CC(=N)SCC1=CC=CC=C1 3158AL [1,0,0,0,0,1|1,0,1]=4 164 B11R1.91 CC(C)NCC1=CN=CC=C1 7190AJ [1,0,0,0,0,1|1,0,0]=3 165 B11R1.91 CC(Cl)COC1=CC=CC=C1 4945AL [1,0,0,0,0,1|1,0,0]=3 166 B11R1.91 CC(N)COC1=CC=CC=C1 4356AB [1,0,0,0,0,1|1,0,0]=3 167 B13R1.3523 C[Si](C)(C)C\C=C\C1=CC=CC=C1 0174AB [0,0,0,0,0,2|1,1,0]=4 168 B13R1.3523 C[Si](C)(Cl)CCCC1=CC=CC=C1 7366AL [0,0,0,0,0,2|1,1,0]=4