0 B3R0.2 BrC(Br)Br 1100-9-03 [0,0,0,0,0,0|3,0,1]=4 1 B3R0.2 C=C(C)C 1300-1-06 [0,0,0,0,0,0|2,0,0]=2 2 B3R0.2 C=C(C)Cl 1300-5-21 [0,0,0,0,0,0|2,0,0]=2 3 B3R0.2 C=C(Cl)Cl 1300-5-11 [0,0,0,0,0,0|2,0,1]=3 4 B3R0.2 C=C(F)Cl 1300-7-03 [0,0,0,0,0,0|2,0,1]=3 5 B3R0.2 CB(O)O 6160-1-X6 [0,0,0,0,0,0|1,0,1]=2 6 B3R0.2 CC(=O)Cl 2116-5-01 [0,0,0,0,0,0|1,0,0]=1 7 B3R0.2 CC(=O)O 4141-1-X0 [0,0,0,0,0,0|0,0,0]=0 8 B3R0.2 CC(=O)[O-] 2122-1-02 [0,0,0,0,0,0|0,0,1]=1 9 B3R0.2 CC(=O)[O-] 2122-1-19 [0,0,0,0,0,0|0,0,1]=1 10 B3R0.2 CC(=O)[O-] 2122-1-29 [0,0,0,0,0,0|0,0,1]=1 11 B3R0.2 CC(=O)[O-] 2122-1-46 [0,0,0,0,0,0|0,0,1]=1 12 B3R0.2 CC(=O)[O-] 2122-1-46H [0,0,0,0,0,0|0,0,1]=1 13 B3R0.2 CC(=O)[O-] M029-1-01 [0,0,0,0,0,0|0,0,1]=1 14 B3R0.2 CC(=O)[O-] M056-1-X0 [0,0,0,0,0,0|0,0,1]=1 15 B3R0.2 CC(=O)[S-] 6161-1-05 [0,0,0,0,0,0|0,1,0]=1 16 B3R0.2 CC(C)Br 1100-9-02 [0,0,0,0,0,0|2,0,1]=3 17 B3R0.2 CC(C)C 1100-1-19 [0,0,0,0,0,0|2,0,1]=3 18 B3R0.2 CC(C)I 1100-H-03 [0,0,0,0,0,0|2,0,1]=3 19 B3R0.2 CC(C)N 3130-5-X1 [0,0,0,0,0,0|2,0,1]=3 20 B3R0.2 CC(Cl)Cl 1100-5-12 [0,0,0,0,0,0|2,0,1]=3 21 B3R0.2 CC(F)Br 1100-B-20 [0,0,0,0,0,0|2,0,1]=3 22 B3R0.2 CC(F)Cl 1100-7-04SM [0,0,0,0,0,0|2,0,1]=3 23 B3R0.2 CC(F)F 1100-3-05 [0,0,0,0,0,0|2,0,1]=3 24 B3R0.2 CC(N)=S 7167-1-X0 [0,0,0,0,0,0|1,1,0]=2 25 B3R0.2 CN(C)C 3132-1-05 [0,0,0,0,0,0|3,0,0]=3 26 B3R0.2 CN(C)C 8132-1-X0 [0,0,0,0,0,0|3,0,0]=3 27 B3R0.2 CS(=O)[O-] 6165-1-X0 [0,0,0,0,0,0|1,0,1]=2 28 B3R0.2 C[S+](C)C 5171-H-01 [0,0,0,0,0,0|3,0,0]=3 29 B3R0.2 Cl[Ce](Cl)Cl M058-5-01 [0,0,0,0,0,0|4,0,0]=4 30 B3R0.2 Cl[In](Cl)Cl M049-5-01 [0,0,0,0,0,0|4,0,0]=4 31 B3R0.2 FC(F)Br 1100-B-01 [0,0,0,0,0,0|3,0,1]=4 32 B3R0.2 FC(F)Cl 1100-7-03 [0,0,0,0,0,0|3,0,1]=4 33 B3R0.2 FC(F)I 1100-K-99 [0,0,0,0,0,0|3,0,1]=4 34 B3R0.2 F[Sb](F)F M051-2-02 [0,0,0,0,0,0|4,0,0]=4 35 B3R0.2 N=C(N)Cl 3141-5-X4 [0,0,0,0,0,0|3,0,0]=3 36 B3R0.2 N=C(N)N 3141-5-X1 [0,0,0,0,0,0|3,0,0]=3 37 B3R0.2 NC(N)=O 4153-1-01 [0,0,0,0,0,0|2,0,0]=2 38 B3R0.2 O=C([O-])[O-] M019-0-02 [0,0,0,0,0,0|1,0,1]=2 39 B3R0.2 O=C([O-])[O-] M021-1-04 [0,0,0,0,0,0|1,0,1]=2 40 B3R0.2 O=S([O-])O M011-1-06 [0,0,0,0,0,0|2,0,0]=2 41 B3R0.2 O=S([O-])O M011-1-06HP [0,0,0,0,0,0|2,0,0]=2 42 B3R0.2 O=S([O-])[O-] M019-0-01 [0,0,0,0,0,0|2,0,1]=3 43 B3R0.2 O=[N+]([O-])[O-] M020-1-X0 [0,0,0,0,0,0|2,0,1]=3 44 B3R0.2 O=[N+]([O-])[O-] M021-1-05 [0,0,0,0,0,0|2,0,1]=3 45 B3R0.2 O=[N+]([O-])[O-] M057-1-01 [0,0,0,0,0,0|2,0,1]=3 46 B2R0.1 C#CC 1500-1-01 [1,0,0,0,0,0|1,0,1]=3 47 B2R0.1 C=CBr 1300-9-01 [1,0,0,0,0,0|1,0,1]=3 48 B2R0.1 C=CBr 1300-9-01ST [1,0,0,0,0,0|1,0,1]=3 49 B2R0.1 C=CC 1300-1-02 [1,0,0,0,0,0|1,0,0]=2 50 B2R0.1 CCBr 1100-9-04 [1,0,0,0,0,0|1,0,1]=3 51 B2R0.1 CCI 1100-H-10 [1,0,0,0,0,0|1,0,1]=3 52 B2R0.1 CCN 3130-1-10 [1,0,0,0,0,0|1,0,1]=3 53 B2R0.1 CC[O-] 9122-1-X0 [1,0,0,0,0,0|0,0,2]=3 54 B2R0.1 CNC 3131-1-X3 [1,0,0,0,0,0|2,0,0]=3 55 B2R0.1 CNO 4156-5-10 [1,0,0,0,0,0|1,0,0]=2 56 B2R0.1 COC 2107-1-01 [1,0,0,0,0,0|2,0,0]=3 57 B2R0.1 CON 4147-5-X3 [1,0,0,0,0,0|2,0,0]=3 58 B2R0.1 ClCBr 1100-D-01 [1,0,0,0,0,0|2,0,1]=4 59 B2R0.1 ClCCl 1100-5-02 [1,0,0,0,0,0|2,0,1]=4 60 B2R0.1 ClCI 1100-L-02 [1,0,0,0,0,0|2,0,1]=4 61 B2R0.1 FCF 1100-3-02 [1,0,0,0,0,0|2,0,1]=4 62 B2R0.1 F[Ni]F M028-2-24 [1,0,0,0,0,0|3,0,0]=4 63 B2R0.1 F[Xe]F M054-2-01 [1,0,0,0,0,0|3,0,0]=4 64 B2R0.1 ICI 1100-H-02 [1,0,0,0,0,0|2,0,1]=4 65 B2R0.1 N#CN 3137-1-Y5 [1,0,0,0,0,0|2,0,1]=4 66 B2R0.1 N#C[S-] 7168-1-29 [1,0,0,0,0,0|1,1,1]=4 67 B2R0.1 N#C[S-] 8168-1-00 [1,0,0,0,0,0|1,1,1]=4 68 B2R0.1 N#C[S-] M019-0-30 [1,0,0,0,0,0|1,1,1]=4 69 B2R0.1 O=C[O-] 2122-1-07 [1,0,0,0,0,0|0,0,1]=2 70 B2R0.1 O=C[O-] 9130-1-00 [1,0,0,0,0,0|0,0,1]=2 71 B2R0.1 O=[Si]=O SI24001A [1,0,0,0,0,0|0,1,1]=3 72 B2R0.1 S=C=S 5166-0-01 [1,0,0,0,0,0|0,2,1]=4 73 B2R0.1 [BH3-]C#N M011-3-60 [1,0,0,0,0,0|2,0,1]=4 74 B4R0.1 C#CC(=O)O 2521-1-01 [0,1,0,0,0,0|0,0,1]=2 75 B4R0.1 C#CC(C)O 2502-1-01 [0,1,0,0,0,0|1,0,1]=3 76 B4R0.1 C#CC(N)=O 4148-1-01 [0,1,0,0,0,0|1,0,1]=3 77 B4R0.1 C#C[C@@H](C)O 2502-1-R1 [0,1,0,0,0,0|1,0,1]=3 78 B4R0.1 C=C(Br)CC 1300-9-24 [0,1,0,0,0,0|2,0,0]=3 79 B4R0.1 C=C(C)CBr 1300-9-00 [0,1,0,0,0,0|2,0,0]=3 80 B4R0.1 C=C(C)CC 1300-1-21 [0,1,0,0,0,0|2,0,0]=3 81 B4R0.1 C=C(C)CN 3330-1-X1 [0,1,0,0,0,0|2,0,0]=3 82 B4R0.1 C=C(C)CN 3330-5-X0 [0,1,0,0,0,0|2,0,0]=3 83 B4R0.1 C=C(C)OC 2307-1-01 [0,1,0,0,0,0|1,0,0]=2 84 B4R0.1 C=C(Cl)C#N 3337-5-X3 [0,1,0,0,0,0|2,0,1]=4 85 B4R0.1 C=C(Cl)CCl 1300-5-15 [0,1,0,0,0,0|2,0,0]=3 86 B4R0.1 C=C(Cl)CF 1300-7-23 [0,1,0,0,0,0|2,0,0]=3 87 B4R0.1 C=C(Cl)CO 2301-5-02 [0,1,0,0,0,0|1,0,1]=3 88 B4R0.1 C=C(Cl)CO 2301-5-02T [0,1,0,0,0,0|1,0,1]=3 89 B4R0.1 C=C(F)CBr 1300-B-49 [0,1,0,0,0,0|2,0,0]=3 90 B4R0.1 C=C(F)CCl 1300-7-14 [0,1,0,0,0,0|2,0,0]=3 91 B4R0.1 C=C(F)CN 3330-3-32 [0,1,0,0,0,0|2,0,0]=3 92 B4R0.1 C=C(F)CO 2301-3-03 [0,1,0,0,0,0|1,0,1]=3 93 B4R0.1 C=CC(=C)C 1300-1-49 [0,1,0,0,0,0|2,0,0]=3 94 B4R0.1 C=CC(C)C 1300-1-26 [0,1,0,0,0,0|2,0,1]=4 95 B4R0.1 C=CC(C)Cl 1300-5-41 [0,1,0,0,0,0|2,0,1]=4 96 B4R0.1 CC(=O)C=O 2117-1-X0 [0,1,0,0,0,0|0,0,1]=2 97 B4R0.1 CC(=O)C=O 2117-1-X0A [0,1,0,0,0,0|0,0,1]=2 98 B4R0.1 CC(=O)CF 2117-3-10 [0,1,0,0,0,0|1,0,0]=2 99 B4R0.1 CC(=O)CO 2120-1-01 [0,1,0,0,0,0|0,0,0]=1 100 B4R0.1 CC(=O)NN 4156-1-2V [0,1,0,0,0,0|1,0,0]=2 101 B4R0.1 CC(C)C#N 3137-1-Y4 [0,1,0,0,0,0|2,0,1]=4 102 B4R0.1 CC(C)C=O 2115-1-13 [0,1,0,0,0,0|1,0,1]=3 103 B4R0.1 CC(C)NN 3139-5-X2 [0,1,0,0,0,0|2,0,1]=4 104 B4R0.1 CC(C)[Mg]Cl 9112-5-04 [0,1,0,0,0,0|2,0,1]=4 105 B4R0.1 CC(F)CO 2101-3-64 [0,1,0,0,0,0|1,0,1]=3 106 B4R0.1 CC(N)CO 4156-1-92 [0,1,0,0,0,0|1,0,1]=3 107 B4R0.1 CC(O)CF 2102-3-12 [0,1,0,0,0,0|1,0,1]=3 108 B4R0.1 CC(O)CO 2104-1-12 [0,1,0,0,0,0|0,0,2]=3 109 B4R0.1 CC=C(Cl)Cl 1300-5-42 [0,1,0,0,0,0|2,0,0]=3 110 B4R0.1 CCB(O)O 6160-1-X1 [0,1,0,0,0,0|1,0,1]=3 111 B4R0.1 CCC(=N)N 3141-5-03 [0,1,0,0,0,0|2,0,0]=3 112 B4R0.1 CCC(C)Cl 1100-5-25 [0,1,0,0,0,0|2,0,1]=4 113 B4R0.1 CCC(C)F 1100-3-47 [0,1,0,0,0,0|2,0,1]=4 114 B4R0.1 CCC(C)I 1100-H-X6 [0,1,0,0,0,0|2,0,1]=4 115 B4R0.1 CC[C@@H](C)O 2101-1-R1 [0,1,0,0,0,0|1,0,1]=3 116 B4R0.1 CN(C)C=O 4148-1-03 [0,1,0,0,0,0|2,0,0]=3 117 B4R0.1 CNC(N)=S 7167-1-20 [0,1,0,0,0,0|1,1,0]=3 118 B4R0.1 COC(=N)N 8153-1-01 [0,1,0,0,0,0|2,0,0]=3 119 B4R0.1 COC(Cl)Cl 2107-5-05 [0,1,0,0,0,0|2,0,1]=4 120 B4R0.1 CSC(=N)N 7167-H-X1 [0,1,0,0,0,0|2,0,0]=3 121 B4R0.1 CSC(=N)N 8167-1-01 [0,1,0,0,0,0|2,0,0]=3 122 B4R0.1 C[C@@H](N)CO 4156-1-R3 [0,1,0,0,0,0|1,0,1]=3 123 B4R0.1 C[C@@H](O)CN 4156-1-R2 [0,1,0,0,0,0|1,0,1]=3 124 B4R0.1 C[C@@H](O)CO 2104-1-R3 [0,1,0,0,0,0|0,0,2]=3 125 B4R0.1 C[C@H](O)CN 4156-1-S2 [0,1,0,0,0,0|1,0,1]=3 126 B4R0.1 C[C@H](O)CO 2104-1-S3 [0,1,0,0,0,0|0,0,2]=3 127 B4R0.1 C\C(Cl)=C/Cl 1300-5-18 [0,1,0,0,0,0|2,0,0]=3 128 B4R0.1 C\C(Cl)=C\Cl 1300-5-Z0 [0,1,0,0,0,0|2,0,0]=3 129 B4R0.1 C\C(N)=N\O 4147-1-X0 [0,1,0,0,0,0|1,0,0]=2 130 B4R0.1 ClC=C(Cl)Cl 1300-5-03 [0,1,0,0,0,0|2,0,1]=4 131 B4R0.1 ClCC(Cl)Cl 1100-5-X2 [0,1,0,0,0,0|2,0,1]=4 132 B4R0.1 FC(Cl)CCl 1100-7-28 [0,1,0,0,0,0|2,0,1]=4 133 B4R0.1 FC(F)CBr 1100-B-07 [0,1,0,0,0,0|2,0,1]=4 134 B4R0.1 FC(F)CI 1100-K-32 [0,1,0,0,0,0|2,0,1]=4 135 B4R0.1 N=C(N)CCl 3141-5-X3 [0,1,0,0,0,0|2,0,0]=3 136 B4R0.1 NC(=O)CBr 4148-9-X4 [0,1,0,0,0,0|1,0,0]=2 137 B4R0.1 NC(=O)CCl 4148-5-00 [0,1,0,0,0,0|1,0,0]=2 138 B4R0.1 NCC(F)F 3130-3-03 [0,1,0,0,0,0|2,0,1]=4 139 B4R0.1 NCC(F)F 3130-7-03 [0,1,0,0,0,0|2,0,1]=4 140 B4R0.1 O=C(Br)CBr 2116-9-03 [0,1,0,0,0,0|1,0,0]=2 141 B4R0.1 O=C(Cl)SCl 6171-5-00 [0,1,0,0,0,0|1,1,0]=3 142 B4R0.1 O=C(O)CBr 2121-9-01 [0,1,0,0,0,0|0,0,0]=1 143 B4R0.1 O=C(O)CI 2121-H-00 [0,1,0,0,0,0|0,0,0]=1 144 B4R0.1 O=C(O)CO 2129-1-20 [0,1,0,0,0,0|0,0,0]=1 145 B4R0.1 O=CC(=O)O 2129-1-X4 [0,1,0,0,0,0|0,0,1]=2 146 B4R0.1 O=S([O-])CO 6165-1-06 [0,1,0,0,0,0|1,0,1]=3 147 B4R0.1 O=[N+]([O-])CBr 4154-9-X0 [0,1,0,0,0,0|1,0,1]=3 148 B4R0.1 OCC(F)F 2101-3-02 [0,1,0,0,0,0|2,0,1]=4 149 B4R0.1 ON=C(Br)Br 4147-9-00 [0,1,0,0,0,0|2,0,0]=3 150 B4R0.1 [C@@H](C)(N)CC 3130-1-S1 [0,1,0,0,0,0|2,0,1]=4 151 B4R0.1 [C@@H](C)(N)CO 4156-1-Y5 [0,1,0,0,0,0|1,0,1]=3 152 B4R0.1 [C@H](C)(N)CC 3130-1-R1 [0,1,0,0,0,0|2,0,1]=4 153 B4R0.3 CC(C)(Br)Br 1100-9-X2 [0,1,0,0,0,0|2,0,1]=4 154 B4R0.3 CC(C)(C)Br 1100-9-X3 [0,1,0,0,0,0|2,0,1]=4 155 B4R0.3 CC(C)(C)C 1100-1-01 [0,1,0,0,0,0|2,0,1]=4 156 B4R0.3 CC(C)(C)Cl 1100-5-22 [0,1,0,0,0,0|2,0,1]=4 157 B4R0.3 CC(C)(C)I 1100-H-18 [0,1,0,0,0,0|2,0,1]=4 158 B4R0.3 CC(C)(C)O 2103-1-01 [0,1,0,0,0,0|1,0,1]=3 159 B4R0.3 CC(C)(C)[O-] 2105-1-05 [0,1,0,0,0,0|1,0,2]=4 160 B4R0.3 CC(C)(Cl)Cl 1100-5-07 [0,1,0,0,0,0|2,0,1]=4 161 B4R0.3 CC(C)(F)F 1100-3-17 [0,1,0,0,0,0|2,0,1]=4 162 B4R0.3 CC(F)(Cl)Cl 1100-7-21 [0,1,0,0,0,0|2,0,1]=4 163 B4R0.3 CC(F)(F)Cl 1100-7-19 [0,1,0,0,0,0|2,0,1]=4 164 B4R0.3 CC(F)(F)F 1100-3-07 [0,1,0,0,0,0|2,0,1]=4 165 B4R0.3 CS(=O)(=O)Cl 6162-5-01 [0,1,0,0,0,0|1,0,1]=3 166 B4R0.3 CS(=O)(=O)F 6162-3-01 [0,1,0,0,0,0|1,0,1]=3 167 B4R0.3 CS(=O)(=O)O 6164-1-17 [0,1,0,0,0,0|1,0,0]=2 168 B4R0.3 CS(C)(=N)=O 8169-1-04 [0,1,0,0,0,0|2,0,0]=3 169 B4R0.3 CS(N)(=O)=O 8169-1-X1 [0,1,0,0,0,0|1,0,1]=3 170 B4R0.3 C[B-](F)(F)F 5160-3-03 [0,1,0,0,0,0|3,0,0]=4 171 B4R0.3 C[N+](C)(C)C 3133-3-02 [0,1,0,0,0,0|3,0,0]=4 172 B4R0.3 C[N+](C)(C)C 3133-3-10 [0,1,0,0,0,0|3,0,0]=4 173 B4R0.3 C[N+](C)(C)C 3133-3-15 [0,1,0,0,0,0|3,0,0]=4 174 B4R0.3 C[N+](C)(C)C 3133-5-01 [0,1,0,0,0,0|3,0,0]=4 175 B4R0.3 C[N+](C)(C)C 4133-1-00SW [0,1,0,0,0,0|3,0,0]=4 176 B4R0.3 C[N+](C)(C)C 7133-3-44 [0,1,0,0,0,0|3,0,0]=4 177 B4R0.3 C[S+](C)(C)=O 6165-5-00 [0,1,0,0,0,0|2,0,0]=3 178 B4R0.3 C[S+](C)(C)=O 6165-H-X0 [0,1,0,0,0,0|2,0,0]=3 179 B4R0.3 C[Si](C)(C)Br 5181-9-01 [0,1,0,0,0,0|2,1,0]=4 180 B4R0.3 C[Si](C)(C)C 5180-1-10 [0,1,0,0,0,0|2,1,0]=4 181 B4R0.3 C[Si](C)(C)Cl 5181-5-01 [0,1,0,0,0,0|2,1,0]=4 182 B4R0.3 C[Si](C)(C)F 5181-3-03 [0,1,0,0,0,0|2,1,0]=4 183 B4R0.3 C[Si](C)(C)I 5181-H-X0 [0,1,0,0,0,0|2,1,0]=4 184 B4R0.3 C[Si](C)(C)O 6182-1-X0 [0,1,0,0,0,0|1,1,0]=3 185 B4R0.3 C[Si](C)(Cl)Cl 5181-5-02 [0,1,0,0,0,0|2,1,0]=4 186 B4R0.3 C[Si](C)(F)F 5181-3-02 [0,1,0,0,0,0|2,1,0]=4 187 B4R0.3 C[Si](Cl)(Cl)Cl 5181-5-07 [0,1,0,0,0,0|2,1,0]=4 188 B4R0.3 C[Si](F)(F)F 5181-3-01 [0,1,0,0,0,0|2,1,0]=4 189 B4R0.3 NS(=O)(=O)Cl M016-5-00 [0,1,0,0,0,0|2,0,1]=4 190 B4R0.3 NS(N)(=O)=O M032-1-X0 [0,1,0,0,0,0|2,0,1]=4 191 B4R0.3 O=Cl(=O)(=O)[O-] M037-4-01 [0,1,0,0,0,0|2,0,1]=4 192 B4R0.3 O=I(=O)(=O)[O-] M011-G-01 [0,1,0,0,0,0|2,0,1]=4 193 B4R0.3 O=P(O)(F)F M001-3-33 [0,1,0,0,0,0|2,0,0]=3 194 B4R0.3 O=P(O)(O)O M015-1-42 [0,1,0,0,0,0|2,0,0]=3 195 B4R0.3 O=P([O-])([O-])F M011-2-09 [0,1,0,0,0,0|2,0,1]=4 196 B4R0.3 O=P([O-])([O-])[O-] M011-0-00 [0,1,0,0,0,0|2,0,1]=4 197 B4R0.3 O=S(=O)([O-])F M019-2-08 [0,1,0,0,0,0|2,0,1]=4 198 B4R0.3 O=S(=O)([O-])[O-] M026-0-02 [0,1,0,0,0,0|2,0,1]=4 199 B4R0.3 O=S([O-])([O-])=S M011-0-55A [0,1,0,0,0,0|2,0,1]=4 200 B4R0.3 O=[As]([O-])(O)O M033-0-01 [0,1,0,0,0,0|2,0,0]=3 201 B4R0.3 O=[W-2](=O)(=O)=O M074-1-00 [0,1,0,0,0,0|2,0,1]=4 202 B4R1.2 BrC1CC1 1200-9-02 [0,0,0,1,0,0|2,0,1]=4 203 B4R1.2 NC1CC1 3230-1-X2 [0,0,0,1,0,0|2,0,1]=4 204 B1R0.1 CCl 1100-5-16 [2,0,0,0,0,0|1,0,0]=3 205 B1R0.1 CF 1100-3-01 [2,0,0,0,0,0|1,0,0]=3 206 B1R0.1 CI 1100-H-01 [2,0,0,0,0,0|1,0,0]=3 207 B1R0.1 C[S-] 5161-1-X1 [2,0,0,0,0,0|0,1,0]=3 208 B1R0.1 C[S-] 5161-1-X1S [2,0,0,0,0,0|0,1,0]=3 209 B1R0.1 ClCl M017-4-01 [2,0,0,0,0,0|2,0,0]=4 210 B1R0.1 NO M007-5-03 [2,0,0,0,0,0|1,0,0]=3 211 B1R0.1 O=[Mg] M012-0-00 [2,0,0,0,0,0|1,0,0]=3 212 B1R0.1 [Cu][Zn] M030-0-29 [2,0,0,0,0,0|2,0,0]=4 213 B3R0.1 BrCCI 1100-S-04 [1,1,0,0,0,0|1,0,1]=4 214 B3R0.1 C#CCC 1500-1-05 [1,1,0,0,0,0|1,0,1]=4 215 B3R0.1 C#CCCl 1500-5-02 [1,1,0,0,0,0|1,0,1]=4 216 B3R0.1 C=CCBr 1300-9-02 [1,1,0,0,0,0|1,0,0]=3 217 B3R0.1 C=CCC 1300-1-25 [1,1,0,0,0,0|1,0,0]=3 218 B3R0.1 C=CCCl 1300-5-10 [1,1,0,0,0,0|1,0,0]=3 219 B3R0.1 C=CCF 1300-3-09 [1,1,0,0,0,0|1,0,0]=3 220 B3R0.1 C=CCI 1300-H-01 [1,1,0,0,0,0|1,0,0]=3 221 B3R0.1 CC#CC 1500-1-02 [1,1,0,0,0,0|1,0,1]=4 222 B3R0.1 CCC=O 2115-1-05 [1,1,0,0,0,0|0,0,0]=2 223 B3R0.1 CCCBr 1100-9-37 [1,1,0,0,0,0|1,0,1]=4 224 B3R0.1 CCCC 1100-1-X0 [1,1,0,0,0,0|1,0,1]=4 225 B3R0.1 CCCCl 1100-5-01 [1,1,0,0,0,0|1,0,1]=4 226 B3R0.1 CCCI 1100-H-X9 [1,1,0,0,0,0|1,0,1]=4 227 B3R0.1 CCNN 3139-5-05 [1,1,0,0,0,0|1,0,1]=4 228 B3R0.1 CNOC 4147-5-01 [1,1,0,0,0,0|1,0,0]=3 229 B3R0.1 COCBr 2107-9-01 [1,1,0,0,0,0|1,0,1]=4 230 B3R0.1 C\C=C/C 1300-1-29 [1,1,0,0,0,0|1,0,0]=3 231 B3R0.1 C\C=C\C 1300-1-04 [1,1,0,0,0,0|1,0,0]=3 232 B3R0.1 C\C=C\Cl 1300-5-17 [1,1,0,0,0,0|1,0,0]=3 233 B3R0.1 C\C=C\Cl 1300-5-E1 [1,1,0,0,0,0|1,0,0]=3 234 B3R0.1 ClCCCl 1100-5-15 [1,1,0,0,0,0|1,0,1]=4 235 B3R0.1 ClCCI 1100-M-00 [1,1,0,0,0,0|1,0,1]=4 236 B3R0.1 Cl\C=C\Cl 1300-5-13 [1,1,0,0,0,0|1,0,1]=4 237 B3R0.1 FCCCl 1100-7-05 [1,1,0,0,0,0|1,0,1]=4 238 B3R0.1 FCCI 1100-K-18 [1,1,0,0,0,0|1,0,1]=4 239 B3R0.1 N#CCBr 3137-9-02 [1,1,0,0,0,0|1,0,1]=4 240 B3R0.1 NCCBr 3130-9-X1 [1,1,0,0,0,0|1,0,1]=4 241 B3R0.1 NCCCl 3130-5-01 [1,1,0,0,0,0|1,0,1]=4 242 B3R0.1 NCCF 3130-7-04 [1,1,0,0,0,0|1,0,1]=4 243 B3R0.1 NCCS 7161-5-01 [1,1,0,0,0,0|0,1,1]=4 244 B3R0.1 OCCBr 2101-9-02 [1,1,0,0,0,0|0,0,1]=3 245 B5R0.1 C=CCC(C)O 2302-1-00 [0,2,0,0,0,0|1,0,1]=4 246 B5R0.1 C=COC(C)=O 2324-1-50 [0,2,0,0,0,0|0,0,0]=2 247 B5R0.1 CC#CC(=O)O 2521-1-13 [0,2,0,0,0,0|0,0,0]=2 248 B5R0.1 CC(C)=CCBr 1300-9-X0 [0,2,0,0,0,0|2,0,0]=4 249 B5R0.1 CC(C)=CCCl 1300-5-X0 [0,2,0,0,0,0|2,0,0]=4 250 B5R0.1 CC(C)CCO 2101-1-53 [0,2,0,0,0,0|1,0,1]=4 251 B5R0.1 CC(N)CCO 4156-1-4D [0,2,0,0,0,0|1,0,1]=4 252 B5R0.1 CCCB(O)O 6160-1-X5 [0,2,0,0,0,0|1,0,1]=4 253 B5R0.1 CCCC(=O)Cl 2116-5-09 [0,2,0,0,0,0|1,0,0]=3 254 B5R0.1 CCCC(=O)[O-] 2122-1-X1 [0,2,0,0,0,0|0,0,1]=3 255 B5R0.1 CCCC(C)O 2102-1-52 [0,2,0,0,0,0|1,0,1]=4 256 B5R0.1 CCNC(N)=O 4153-1-X1 [0,2,0,0,0,0|1,0,0]=3 257 B5R0.1 CCOC(=S)[S-] 6167-1-02 [0,2,0,0,0,0|0,2,0]=4 258 B5R0.1 COCC(=O)Cl 2116-5-X4 [0,2,0,0,0,0|1,0,0]=3 259 B5R0.1 CSCC(=O)O 6166-1-05 [0,2,0,0,0,0|0,0,0]=2 260 B5R0.1 C[C@@H](N)CCO 4156-1-RB [0,2,0,0,0,0|1,0,1]=4 261 B5R0.1 C[C@@H](O)CCO 2101-1-X0 [0,2,0,0,0,0|0,0,2]=4 262 B5R0.1 ClCC=C(Cl)Cl 1300-5-07 [0,2,0,0,0,0|2,0,0]=4 263 B5R0.1 N#CCC(N)=S 7167-1-W0 [0,2,0,0,0,0|1,1,0]=4 264 B5R0.1 NC(=O)CCBr 4148-9-00 [0,2,0,0,0,0|1,0,0]=3 265 B5R0.1 NC(=O)CCCl 4148-5-02 [0,2,0,0,0,0|1,0,0]=3 266 B5R0.1 O=C(O)CCO 2129-1-Y8 [0,2,0,0,0,0|0,0,0]=2 267 B5R0.3 C#CC(=O)OC 2523-1-X1 [0,2,0,0,0,0|0,0,1]=3 268 B5R0.3 C#CC(O)CC 2502-1-02 [0,2,0,0,0,0|1,0,1]=4 269 B5R0.3 C=C(CCl)CCl 1300-5-X1 [0,2,0,0,0,0|2,0,0]=4 270 B5R0.3 C=C(CO)CO 2304-1-X0 [0,2,0,0,0,0|1,0,0]=3 271 B5R0.3 CCC(=O)CBr 2117-9-01 [0,2,0,0,0,0|1,0,0]=3 272 B5R0.3 CCC(C)C=O 2115-1-0C [0,2,0,0,0,0|1,0,1]=4 273 B5R0.3 CCC(N)CO 4156-1-38 [0,2,0,0,0,0|1,0,1]=4 274 B5R0.3 CCC(O)CN 4156-1-Z4 [0,2,0,0,0,0|1,0,1]=4 275 B5R0.3 CC[C@@H](N)CO 4156-1-R4 [0,2,0,0,0,0|1,0,1]=4 276 B5R0.3 CC[C@H](N)CO 4156-1-W2 [0,2,0,0,0,0|1,0,1]=4 277 B5R0.3 CNC(=S)NN 7167-1-19 [0,2,0,0,0,0|1,1,0]=4 278 B5R0.3 COC(=O)CBr 2123-9-36 [0,2,0,0,0,0|0,0,0]=2 279 B5R0.3 COC(=O)CN 4158-5-40 [0,2,0,0,0,0|0,0,0]=2 280 B5R0.3 COC(=O)CO 2129-1-X2 [0,2,0,0,0,0|0,0,0]=2 281 B5R0.3 COC(=O)CS 6161-1-X3 [0,2,0,0,0,0|0,0,0]=2 282 B5R0.3 COC(=O)NN 4156-1-39 [0,2,0,0,0,0|1,0,0]=3 283 B5R0.3 COS(=O)OC 6164-1-13 [0,2,0,0,0,0|1,0,0]=3 284 B5R0.3 CO[PH](=O)OC 6177-1-0G [0,2,0,0,0,0|1,0,0]=3 285 B5R0.3 CSC(=N)NN 7167-H-X0 [0,2,0,0,0,0|2,0,0]=4 286 B5R0.3 CSC(=S)NN 8169-1-0B [0,2,0,0,0,0|1,1,0]=4 287 B5R0.3 C\C(C=O)=C/N 4356-1-X1 [0,2,0,0,0,0|1,0,0]=3 288 B5R0.3 NC(CO)CO 4104-1-X0 [0,2,0,0,0,0|1,0,1]=4 289 B5R0.3 NCC(O)CN 4156-1-Y7 [0,2,0,0,0,0|1,0,1]=4 290 B5R0.3 NCC(O)CO 4156-1-Z8 [0,2,0,0,0,0|0,0,2]=4 291 B5R0.3 O=C(CBr)CBr 2117-9-03 [0,2,0,0,0,0|1,0,0]=3 292 B5R0.3 O=C(CF)CF 2117-3-09 [0,2,0,0,0,0|1,0,0]=3 293 B5R0.3 OC(CBr)CBr 2101-9-X1 [0,2,0,0,0,0|1,0,1]=4 294 B5R0.3 OC(CCl)CCl 2102-5-13 [0,2,0,0,0,0|1,0,1]=4 295 B5R0.3 OC(CF)CCl 2102-7-02 [0,2,0,0,0,0|1,0,1]=4 296 B5R0.3 OC(CF)CF 2102-3-13 [0,2,0,0,0,0|1,0,1]=4 297 B5R0.3 OCC(O)CBr 2104-9-01 [0,2,0,0,0,0|0,0,2]=4 298 B5R0.3 OCC(O)CS 6161-1-X4 [0,2,0,0,0,0|0,0,2]=4 299 B5R0.4 CC(C)(C)C=O 2115-1-X3 [0,2,0,0,0,0|1,0,1]=4 300 B5R0.4 CC(C)(C)CO 2101-1-08 [0,2,0,0,0,0|1,0,1]=4 301 B5R0.4 CC(C)(C)NO 4147-5-X0 [0,2,0,0,0,0|1,0,1]=4 302 B5R0.4 CC(C)(F)CO 2101-3-97 [0,2,0,0,0,0|1,0,1]=4 303 B5R0.4 CC(C)(N)CO 4156-1-X8 [0,2,0,0,0,0|1,0,1]=4 304 B5R0.4 CC(C)(O)CN 4156-1-05 [0,2,0,0,0,0|1,0,1]=4 305 B5R0.4 CC(C)(O)CO 2104-1-09 [0,2,0,0,0,0|0,0,2]=4 306 B5R0.4 CC(F)(F)CO 2101-3-52 [0,2,0,0,0,0|1,0,1]=4 307 B5R0.4 CCS(C)(=O)=O 6163-1-0B [0,2,0,0,0,0|1,0,1]=4 308 B5R0.4 CCS(N)(=O)=O 8169-1-03 [0,2,0,0,0,0|1,0,1]=4 309 B5R0.4 CNS(C)(=O)=O 8169-1-11 [0,2,0,0,0,0|1,0,1]=4 310 B5R0.4 NOS(=O)(=O)O P612-A-67 [0,2,0,0,0,0|2,0,0]=4 311 B5R0.4 O=S(=O)(Cl)CCl 6162-5-X1 [0,2,0,0,0,0|1,0,1]=4 312 B5R0.5 C=C(C)C(C)C 1300-1-24 [0,2,0,0,0,0|2,0,0]=4 313 B5R0.5 C=C(F)C(=O)O 2321-3-06 [0,2,0,0,0,0|0,0,1]=3 314 B5R0.5 CC(=O)C(=O)O 2129-1-03 [0,2,0,0,0,0|0,0,0]=2 315 B5R0.5 CC(=O)C(C)=O 2118-1-05 [0,2,0,0,0,0|0,0,1]=3 316 B5R0.5 CC(=O)C(C)C 2117-1-13 [0,2,0,0,0,0|1,0,0]=3 317 B5R0.5 CC(=O)C(C)F 2117-3-11 [0,2,0,0,0,0|1,0,0]=3 318 B5R0.5 CC(=O)C(F)F 2117-3-13 [0,2,0,0,0,0|1,0,0]=3 319 B5R0.5 CC(=O)N(C)C 4148-1-08 [0,2,0,0,0,0|1,0,0]=3 320 B5R0.5 CC(Br)C(N)=O 4157-9-X1 [0,2,0,0,0,0|1,0,0]=3 321 B5R0.5 CC(C)=C(C)C 1300-1-X1 [0,2,0,0,0,0|2,0,0]=4 322 B5R0.5 CC(C)B(O)O 6160-1-X0 [0,2,0,0,0,0|1,0,1]=4 323 B5R0.5 CC(C)C(=N)N 3141-5-X0 [0,2,0,0,0,0|2,0,0]=4 324 B5R0.5 CC(C)C(=O)Cl 2116-5-05 [0,2,0,0,0,0|1,0,0]=3 325 B5R0.5 CC(F)C(=O)O 2121-3-95 [0,2,0,0,0,0|0,0,0]=2 326 B5R0.5 CC(N)C(N)=O 4158-5-X5 [0,2,0,0,0,0|1,0,0]=3 327 B5R0.5 CC(O)C(C)O 2104-1-07 [0,2,0,0,0,0|0,0,2]=4 328 B5R0.5 CN(C)C(=N)N 3141-5-00 [0,2,0,0,0,0|2,0,0]=4 329 B5R0.5 CN(C)C(=S)Cl P911-A-76 [0,2,0,0,0,0|1,1,0]=4 330 B5R0.5 CN(C)C(=S)[S-] 5167-1-01 [0,2,0,0,0,0|0,2,0]=4 331 B5R0.5 C[C@@H](Cl)C(=O)O 2121-5-R1 [0,2,0,0,0,0|0,0,0]=2 332 B5R0.5 C[C@@H](O)C(N)=O 4148-1-R1 [0,2,0,0,0,0|0,0,1]=3 333 B5R0.5 C[C@@H](O)[C@@H](C)O 2104-1-R1 [0,2,0,0,0,0|0,0,2]=4 334 B5R0.5 C[C@H](N)C(=O)O 4157-1-S5 [0,2,0,0,0,0|0,0,0]=2 335 B5R0.5 C[C@H](N)C(N)=O 4148-5-04 [0,2,0,0,0,0|1,0,0]=3 336 B5R0.5 C[C@H](O)C(=O)O 2129-1-S8 [0,2,0,0,0,0|0,0,0]=2 337 B5R0.5 C[C@H](O)[C@H](C)O 2104-1-X2 [0,2,0,0,0,0|0,0,2]=4 338 B5R0.5 NC(=O)C(Cl)Cl 4148-5-X4 [0,2,0,0,0,0|1,0,0]=3 339 B5R0.5 NC(=O)C(F)Br 4148-B-02 [0,2,0,0,0,0|1,0,0]=3 340 B5R0.5 NC(=O)C(F)Cl 4148-7-03 [0,2,0,0,0,0|1,0,0]=3 341 B5R0.5 NC(=O)C(F)F 4148-3-18 [0,2,0,0,0,0|1,0,0]=3 342 B5R0.5 NC(=O)C(F)I 4148-K-01 [0,2,0,0,0,0|1,0,0]=3 343 B5R0.5 NC(=O)C(N)=O 4148-1-18 [0,2,0,0,0,0|1,0,1]=4 344 B5R0.5 O=C(Cl)C(=O)Cl 2116-4-02 [0,2,0,0,0,0|1,0,1]=4 345 B5R0.5 O=C(Cl)C(Cl)Cl 2116-5-00 [0,2,0,0,0,0|1,0,0]=3 346 B5R0.5 O=C(O)C(=O)O 2121-1-12 [0,2,0,0,0,0|0,0,1]=3 347 B5R0.5 O=C(O)C(F)Br 2121-B-03 [0,2,0,0,0,0|0,0,0]=2 348 B5R0.5 O=C(O)C(F)Cl 2121-7-03 [0,2,0,0,0,0|0,0,0]=2 349 B5R0.5 O=C(O)C(F)F 2121-3-05 [0,2,0,0,0,0|0,0,0]=2 350 B5R0.5 O=C(O)C(F)I 2121-K-01 [0,2,0,0,0,0|0,0,0]=2 351 B5R0.5 O=C([O-])C(=O)[O-] 2122-0-00 [0,2,0,0,0,0|0,0,2]=4 352 B5R0.5 O=C([O-])C(=O)[O-] 2122-1-06 [0,2,0,0,0,0|0,0,2]=4 353 B5R0.5 O=C([O-])C(=O)[O-] M068-1-X0 [0,2,0,0,0,0|0,0,2]=4 354 B5R0.5 O=C([O-])C(=O)[O-] M068-1-X1 [0,2,0,0,0,0|0,0,2]=4 355 B5R0.5 O=C([O-])C(F)Br 2122-B-01 [0,2,0,0,0,0|0,0,1]=3 356 B5R0.5 O=C([O-])C(F)Cl 2122-7-01 [0,2,0,0,0,0|0,0,1]=3 357 B5R0.5 O=C([O-])C(F)F 2122-3-02 [0,2,0,0,0,0|0,0,1]=3 358 B5R0.5 O=C([O-])C(F)F 2122-3-07 [0,2,0,0,0,0|0,0,1]=3 359 B5R0.5 [C@@H](C)(Cl)C(=O)O 2121-5-S1 [0,2,0,0,0,0|0,0,0]=2 360 B3R1.1 C1CC1 1200-1-03 [1,0,0,1,0,0|1,0,1]=4 361 B5R1.2 BrC1COC1 2H10-9-07 [0,1,0,1,0,0|1,0,1]=4 362 B5R1.2 IC1COC1 2H10-H-05 [0,1,0,1,0,0|1,0,1]=4 363 B5R1.2 O=C1CCC1 2217-1-X6 [0,1,0,1,0,0|1,0,0]=3 364 B5R1.2 O=C1CCN1 4H48-1-F4 [0,1,0,1,0,0|1,0,0]=3 365 B5R1.2 O=C1CNC1 4H56-5-05 [0,1,0,1,0,0|1,0,0]=3 366 B5R1.2 O=C1COC1 2H17-1-05 [0,1,0,1,0,0|0,0,0]=2 367 B5R1.2 O=C1CSC1 6H66-1-39 [0,1,0,1,0,0|0,1,0]=3 368 B5R1.2 OC1CNC1 4H01-5-63 [0,1,0,1,0,0|1,0,1]=4 369 B5R1.2 OC1COC1 2H01-1-X3 [0,1,0,1,0,0|0,0,2]=4 370 B5R1.3 C=CC1CO1 2309-1-02 [0,1,0,1,0,0|1,0,1]=4 371 B5R1.3 ClCC1CO1 2109-5-01 [0,1,0,1,0,0|1,0,1]=4 372 B5R1.3 ClC[C@@H]1CO1 2109-5-X0 [0,1,0,1,0,0|1,0,1]=4 373 B5R1.3 ClC[C@H]1CO1 2109-5-X1 [0,1,0,1,0,0|1,0,1]=4 374 B5R1.3 FCC1CO1 2109-3-20 [0,1,0,1,0,0|1,0,1]=4 375 B5R1.3 O=CC1CC1 2215-1-X2 [0,1,0,1,0,0|1,0,1]=4 376 B5R1.3 OCC1CC1 2301-1-X2 [0,1,0,1,0,0|1,0,1]=4 377 B5R1.3 OC[C@@H]1CO1 2109-1-R2 [0,1,0,1,0,0|0,0,2]=4 378 B5R1.3 OC[C@H]1CO1 2109-1-S1 [0,1,0,1,0,0|0,0,2]=4 379 B5R1.4 C[C@@H]1O[C@@H]1C 2109-1-Z0 [0,1,0,1,0,0|1,0,1]=4 380 B5R1.4 C[C@@H]1O[C@H]1C 2109-1-E0 [0,1,0,1,0,0|1,0,1]=4 381 B5R1.5 CC1(C)CO1 2109-1-03 [0,1,0,1,0,0|1,0,1]=4