0 B4R0.1 C#CC(C)O 2502-1-01 [0,0,0,0,0,0|2,0,1]=3 1 B4R0.1 C#C[C@@H](C)O 2502-1-R1 [0,0,0,0,0,0|2,0,1]=3 2 B4R0.1 C=C(C)CBr 1300-9-00 [0,0,0,0,0,0|1,0,3]=4 3 B4R0.1 C=C(C)CC 1300-1-21 [0,0,0,0,0,0|1,0,3]=4 4 B4R0.1 C=C(C)CN 3330-1-X1 [0,0,0,0,0,0|1,0,3]=4 5 B4R0.1 C=C(C)CN 3330-5-X0 [0,0,0,0,0,0|1,0,3]=4 6 B4R0.1 C=C(C)OC 2307-1-01 [0,0,0,0,0,0|2,0,2]=4 7 B4R0.1 C=CC(=C)C 1300-1-49 [0,0,0,0,0,0|1,0,2]=3 8 B4R0.1 C=CC(C)C 1300-1-26 [0,0,0,0,0,0|1,0,0]=1 9 B4R0.1 C=CC(C)Cl 1300-5-41 [0,0,0,0,0,0|2,0,0]=2 10 B4R0.1 CC(=O)C=O 2117-1-X0 [0,0,0,0,0,0|1,0,1]=2 11 B4R0.1 CC(=O)C=O 2117-1-X0A [0,0,0,0,0,0|1,0,1]=2 12 B4R0.1 CC(=O)CF 2117-3-10 [0,0,0,0,0,0|2,0,2]=4 13 B4R0.1 CC(=O)CO 2120-1-01 [0,0,0,0,0,0|1,0,3]=4 14 B4R0.1 CC(=O)NN 4156-1-2V [0,0,0,0,0,0|3,0,1]=4 15 B4R0.1 CC(C)C#N 3137-1-Y4 [0,0,0,0,0,0|1,0,1]=2 16 B4R0.1 CC(C)C=O 2115-1-13 [0,0,0,0,0,0|0,0,0]=0 17 B4R0.1 CC(C)NN 3139-5-X2 [0,0,0,0,0,0|2,0,0]=2 18 B4R0.1 CC(C)[Mg]Cl 9112-5-04 [0,0,0,0,0,0|2,0,0]=2 19 B4R0.1 CC(F)CO 2101-3-64 [0,0,0,0,0,0|1,0,2]=3 20 B4R0.1 CC(N)CO 4156-1-92 [0,0,0,0,0,0|1,0,2]=3 21 B4R0.1 CC(O)CF 2102-3-12 [0,0,0,0,0,0|2,0,1]=3 22 B4R0.1 CC(O)CO 2104-1-12 [0,0,0,0,0,0|1,0,2]=3 23 B4R0.1 CC=C(Cl)Cl 1300-5-42 [0,0,0,0,0,0|3,0,1]=4 24 B4R0.1 CCC(C)Cl 1100-5-25 [0,0,0,0,0,0|2,0,1]=3 25 B4R0.1 CCC(C)F 1100-3-47 [0,0,0,0,0,0|2,0,1]=3 26 B4R0.1 CCC(C)I 1100-H-X6 [0,0,0,0,0,0|2,0,1]=3 27 B4R0.1 CC[C@@H](C)O 2101-1-R1 [0,0,0,0,0,0|2,0,1]=3 28 B4R0.1 CN(C)C=O 4148-1-03 [0,0,0,0,0,0|1,0,0]=1 29 B4R0.1 COC(Cl)Cl 2107-5-05 [0,0,0,0,0,0|4,0,0]=4 30 B4R0.1 C[C@@H](N)CO 4156-1-R3 [0,0,0,0,0,0|1,0,2]=3 31 B4R0.1 C[C@@H](O)CN 4156-1-R2 [0,0,0,0,0,0|2,0,1]=3 32 B4R0.1 C[C@@H](O)CO 2104-1-R3 [0,0,0,0,0,0|1,0,2]=3 33 B4R0.1 C[C@H](O)CN 4156-1-S2 [0,0,0,0,0,0|2,0,1]=3 34 B4R0.1 C[C@H](O)CO 2104-1-S3 [0,0,0,0,0,0|1,0,2]=3 35 B4R0.1 C\C(Cl)=C/Cl 1300-5-18 [0,0,0,0,0,0|2,0,1]=3 36 B4R0.1 C\C(Cl)=C\Cl 1300-5-Z0 [0,0,0,0,0,0|2,0,1]=3 37 B4R0.1 C\C(N)=N\O 4147-1-X0 [0,0,0,0,0,0|2,0,2]=4 38 B4R0.1 ClC=C(Cl)Cl 1300-5-03 [0,0,0,0,0,0|3,0,1]=4 39 B4R0.1 ClCC(Cl)Cl 1100-5-X2 [0,0,0,0,0,0|3,0,1]=4 40 B4R0.1 FC(Cl)CCl 1100-7-28 [0,0,0,0,0,0|3,0,1]=4 41 B4R0.1 FC(F)CBr 1100-B-07 [0,0,0,0,0,0|3,0,1]=4 42 B4R0.1 FC(F)CI 1100-K-32 [0,0,0,0,0,0|3,0,1]=4 43 B4R0.1 N#CC(F)F 3137-3-22 [0,0,0,0,0,0|3,0,1]=4 44 B4R0.1 NCC(F)F 3130-3-03 [0,0,0,0,0,0|3,0,1]=4 45 B4R0.1 NCC(F)F 3130-7-03 [0,0,0,0,0,0|3,0,1]=4 46 B4R0.1 O=CC(=O)O 2129-1-X4 [0,0,0,0,0,0|2,0,1]=3 47 B4R0.1 OCC(F)F 2101-3-02 [0,0,0,0,0,0|2,0,2]=4 48 B4R0.1 [C@@H](C)(N)CC 3130-1-S1 [0,0,0,0,0,0|2,0,1]=3 49 B4R0.1 [C@@H](C)(N)CO 4156-1-Y5 [0,0,0,0,0,0|1,0,2]=3 50 B4R0.1 [C@H](C)(N)CC 3130-1-R1 [0,0,0,0,0,0|2,0,1]=3 51 B3R0.1 BrCCI 1100-S-04 [1,0,0,0,0,0|2,0,1]=4 52 B3R0.1 C#CCC 1500-1-05 [1,0,0,0,0,0|1,0,1]=3 53 B3R0.1 C#CCCl 1500-5-02 [1,0,0,0,0,0|2,0,1]=4 54 B3R0.1 C=CCBr 1300-9-02 [1,0,0,0,0,0|2,0,0]=3 55 B3R0.1 C=CCC 1300-1-25 [1,0,0,0,0,0|1,0,0]=2 56 B3R0.1 C=CCCl 1300-5-10 [1,0,0,0,0,0|2,0,0]=3 57 B3R0.1 C=CCF 1300-3-09 [1,0,0,0,0,0|2,0,0]=3 58 B3R0.1 C=CCI 1300-H-01 [1,0,0,0,0,0|2,0,0]=3 59 B3R0.1 CC#CC 1500-1-02 [1,0,0,0,0,0|1,0,2]=4 60 B3R0.1 CCC=O 2115-1-05 [1,0,0,0,0,0|0,0,0]=1 61 B3R0.1 CCCBr 1100-9-37 [1,0,0,0,0,0|1,0,1]=3 62 B3R0.1 CCCC 1100-1-X0 [1,0,0,0,0,0|1,0,1]=3 63 B3R0.1 CCCCl 1100-5-01 [1,0,0,0,0,0|1,0,1]=3 64 B3R0.1 CCCI 1100-H-X9 [1,0,0,0,0,0|1,0,1]=3 65 B3R0.1 CCNN 3139-5-05 [1,0,0,0,0,0|2,0,0]=3 66 B3R0.1 CNOC 4147-5-01 [1,0,0,0,0,0|3,0,0]=4 67 B3R0.1 COCBr 2107-9-01 [1,0,0,0,0,0|2,0,1]=4 68 B3R0.1 C\C=C/C 1300-1-29 [1,0,0,0,0,0|1,0,1]=3 69 B3R0.1 C\C=C\C 1300-1-04 [1,0,0,0,0,0|1,0,1]=3 70 B3R0.1 C\C=C\Cl 1300-5-17 [1,0,0,0,0,0|1,0,1]=3 71 B3R0.1 C\C=C\Cl 1300-5-E1 [1,0,0,0,0,0|1,0,1]=3 72 B3R0.1 ClCCCl 1100-5-15 [1,0,0,0,0,0|2,0,1]=4 73 B3R0.1 ClCCI 1100-M-00 [1,0,0,0,0,0|2,0,1]=4 74 B3R0.1 Cl\C=C\Cl 1300-5-13 [1,0,0,0,0,0|2,0,1]=4 75 B3R0.1 FCCCl 1100-7-05 [1,0,0,0,0,0|2,0,1]=4 76 B3R0.1 FCCI 1100-K-18 [1,0,0,0,0,0|2,0,1]=4 77 B3R0.1 N#CCBr 3137-9-02 [1,0,0,0,0,0|2,0,1]=4 78 B3R0.1 NCCBr 3130-9-X1 [1,0,0,0,0,0|2,0,1]=4 79 B3R0.1 NCCCl 3130-5-01 [1,0,0,0,0,0|2,0,1]=4 80 B3R0.1 NCCF 3130-7-04 [1,0,0,0,0,0|2,0,1]=4 81 B3R0.1 NCCS 7161-5-01 [1,0,0,0,0,0|1,1,1]=4 82 B3R0.1 OCCBr 2101-9-02 [1,0,0,0,0,0|1,0,2]=4 83 B3R0.2 BrC(Br)Br 1100-9-03 [1,0,0,0,0,0|3,0,0]=4 84 B3R0.2 C=C(C)C 1300-1-06 [1,0,0,0,0,0|0,0,1]=2 85 B3R0.2 C=C(C)Cl 1300-5-21 [1,0,0,0,0,0|1,0,1]=3 86 B3R0.2 C=C(Cl)Cl 1300-5-11 [1,0,0,0,0,0|2,0,1]=4 87 B3R0.2 C=C(F)Cl 1300-7-03 [1,0,0,0,0,0|2,0,1]=4 88 B3R0.2 CB(O)O 6160-1-X6 [1,0,0,0,0,0|2,0,1]=4 89 B3R0.2 CC(=O)Cl 2116-5-01 [1,0,0,0,0,0|1,0,1]=3 90 B3R0.2 CC(=O)O 4141-1-X0 [1,0,0,0,0,0|1,0,1]=3 91 B3R0.2 CC(=O)[O-] 2122-1-02 [1,0,0,0,0,0|1,0,1]=3 92 B3R0.2 CC(=O)[O-] 2122-1-19 [1,0,0,0,0,0|1,0,1]=3 93 B3R0.2 CC(=O)[O-] 2122-1-29 [1,0,0,0,0,0|1,0,1]=3 94 B3R0.2 CC(=O)[O-] 2122-1-46 [1,0,0,0,0,0|1,0,1]=3 95 B3R0.2 CC(=O)[O-] 2122-1-46H [1,0,0,0,0,0|1,0,1]=3 96 B3R0.2 CC(=O)[O-] M029-1-01 [1,0,0,0,0,0|1,0,1]=3 97 B3R0.2 CC(=O)[O-] M056-1-X0 [1,0,0,0,0,0|1,0,1]=3 98 B3R0.2 CC(=O)[S-] 6161-1-05 [1,0,0,0,0,0|1,0,1]=3 99 B3R0.2 CC(C)Br 1100-9-02 [1,0,0,0,0,0|1,0,0]=2 100 B3R0.2 CC(C)C 1100-1-19 [1,0,0,0,0,0|0,0,1]=2 101 B3R0.2 CC(C)I 1100-H-03 [1,0,0,0,0,0|1,0,0]=2 102 B3R0.2 CC(C)N 3130-5-X1 [1,0,0,0,0,0|1,0,0]=2 103 B3R0.2 CC(Cl)Cl 1100-5-12 [1,0,0,0,0,0|2,0,0]=3 104 B3R0.2 CC(F)Br 1100-B-20 [1,0,0,0,0,0|2,0,0]=3 105 B3R0.2 CC(F)Cl 1100-7-04SM [1,0,0,0,0,0|2,0,0]=3 106 B3R0.2 CC(F)F 1100-3-05 [1,0,0,0,0,0|2,0,0]=3 107 B3R0.2 CC(N)=S 7167-1-X0 [1,0,0,0,0,0|1,1,1]=4 108 B3R0.2 CN(C)C 3132-1-05 [1,0,0,0,0,0|1,0,1]=3 109 B3R0.2 CN(C)C 8132-1-X0 [1,0,0,0,0,0|1,0,1]=3 110 B3R0.2 CS(=O)[O-] 6165-1-X0 [1,0,0,0,0,0|2,0,0]=3 111 B3R0.2 C[S+](C)C 5171-H-01 [1,0,0,0,0,0|1,0,1]=3 112 B3R0.2 FC(F)Br 1100-B-01 [1,0,0,0,0,0|3,0,0]=4 113 B3R0.2 FC(F)Cl 1100-7-03 [1,0,0,0,0,0|3,0,0]=4 114 B3R0.2 FC(F)I 1100-K-99 [1,0,0,0,0,0|3,0,0]=4 115 B3R0.2 NC(N)=O 4153-1-01 [1,0,0,0,0,0|2,0,1]=4 116 B3R0.2 O=C([O-])[O-] M019-0-02 [1,0,0,0,0,0|2,0,1]=4 117 B3R0.2 O=C([O-])[O-] M021-1-04 [1,0,0,0,0,0|2,0,1]=4 118 B3R0.2 O=S([O-])O M011-1-06 [1,0,0,0,0,0|3,0,0]=4 119 B3R0.2 O=S([O-])O M011-1-06HP [1,0,0,0,0,0|3,0,0]=4 120 B3R0.2 O=S([O-])[O-] M019-0-01 [1,0,0,0,0,0|3,0,0]=4 121 B3R0.2 O=[N+]([O-])[O-] M020-1-X0 [1,0,0,0,0,0|3,0,0]=4 122 B3R0.2 O=[N+]([O-])[O-] M021-1-05 [1,0,0,0,0,0|3,0,0]=4 123 B3R0.2 O=[N+]([O-])[O-] M057-1-01 [1,0,0,0,0,0|3,0,0]=4 124 B5R0.1 C=CCC(C)O 2302-1-00 [0,1,0,0,0,0|2,0,0]=3 125 B5R0.1 C=COC(C)=O 2324-1-50 [0,1,0,0,0,0|2,0,1]=4 126 B5R0.1 CC(C)=CCBr 1300-9-X0 [0,1,0,0,0,0|1,0,1]=3 127 B5R0.1 CC(C)=CCCl 1300-5-X0 [0,1,0,0,0,0|1,0,1]=3 128 B5R0.1 CC(C)CCI 1100-H-X4 [0,1,0,0,0,0|1,0,1]=3 129 B5R0.1 CC(C)CCN 3130-1-X4 [0,1,0,0,0,0|1,0,1]=3 130 B5R0.1 CC(C)CCO 2101-1-53 [0,1,0,0,0,0|0,0,2]=3 131 B5R0.1 CC(C)CNN 3139-5-X0 [0,1,0,0,0,0|1,0,1]=3 132 B5R0.1 CC(C)N=C=S 7168-1-X2 [0,1,0,0,0,0|0,1,1]=3 133 B5R0.1 CC(N)CCO 4156-1-4D [0,1,0,0,0,0|1,0,2]=4 134 B5R0.1 CCCC(C)C 1100-1-04 [0,1,0,0,0,0|1,0,1]=3 135 B5R0.1 CCCC(C)O 2102-1-52 [0,1,0,0,0,0|2,0,1]=4 136 B5R0.1 CN(C)CC#N 3137-1-03 [0,1,0,0,0,0|2,0,1]=4 137 B5R0.1 CN(C)CCN 3132-1-X2 [0,1,0,0,0,0|2,0,1]=4 138 B5R0.1 C[C@@H](N)CCO 4156-1-RB [0,1,0,0,0,0|1,0,2]=4 139 B5R0.1 C[C@@H](O)CCO 2101-1-X0 [0,1,0,0,0,0|1,0,2]=4 140 B5R0.3 C#CC(O)CC 2502-1-02 [0,1,0,0,0,0|2,0,1]=4 141 B5R0.3 CCC(C)C=O 2115-1-0C [0,1,0,0,0,0|0,0,0]=1 142 B5R0.3 CCC(C)CN 3130-1-X5 [0,1,0,0,0,0|1,0,1]=3 143 B5R0.3 CCC(N)CC 3130-1-14 [0,1,0,0,0,0|2,0,1]=4 144 B5R0.3 CCC(N)CO 4156-1-38 [0,1,0,0,0,0|1,0,2]=4 145 B5R0.3 CCC(O)CN 4156-1-Z4 [0,1,0,0,0,0|2,0,1]=4 146 B5R0.3 CC[C@@H](N)CO 4156-1-R4 [0,1,0,0,0,0|1,0,2]=4 147 B5R0.3 CC[C@H](N)CO 4156-1-W2 [0,1,0,0,0,0|1,0,2]=4 148 B5R0.3 C\C(C=O)=C/N 4356-1-X1 [0,1,0,0,0,0|0,0,2]=3 149 B5R0.3 ClCC(Br)CBr 1100-D-12 [0,1,0,0,0,0|2,0,1]=4 150 B5R0.3 ClCC(Cl)CCl 1100-5-10 [0,1,0,0,0,0|2,0,1]=4 151 B5R0.3 FCC(Br)CBr 1100-B-28 [0,1,0,0,0,0|2,0,1]=4 152 B5R0.3 NC(CO)CO 4104-1-X0 [0,1,0,0,0,0|1,0,2]=4 153 B5R0.3 NCC(O)CN 4156-1-Y7 [0,1,0,0,0,0|2,0,1]=4 154 B5R0.3 NCC(O)CO 4156-1-Z8 [0,1,0,0,0,0|1,0,2]=4 155 B5R0.3 O=CC(Br)C=O 2115-9-02 [0,1,0,0,0,0|1,0,1]=3 156 B5R0.3 OC(CBr)CBr 2101-9-X1 [0,1,0,0,0,0|2,0,1]=4 157 B5R0.3 OC(CCl)CCl 2102-5-13 [0,1,0,0,0,0|2,0,1]=4 158 B5R0.3 OC(CF)CCl 2102-7-02 [0,1,0,0,0,0|2,0,1]=4 159 B5R0.3 OC(CF)CF 2102-3-13 [0,1,0,0,0,0|2,0,1]=4 160 B5R0.3 OCC(O)CBr 2104-9-01 [0,1,0,0,0,0|1,0,2]=4 161 B5R0.3 OCC(O)CS 6161-1-X4 [0,1,0,0,0,0|1,0,2]=4 162 B5R0.4 C#CC(C)(C)C 1500-1-00 [0,1,0,0,0,0|1,0,1]=3 163 B5R0.4 C#CC(C)(C)N 3530-1-01 [0,1,0,0,0,0|1,0,1]=3 164 B5R0.4 C#C[Si](C)(C)C P911-A-12 [0,1,0,0,0,0|1,1,1]=4 165 B5R0.4 C=CC(Cl)(Cl)Cl 1300-5-02 [0,1,0,0,0,0|3,0,0]=4 166 B5R0.4 C=CC(F)(F)Br 1300-B-06 [0,1,0,0,0,0|3,0,0]=4 167 B5R0.4 C=CC(F)(F)F 1300-3-08 [0,1,0,0,0,0|3,0,0]=4 168 B5R0.4 CC(C)(C)C#N 3137-1-Y1 [0,1,0,0,0,0|1,0,1]=3 169 B5R0.4 CC(C)(C)C=O 2115-1-X3 [0,1,0,0,0,0|0,0,0]=1 170 B5R0.4 CC(C)(C)CCl 1100-5-20 [0,1,0,0,0,0|1,0,1]=3 171 B5R0.4 CC(C)(C)CO 2101-1-08 [0,1,0,0,0,0|0,0,2]=3 172 B5R0.4 CC(C)(C)NN 3139-5-01 [0,1,0,0,0,0|2,0,0]=3 173 B5R0.4 CC(C)(C)NO 4147-5-X0 [0,1,0,0,0,0|1,0,1]=3 174 B5R0.4 CC(C)(Cl)CCl 1100-5-18 [0,1,0,0,0,0|1,0,1]=3 175 B5R0.4 CC(C)(F)CO 2101-3-97 [0,1,0,0,0,0|0,0,2]=3 176 B5R0.4 CC(C)(N)C#N 3137-5-02 [0,1,0,0,0,0|1,0,1]=3 177 B5R0.4 CC(C)(N)CO 4156-1-X8 [0,1,0,0,0,0|0,0,2]=3 178 B5R0.4 CC(C)(O)CN 4156-1-05 [0,1,0,0,0,0|1,0,1]=3 179 B5R0.4 CC(C)(O)CO 2104-1-09 [0,1,0,0,0,0|0,0,2]=3 180 B5R0.4 CC(F)(Cl)CCl 1100-7-49 [0,1,0,0,0,0|2,0,1]=4 181 B5R0.4 CC(F)(F)CCl 1100-7-64 [0,1,0,0,0,0|2,0,1]=4 182 B5R0.4 CC(F)(F)CN 3130-7-22 [0,1,0,0,0,0|2,0,1]=4 183 B5R0.4 CC(F)(F)CO 2101-3-52 [0,1,0,0,0,0|1,0,2]=4 184 B5R0.4 CCC(C)(C)C 1100-1-32 [0,1,0,0,0,0|1,0,1]=3 185 B5R0.4 CCC(C)(F)F 1100-3-98 [0,1,0,0,0,0|2,0,1]=4 186 B5R0.4 CNC(C)(C)C 3131-1-X1 [0,1,0,0,0,0|2,0,0]=3 187 B5R0.4 C[Si](C)(C)C#N 7190-1-01 [0,1,0,0,0,0|1,1,1]=4 188 B5R0.4 C[Si](C)(C)CCl 5181-5-25 [0,1,0,0,0,0|1,1,1]=4 189 B5R0.5 C=C(C)C(C)C 1300-1-24 [0,1,0,0,0,0|1,0,0]=2 190 B5R0.5 C=C(F)C(=O)O 2321-3-06 [0,1,0,0,0,0|1,0,2]=4 191 B5R0.5 CC(=O)C(=O)O 2129-1-03 [0,1,0,0,0,0|1,0,1]=3 192 B5R0.5 CC(=O)C(C)=O 2118-1-05 [0,1,0,0,0,0|1,0,1]=3 193 B5R0.5 CC(=O)C(C)C 2117-1-13 [0,1,0,0,0,0|0,0,0]=1 194 B5R0.5 CC(=O)C(C)F 2117-3-11 [0,1,0,0,0,0|1,0,0]=2 195 B5R0.5 CC(=O)C(F)F 2117-3-13 [0,1,0,0,0,0|2,0,0]=3 196 B5R0.5 CC(=O)N(C)C 4148-1-08 [0,1,0,0,0,0|1,0,0]=2 197 B5R0.5 CC(Br)C(N)=O 4157-9-X1 [0,1,0,0,0,0|1,0,0]=2 198 B5R0.5 CC(C)=C(C)C 1300-1-X1 [0,1,0,0,0,0|1,0,1]=3 199 B5R0.5 CC(C)B(O)O 6160-1-X0 [0,1,0,0,0,0|1,0,1]=3 200 B5R0.5 CC(C)C(=N)N 3141-5-X0 [0,1,0,0,0,0|1,0,0]=2 201 B5R0.5 CC(C)C(=O)Cl 2116-5-05 [0,1,0,0,0,0|0,0,0]=1 202 B5R0.5 CC(Cl)C(Cl)Cl 1100-5-31 [0,1,0,0,0,0|2,0,1]=4 203 B5R0.5 CC(F)C(=O)O 2121-3-95 [0,1,0,0,0,0|1,0,0]=2 204 B5R0.5 CC(N)C(N)=O 4158-5-X5 [0,1,0,0,0,0|1,0,0]=2 205 B5R0.5 CC(O)C(C)O 2104-1-07 [0,1,0,0,0,0|1,0,2]=4 206 B5R0.5 CN(C)C(=N)N 3141-5-00 [0,1,0,0,0,0|2,0,0]=3 207 B5R0.5 CN(C)C(=S)Cl P911-A-76 [0,1,0,0,0,0|1,1,0]=3 208 B5R0.5 CN(C)C(=S)[S-] 5167-1-01 [0,1,0,0,0,0|1,1,0]=3 209 B5R0.5 C[C@@H](Cl)C(=O)O 2121-5-R1 [0,1,0,0,0,0|1,0,0]=2 210 B5R0.5 C[C@@H](O)C(N)=O 4148-1-R1 [0,1,0,0,0,0|1,0,0]=2 211 B5R0.5 C[C@@H](O)[C@@H](C)O 2104-1-R1 [0,1,0,0,0,0|1,0,2]=4 212 B5R0.5 C[C@H](N)C(=O)O 4157-1-S5 [0,1,0,0,0,0|1,0,0]=2 213 B5R0.5 C[C@H](N)C(N)=O 4148-5-04 [0,1,0,0,0,0|1,0,0]=2 214 B5R0.5 C[C@H](O)C(=O)O 2129-1-S8 [0,1,0,0,0,0|1,0,0]=2 215 B5R0.5 C[C@H](O)[C@H](C)O 2104-1-X2 [0,1,0,0,0,0|1,0,2]=4 216 B5R0.5 NC(=O)C(Cl)Cl 4148-5-X4 [0,1,0,0,0,0|2,0,0]=3 217 B5R0.5 NC(=O)C(F)Br 4148-B-02 [0,1,0,0,0,0|2,0,0]=3 218 B5R0.5 NC(=O)C(F)Cl 4148-7-03 [0,1,0,0,0,0|2,0,0]=3 219 B5R0.5 NC(=O)C(F)F 4148-3-18 [0,1,0,0,0,0|2,0,0]=3 220 B5R0.5 NC(=O)C(F)I 4148-K-01 [0,1,0,0,0,0|2,0,0]=3 221 B5R0.5 NC(=O)C(N)=O 4148-1-18 [0,1,0,0,0,0|2,0,1]=4 222 B5R0.5 O=C(Cl)C(=O)Cl 2116-4-02 [0,1,0,0,0,0|2,0,1]=4 223 B5R0.5 O=C(Cl)C(Cl)Cl 2116-5-00 [0,1,0,0,0,0|2,0,0]=3 224 B5R0.5 O=C(O)C(=O)O 2121-1-12 [0,1,0,0,0,0|2,0,1]=4 225 B5R0.5 O=C(O)C(F)Br 2121-B-03 [0,1,0,0,0,0|2,0,0]=3 226 B5R0.5 O=C(O)C(F)Cl 2121-7-03 [0,1,0,0,0,0|2,0,0]=3 227 B5R0.5 O=C(O)C(F)F 2121-3-05 [0,1,0,0,0,0|2,0,0]=3 228 B5R0.5 O=C(O)C(F)I 2121-K-01 [0,1,0,0,0,0|2,0,0]=3 229 B5R0.5 O=C([O-])C(=O)[O-] 2122-0-00 [0,1,0,0,0,0|2,0,1]=4 230 B5R0.5 O=C([O-])C(=O)[O-] 2122-1-06 [0,1,0,0,0,0|2,0,1]=4 231 B5R0.5 O=C([O-])C(=O)[O-] M068-1-X0 [0,1,0,0,0,0|2,0,1]=4 232 B5R0.5 O=C([O-])C(=O)[O-] M068-1-X1 [0,1,0,0,0,0|2,0,1]=4 233 B5R0.5 O=C([O-])C(F)Br 2122-B-01 [0,1,0,0,0,0|2,0,0]=3 234 B5R0.5 O=C([O-])C(F)Cl 2122-7-01 [0,1,0,0,0,0|2,0,0]=3 235 B5R0.5 O=C([O-])C(F)F 2122-3-02 [0,1,0,0,0,0|2,0,0]=3 236 B5R0.5 O=C([O-])C(F)F 2122-3-07 [0,1,0,0,0,0|2,0,0]=3 237 B5R0.5 [C@@H](C)(Cl)C(=O)O 2121-5-S1 [0,1,0,0,0,0|1,0,0]=2 238 B5R1.2 BrC1CCC1 1200-9-17 [0,0,0,1,0,0|2,0,1]=4 239 B5R1.2 BrC1COC1 2H10-9-07 [0,0,0,1,0,0|1,0,2]=4 240 B5R1.2 FC1CNC1 3231-7-01 [0,0,0,1,0,0|2,0,1]=4 241 B5R1.2 IC1COC1 2H10-H-05 [0,0,0,1,0,0|1,0,2]=4 242 B5R1.2 NC1CCC1 3230-1-X4 [0,0,0,1,0,0|2,0,1]=4 243 B5R1.2 NC1CNC1 3H30-5-38 [0,0,0,1,0,0|2,0,1]=4 244 B5R1.2 OC1CNC1 4H01-5-63 [0,0,0,1,0,0|2,0,1]=4 245 B5R1.2 OC1COC1 2H01-1-X3 [0,0,0,1,0,0|1,0,2]=4 246 B5R1.3 BrCC1CC1 1200-9-X0 [0,0,0,1,0,0|1,0,1]=3 247 B5R1.3 C#CC1CC1 1500-1-04 [0,0,0,1,0,0|1,0,1]=3 248 B5R1.3 C=CC1CO1 2309-1-02 [0,0,0,1,0,0|2,0,0]=3 249 B5R1.3 CNC1CC1 3231-5-04 [0,0,0,1,0,0|2,0,0]=3 250 B5R1.3 ClCC1CC1 1200-5-01 [0,0,0,1,0,0|1,0,1]=3 251 B5R1.3 ClCC1CO1 2109-5-01 [0,0,0,1,0,0|2,0,1]=4 252 B5R1.3 ClC[C@@H]1CO1 2109-5-X0 [0,0,0,1,0,0|2,0,1]=4 253 B5R1.3 ClC[C@H]1CO1 2109-5-X1 [0,0,0,1,0,0|2,0,1]=4 254 B5R1.3 FCC1CO1 2109-3-20 [0,0,0,1,0,0|2,0,1]=4 255 B5R1.3 ICC1CC1 1200-H-04 [0,0,0,1,0,0|1,0,1]=3 256 B5R1.3 N#CC1CC1 3237-1-Y6 [0,0,0,1,0,0|1,0,1]=3 257 B5R1.3 NCC1CC1 P911-A-36 [0,0,0,1,0,0|1,0,1]=3 258 B5R1.3 O=CC1CC1 2215-1-X2 [0,0,0,1,0,0|0,0,0]=1 259 B5R1.3 OCC1CC1 2301-1-X2 [0,0,0,1,0,0|0,0,2]=3 260 B5R1.3 OC[C@@H]1CO1 2109-1-R2 [0,0,0,1,0,0|1,0,2]=4 261 B5R1.3 OC[C@H]1CO1 2109-1-S1 [0,0,0,1,0,0|1,0,2]=4 262 B5R1.4 C[C@@H]1O[C@@H]1C 2109-1-Z0 [0,0,0,1,0,0|2,0,1]=4 263 B5R1.4 C[C@@H]1O[C@H]1C 2109-1-E0 [0,0,0,1,0,0|2,0,1]=4 264 B5R1.5 CC1(C)CO1 2109-1-03 [0,0,0,1,0,0|0,0,2]=3 265 B5R1.5 CC1(N)CC1 3230-5-01 [0,0,0,1,0,0|2,0,1]=4 266 B2R0.1 C#CC 1500-1-01 [2,0,0,0,0,0|0,0,2]=4 267 B2R0.1 C=CBr 1300-9-01 [2,0,0,0,0,0|1,0,1]=4 268 B2R0.1 C=CBr 1300-9-01ST [2,0,0,0,0,0|1,0,1]=4 269 B2R0.1 C=CC 1300-1-02 [2,0,0,0,0,0|0,0,1]=3 270 B2R0.1 CCBr 1100-9-04 [2,0,0,0,0,0|1,0,0]=3 271 B2R0.1 CCI 1100-H-10 [2,0,0,0,0,0|1,0,0]=3 272 B2R0.1 CCN 3130-1-10 [2,0,0,0,0,0|1,0,0]=3 273 B2R0.1 CC[O-] 9122-1-X0 [2,0,0,0,0,0|0,0,1]=3 274 B2R0.1 CNC 3131-1-X3 [2,0,0,0,0,0|1,0,0]=3 275 B2R0.1 CNO 4156-5-10 [2,0,0,0,0,0|1,0,1]=4 276 B2R0.1 COC 2107-1-01 [2,0,0,0,0,0|1,0,0]=3 277 B2R0.1 CON 4147-5-X3 [2,0,0,0,0,0|2,0,0]=4 278 B2R0.1 ClCBr 1100-D-01 [2,0,0,0,0,0|2,0,0]=4 279 B2R0.1 ClCCl 1100-5-02 [2,0,0,0,0,0|2,0,0]=4 280 B2R0.1 ClCI 1100-L-02 [2,0,0,0,0,0|2,0,0]=4 281 B2R0.1 FCF 1100-3-02 [2,0,0,0,0,0|2,0,0]=4 282 B2R0.1 ICI 1100-H-02 [2,0,0,0,0,0|2,0,0]=4 283 B2R0.1 O=C[O-] 2122-1-07 [2,0,0,0,0,0|1,0,0]=3 284 B2R0.1 O=C[O-] 9130-1-00 [2,0,0,0,0,0|1,0,0]=3 285 B2R0.1 O=[Si]=O SI24001A [2,0,0,0,0,0|1,1,0]=4 286 B4R0.2 BrCCCBr 1100-9-13 [1,1,0,0,0,0|1,0,1]=4 287 B4R0.2 C#CCCC 1500-1-X1 [1,1,0,0,0,0|1,0,1]=4 288 B4R0.2 C#CCCO P311-A-35 [1,1,0,0,0,0|1,0,1]=4 289 B4R0.2 C#COCC 2507-1-01 [1,1,0,0,0,0|1,0,1]=4 290 B4R0.2 C=CCCBr 1300-9-04 [1,1,0,0,0,0|1,0,0]=3 291 B4R0.2 C=CCCC 1300-1-09 [1,1,0,0,0,0|1,0,0]=3 292 B4R0.2 CCCC#N 3137-1-Y3 [1,1,0,0,0,0|1,0,1]=4 293 B4R0.2 CCCCBr 1100-9-15 [1,1,0,0,0,0|1,0,1]=4 294 B4R0.2 CCCCF 1100-3-32 [1,1,0,0,0,0|1,0,1]=4 295 B4R0.2 CCNCC 3133-5-06 [1,1,0,0,0,0|1,0,1]=4 296 B4R0.2 CCOCC 6160-3-09 [1,1,0,0,0,0|1,0,1]=4 297 B4R0.2 CCOCCl 2107-5-01 [1,1,0,0,0,0|1,0,1]=4 298 B4R0.2 CNCCCl 3133-5-05 [1,1,0,0,0,0|1,0,1]=4 299 B4R0.2 CNCCN 3131-1-11 [1,1,0,0,0,0|1,0,1]=4 300 B4R0.2 CNCCO 4156-1-3Y [1,1,0,0,0,0|0,0,2]=4 301 B4R0.2 COCC#N 4137-1-Y6 [1,1,0,0,0,0|1,0,1]=4 302 B4R0.2 COCCBr 2107-9-X1 [1,1,0,0,0,0|1,0,1]=4 303 B4R0.2 COCCCl 2107-5-0R [1,1,0,0,0,0|1,0,1]=4 304 B4R0.2 COCCN 4130-1-X3 [1,1,0,0,0,0|1,0,1]=4 305 B4R0.2 COCOC 2108-1-07 [1,1,0,0,0,0|2,0,0]=4 306 B4R0.2 CSCCN 7166-1-X1 [1,1,0,0,0,0|1,0,1]=4 307 B4R0.2 C\C=C\CC 1300-1-05 [1,1,0,0,0,0|1,0,0]=3 308 B4R0.2 ClCCCCl 1100-5-19 [1,1,0,0,0,0|1,0,1]=4 309 B4R0.2 ClCCCI 1100-M-01 [1,1,0,0,0,0|1,0,1]=4 310 B4R0.2 Cl\C=C\CCl 1300-5-28 [1,1,0,0,0,0|1,0,1]=4 311 B4R0.2 FCCCF 1100-3-16 [1,1,0,0,0,0|1,0,1]=4 312 B4R0.2 FCCCI 1100-K-35 [1,1,0,0,0,0|1,0,1]=4 313 B4R0.2 ICCCI 1100-H-X0 [1,1,0,0,0,0|1,0,1]=4 314 B4R0.2 N#CCCO 4137-1-Y3 [1,1,0,0,0,0|1,0,1]=4 315 B4R0.2 NCCCBr 3130-9-X0 [1,1,0,0,0,0|1,0,1]=4 316 B4R0.2 NCCCCl 3130-5-03 [1,1,0,0,0,0|1,0,1]=4 317 B4R0.2 NCCCF 3130-7-13 [1,1,0,0,0,0|1,0,1]=4 318 B4R0.2 NNCCO 4139-1-01 [1,1,0,0,0,0|2,0,0]=4 319 B4R0.2 OCCCBr 2101-9-X2 [1,1,0,0,0,0|0,0,2]=4 320 B4R0.2 OCCCCl 2101-5-13 [1,1,0,0,0,0|0,0,2]=4 321 B4R0.2 OCCCF 2101-3-50 [1,1,0,0,0,0|0,0,2]=4 322 B4R0.2 OCCCI 2101-H-01 [1,1,0,0,0,0|0,0,2]=4 323 B4R0.2 OCCCO 2104-1-11 [1,1,0,0,0,0|0,0,2]=4 324 B4R0.3 CC(C)(Br)Br 1100-9-X2 [1,1,0,0,0,0|1,0,0]=3 325 B4R0.3 CC(C)(C)Br 1100-9-X3 [1,1,0,0,0,0|0,0,1]=3 326 B4R0.3 CC(C)(C)C 1100-1-01 [1,1,0,0,0,0|0,0,1]=3 327 B4R0.3 CC(C)(C)Cl 1100-5-22 [1,1,0,0,0,0|0,0,1]=3 328 B4R0.3 CC(C)(C)I 1100-H-18 [1,1,0,0,0,0|0,0,1]=3 329 B4R0.3 CC(C)(C)O 2103-1-01 [1,1,0,0,0,0|0,0,1]=3 330 B4R0.3 CC(C)(C)[O-] 2105-1-05 [1,1,0,0,0,0|0,0,1]=3 331 B4R0.3 CC(C)(Cl)Cl 1100-5-07 [1,1,0,0,0,0|1,0,0]=3 332 B4R0.3 CC(C)(F)F 1100-3-17 [1,1,0,0,0,0|1,0,0]=3 333 B4R0.3 CC(F)(Cl)Cl 1100-7-21 [1,1,0,0,0,0|2,0,0]=4 334 B4R0.3 CC(F)(F)Cl 1100-7-19 [1,1,0,0,0,0|2,0,0]=4 335 B4R0.3 CC(F)(F)F 1100-3-07 [1,1,0,0,0,0|2,0,0]=4 336 B4R0.3 CS(=O)(=O)Cl 6162-5-01 [1,1,0,0,0,0|2,0,0]=4 337 B4R0.3 CS(=O)(=O)F 6162-3-01 [1,1,0,0,0,0|2,0,0]=4 338 B4R0.3 CS(=O)(=O)O 6164-1-17 [1,1,0,0,0,0|2,0,0]=4 339 B4R0.3 CS(C)(=N)=O 8169-1-04 [1,1,0,0,0,0|1,0,0]=3 340 B4R0.3 CS(N)(=O)=O 8169-1-X1 [1,1,0,0,0,0|2,0,0]=4 341 B4R0.3 C[N+](C)(C)C 3133-3-02 [1,1,0,0,0,0|1,0,1]=4 342 B4R0.3 C[N+](C)(C)C 3133-3-10 [1,1,0,0,0,0|1,0,1]=4 343 B4R0.3 C[N+](C)(C)C 3133-3-15 [1,1,0,0,0,0|1,0,1]=4 344 B4R0.3 C[N+](C)(C)C 3133-5-01 [1,1,0,0,0,0|1,0,1]=4 345 B4R0.3 C[N+](C)(C)C 4133-1-00SW [1,1,0,0,0,0|1,0,1]=4 346 B4R0.3 C[N+](C)(C)C 7133-3-44 [1,1,0,0,0,0|1,0,1]=4 347 B4R0.3 C[S+](C)(C)=O 6165-5-00 [1,1,0,0,0,0|1,0,0]=3 348 B4R0.3 C[S+](C)(C)=O 6165-H-X0 [1,1,0,0,0,0|1,0,0]=3 349 B4R0.3 C[Si](C)(C)Br 5181-9-01 [1,1,0,0,0,0|0,1,1]=4 350 B4R0.3 C[Si](C)(C)C 5180-1-10 [1,1,0,0,0,0|0,1,1]=4 351 B4R0.3 C[Si](C)(C)Cl 5181-5-01 [1,1,0,0,0,0|0,1,1]=4 352 B4R0.3 C[Si](C)(C)F 5181-3-03 [1,1,0,0,0,0|0,1,1]=4 353 B4R0.3 C[Si](C)(C)I 5181-H-X0 [1,1,0,0,0,0|0,1,1]=4 354 B4R0.3 C[Si](C)(C)O 6182-1-X0 [1,1,0,0,0,0|0,1,1]=4 355 B4R0.3 C[Si](C)(Cl)Cl 5181-5-02 [1,1,0,0,0,0|1,1,0]=4 356 B4R0.3 C[Si](C)(F)F 5181-3-02 [1,1,0,0,0,0|1,1,0]=4 357 B6R0.1 CCC(C)N=C=S 7168-1-02 [0,2,0,0,0,0|0,1,1]=4 358 B6R0.1 CCCC(C)CCl 1100-5-0A [0,2,0,0,0,0|1,0,1]=4 359 B6R0.1 CCOC(=O)C=O 2323-1-X0 [0,2,0,0,0,0|1,0,1]=4 360 B6R0.2 CC(=O)CC(C)=O 2118-1-01 [0,2,0,0,0,0|1,0,1]=4 361 B6R0.2 CC(=O)CC(C)C 2118-1-02 [0,2,0,0,0,0|0,0,0]=2 362 B6R0.2 CC(=O)\C=C(\C)N 4356-1-06 [0,2,0,0,0,0|1,0,1]=4 363 B6R0.2 CC(=O)\C=C(\C)[O-] 9128-1-X0 [0,2,0,0,0,0|1,0,1]=4 364 B6R0.2 CC(C)=CB(O)O 6360-1-X3 [0,2,0,0,0,0|0,0,2]=4 365 B6R0.2 CC(C)=CC(=O)O 2321-1-X4 [0,2,0,0,0,0|0,0,1]=3 366 B6R0.2 CC(C)CB(O)O 6160-1-X3 [0,2,0,0,0,0|0,0,2]=4 367 B6R0.2 CC(C)CC(N)=O 4148-1-Y7 [0,2,0,0,0,0|0,0,0]=2 368 B6R0.2 CC(C)NC(C)C 3135-5-00 [0,2,0,0,0,0|1,0,1]=4 369 B6R0.2 CC(C)NC(C)C 4133-5-01 [0,2,0,0,0,0|1,0,1]=4 370 B6R0.2 CC(C)NC(N)=S 7167-1-18 [0,2,0,0,0,0|0,1,0]=3 371 B6R0.2 CC(C)OP(Cl)Cl 6174-5-00 [0,2,0,0,0,0|2,0,0]=4 372 B6R0.2 CC(Cl)OC(=O)Cl 2116-5-X1 [0,2,0,0,0,0|1,0,0]=3 373 B6R0.2 CC(O)CC(=O)[O-] 2129-1-35 [0,2,0,0,0,0|1,0,0]=3 374 B6R0.2 CN(C)CC(=O)O 4158-1-40 [0,2,0,0,0,0|1,0,0]=3 375 B6R0.2 CN(C)CC(N)=S 7167-5-01 [0,2,0,0,0,0|1,1,0]=4 376 B6R0.3 CC(=O)C(=O)CBr 2118-9-01 [0,2,0,0,0,0|1,0,1]=4 377 B6R0.3 CC(C#N)C(=O)O 4137-1-0Z [0,2,0,0,0,0|0,0,1]=3 378 B6R0.3 CC(C)C(=N)NO 4156-1-Z3 [0,2,0,0,0,0|0,0,1]=3 379 B6R0.3 CC(C)C(N)CO 4156-1-88 [0,2,0,0,0,0|0,0,2]=4 380 B6R0.3 CC(C)[C@@H](N)CO 4156-1-R5 [0,2,0,0,0,0|0,0,2]=4 381 B6R0.3 CC(C)[C@H](N)CO 4156-1-S5 [0,2,0,0,0,0|0,0,2]=4 382 B6R0.3 CCC(=O)C(C)C 2117-1-18 [0,2,0,0,0,0|0,0,0]=2 383 B6R0.3 CCC(N)C(=O)O 4157-1-16 [0,2,0,0,0,0|1,0,0]=3 384 B6R0.3 CCN(C)C(=O)Cl 4148-5-18 [0,2,0,0,0,0|1,0,0]=3 385 B6R0.3 CC[C@H](O)C(=O)O 2129-1-SF [0,2,0,0,0,0|1,0,0]=3 386 B6R0.3 CN(C)C(=O)CBr 4148-9-08 [0,2,0,0,0,0|1,0,0]=3 387 B6R0.3 CN(C)C(=S)NN 7167-1-08 [0,2,0,0,0,0|1,1,0]=4 388 B6R0.3 CNC(=O)C(=O)O 4156-1-Y4 [0,2,0,0,0,0|1,0,1]=4 389 B6R0.3 CNC(=O)C(C)N 4148-1-1M [0,2,0,0,0,0|1,0,0]=3 390 B6R0.3 CNC(=O)C(F)Br 4148-B-03 [0,2,0,0,0,0|2,0,0]=4 391 B6R0.3 CNC(=O)C(F)Cl 4148-7-04 [0,2,0,0,0,0|2,0,0]=4 392 B6R0.3 CNC(=O)C(F)I 4148-K-02 [0,2,0,0,0,0|2,0,0]=4 393 B6R0.3 CN[C@@H](C)C(=O)O 4157-1-07 [0,2,0,0,0,0|0,0,0]=2 394 B6R0.3 COC(=O)C(=O)Cl 2129-5-0K [0,2,0,0,0,0|1,0,1]=4 395 B6R0.3 COC(=O)C(C)Cl 2123-5-05 [0,2,0,0,0,0|1,0,0]=3 396 B6R0.3 COC(=O)C(C)F 2123-3-1X [0,2,0,0,0,0|1,0,0]=3 397 B6R0.3 COC(=O)C(C)O 2129-1-70 [0,2,0,0,0,0|1,0,0]=3 398 B6R0.3 COC(=O)C(F)F 2123-3-02 [0,2,0,0,0,0|2,0,0]=4 399 B6R0.3 COC(=O)[C@H](C)N 4158-5-45 [0,2,0,0,0,0|1,0,0]=3 400 B6R0.3 CON(C)C(C)=O 4148-1-44 [0,2,0,0,0,0|1,0,0]=3 401 B6R0.3 C\C=C(/C)C(=O)O 2321-1-17 [0,2,0,0,0,0|0,0,1]=3 402 B6R0.3 C\C=C(/C)C(=O)O 2321-1-E0 [0,2,0,0,0,0|0,0,1]=3 403 B6R0.3 C\C=C(/C)C(C)=O 2317-1-02 [0,2,0,0,0,0|0,0,1]=3 404 B6R0.3 N#CC(N)C(N)=O 4148-1-X1 [0,2,0,0,0,0|1,0,1]=4 405 B6R0.3 NCC(F)C(=O)O 4157-3-02 [0,2,0,0,0,0|1,0,0]=3 406 B6R0.3 N[C@@H](CS)C(=O)O 8158-1-01 [0,2,0,0,0,0|1,0,0]=3 407 B6R0.3 O=C(O)C(=O)CBr 2129-9-X3 [0,2,0,0,0,0|1,0,1]=4 408 B6R0.3 [C@@H](N)(CC)C(=O)O 4157-1-X5 [0,2,0,0,0,0|1,0,0]=3 409 B6R0.3 [C@H](N)(CC)C(=O)O 4157-1-X4 [0,2,0,0,0,0|1,0,0]=3 410 B6R0.4 C=CCC[C@@H](C)O 2302-1-R1 [0,2,0,0,0,0|2,0,0]=4 411 B6R0.4 CC(C)CN=C=S 7168-1-X1 [0,2,0,0,0,0|0,1,1]=4 412 B6R0.4 CC(C)OCCO 2107-1-0H [0,2,0,0,0,0|0,0,2]=4 413 B6R0.4 CN(C)\C=C\C#N 3337-1-Z0 [0,2,0,0,0,0|2,0,0]=4 414 B6R0.5 C=CC[Si](C)(C)C 5380-1-01 [0,2,0,0,0,0|1,1,0]=4 415 B6R0.5 C=CC[Si](C)(C)Cl 5381-5-03 [0,2,0,0,0,0|1,1,0]=4 416 B6R0.5 CC(C)(C)N=C=S 7168-1-03 [0,2,0,0,0,0|0,1,1]=4 417 B6R0.5 CC(C)(C)ON=O 4145-1-X1 [0,2,0,0,0,0|1,0,0]=3 418 B6R0.8 CC(C)(CN)CN 3130-1-X8 [0,2,0,0,0,0|1,0,1]=4 419 B6R0.8 CC(C)(CO)CO 2104-1-37 [0,2,0,0,0,0|0,0,2]=4 420 B6R0.8 CC(N)(CO)CO 4156-1-0R [0,2,0,0,0,0|0,0,2]=4 421 B6R0.8 COC(C)(C)OC 2108-1-06 [0,2,0,0,0,0|2,0,0]=4 422 B6R0.9 CCC(CC)CN 3130-1-X0 [0,2,0,0,0,0|1,0,1]=4 423 B6R0.9 CCC(CC)NC 3131-5-01 [0,2,0,0,0,0|1,0,1]=4 424 B6R0.9 COC(C=O)OC 2115-1-X1 [0,2,0,0,0,0|0,0,0]=2 425 B6R0.9 COC(CN)OC 4156-1-Z7 [0,2,0,0,0,0|1,0,1]=4 426 B6R0.7 CC(=O)C(C)(C)C 2117-1-05 [0,2,0,0,0,0|0,0,0]=2 427 B6R0.7 CC(=O)C(F)(F)Cl 2117-7-03 [0,2,0,0,0,0|2,0,0]=4 428 B6R0.7 CC(=O)C(F)(F)F 2117-3-01 [0,2,0,0,0,0|2,0,0]=4 429 B6R0.7 CC(=O)C(F)(F)F 2117-3-60 [0,2,0,0,0,0|2,0,0]=4 430 B6R0.7 CC(C)(Br)C(N)=O 4148-9-X0 [0,2,0,0,0,0|0,0,0]=2 431 B6R0.7 CC(C)(C)C(=N)N 4141-5-X0 [0,2,0,0,0,0|1,0,0]=3 432 B6R0.7 CC(C)(C)C(N)=O 4148-1-26 [0,2,0,0,0,0|0,0,0]=2 433 B6R0.7 CC(C)(C)C(N)=S 7169-1-00 [0,2,0,0,0,0|0,1,0]=3 434 B6R0.7 CC(C)(C)S(N)=O 8169-1-01 [0,2,0,0,0,0|1,0,0]=3 435 B6R0.7 CC(C)(C)[S@@](N)=O 8169-1-S2 [0,2,0,0,0,0|1,0,0]=3 436 B6R0.7 CC(C)(C)[S@](N)=O P311-A-51 [0,2,0,0,0,0|1,0,0]=3 437 B6R0.7 CC(C)(F)C(=O)O 2121-3-57 [0,2,0,0,0,0|0,0,0]=2 438 B6R0.7 CC(C)(O)C(=O)O 2129-1-10 [0,2,0,0,0,0|0,0,0]=2 439 B6R0.7 CC(C)[B-](F)(F)F 5160-3-0B [0,2,0,0,0,0|2,0,0]=4 440 B6R0.7 CC(F)(Br)C(=O)O 2121-B-06 [0,2,0,0,0,0|1,0,0]=3 441 B6R0.7 CC(F)(F)C(=O)O 2121-3-52 [0,2,0,0,0,0|1,0,0]=3 442 B6R0.7 CC(F)(F)C(=O)[O-] 2122-3-52 [0,2,0,0,0,0|1,0,0]=3 443 B6R0.7 CC(F)(F)C(N)=O 4148-3-X1 [0,2,0,0,0,0|1,0,0]=3 444 B6R0.7 NC(=O)C(Cl)(Cl)Cl 4148-5-14 [0,2,0,0,0,0|2,0,0]=4 445 B6R0.7 NC(=O)C(F)(Br)Br 4148-B-04 [0,2,0,0,0,0|2,0,0]=4 446 B6R0.7 NC(=O)C(F)(F)Br 4148-B-01 [0,2,0,0,0,0|2,0,0]=4 447 B6R0.7 NC(=O)C(F)(F)F 4148-3-03 [0,2,0,0,0,0|2,0,0]=4 448 B6R0.7 O=C(Br)C(F)(F)Br 2116-B-X1 [0,2,0,0,0,0|2,0,0]=4 449 B6R0.7 O=C(Cl)C(F)(F)Br 2116-E-01 [0,2,0,0,0,0|2,0,0]=4 450 B6R0.7 O=C(Cl)C(F)(F)Cl 2116-6-04 [0,2,0,0,0,0|2,0,0]=4 451 B6R0.7 O=C(F)C(F)(F)I 2116-J-X0 [0,2,0,0,0,0|2,0,0]=4 452 B6R0.7 O=C(O)C(Cl)(Cl)Cl 2121-5-X0 [0,2,0,0,0,0|2,0,0]=4 453 B6R0.7 O=C(O)C(F)(Br)Br 2121-B-01 [0,2,0,0,0,0|2,0,0]=4 454 B6R0.7 O=C(O)C(F)(Cl)Cl 2121-7-07 [0,2,0,0,0,0|2,0,0]=4 455 B6R0.7 O=C(O)C(F)(F)Br 2121-B-02 [0,2,0,0,0,0|2,0,0]=4 456 B6R0.7 O=C(O)C(F)(F)Cl 2121-7-01 [0,2,0,0,0,0|2,0,0]=4 457 B6R0.7 O=C(O)C(F)(F)F 2121-3-01 [0,2,0,0,0,0|2,0,0]=4 458 B6R0.7 O=C(O)C(F)(F)F 2121-3-02 [0,2,0,0,0,0|2,0,0]=4 459 B6R0.7 O=C(O)C(F)(F)F 2121-3-02L [0,2,0,0,0,0|2,0,0]=4 460 B6R0.7 O=C(O)C(F)(F)F 4H33-3-00 [0,2,0,0,0,0|2,0,0]=4 461 B6R0.7 O=C([O-])C(F)(Cl)Cl 2122-6-02 [0,2,0,0,0,0|2,0,0]=4 462 B6R0.7 O=C([O-])C(F)(F)Br 2122-A-01 [0,2,0,0,0,0|2,0,0]=4 463 B6R0.7 O=C([O-])C(F)(F)Br 2122-A-02 [0,2,0,0,0,0|2,0,0]=4 464 B6R0.7 O=C([O-])C(F)(F)Cl 2122-6-01 [0,2,0,0,0,0|2,0,0]=4 465 B6R0.7 O=C([O-])C(F)(F)F 2122-2-01 [0,2,0,0,0,0|2,0,0]=4 466 B6R0.7 O=C([O-])C(F)(F)F 2122-2-02 [0,2,0,0,0,0|2,0,0]=4 467 B6R0.7 O=C([O-])C(F)(F)F 2122-2-03 [0,2,0,0,0,0|2,0,0]=4 468 B6R0.7 O=C([O-])C(F)(F)F 2122-2-04 [0,2,0,0,0,0|2,0,0]=4 469 B6R0.7 O=C([O-])C(F)(F)F 2122-2-X0 [0,2,0,0,0,0|2,0,0]=4 470 B6R0.7 O=C([O-])C(F)(F)F 2122-2-X1 [0,2,0,0,0,0|2,0,0]=4 471 B6R0.7 O=C([O-])C(F)(F)F 2122-2-X3 [0,2,0,0,0,0|2,0,0]=4 472 B6R0.7 O=C([O-])C(F)(F)F 2122-2-X4 [0,2,0,0,0,0|2,0,0]=4 473 B6R0.7 O=C([O-])C(F)(F)F 4122-3-03 [0,2,0,0,0,0|2,0,0]=4 474 B4R1.1 C1CNC1 3H31-5-W1 [1,0,0,1,0,0|1,0,1]=4 475 B4R1.1 C1CNC1 P612-A-70 [1,0,0,1,0,0|1,0,1]=4 476 B4R1.2 BrC1CC1 1200-9-02 [1,0,0,1,0,0|1,0,1]=4 477 B4R1.2 NC1CC1 3230-1-X2 [1,0,0,1,0,0|1,0,1]=4 478 B6R1.2 CC1CCCC1 1200-1-07 [0,1,0,1,0,0|1,0,1]=4 479 B6R1.2 CC1CCCO1 2H10-1-01 [0,1,0,1,0,0|1,0,1]=4 480 B6R1.2 CC1CCNC1 3H31-5-95 [0,1,0,1,0,0|1,0,1]=4 481 B6R1.2 CC1OCCO1 2H08-1-01 [0,1,0,1,0,0|2,0,0]=4 482 B6R1.2 C[C@@H]1CCCN1 3H31-5-3F [0,1,0,1,0,0|1,0,1]=4 483 B6R1.2 C[C@H]1CCCN1 3H31-5-S6 [0,1,0,1,0,0|1,0,1]=4 484 B6R1.2 C[C@H]1CCNC1 3H31-5-S5 [0,1,0,1,0,0|1,0,1]=4 485 B6R1.2 OC1CC=CC1 2402-1-00 [0,1,0,1,0,0|2,0,0]=4 486 B6R1.3 NCCC1CC1 3230-5-07 [0,1,0,1,0,0|1,0,1]=4 487 B6R1.3 OCCC1CC1 2201-1-11 [0,1,0,1,0,0|0,0,2]=4 488 B6R1.3 S=C=NC1CC1 7268-1-X0 [0,1,0,1,0,0|0,1,1]=4 489 B6R1.10 CC1(C)CNC1 3H31-5-96 [0,1,0,1,0,0|1,0,1]=4 490 B6R1.11 CC(=O)C1CC1 2217-1-X9 [0,1,0,1,0,0|0,0,0]=2 491 B6R1.11 CC(N)C1CC1 P911-A-20 [0,1,0,1,0,0|1,0,1]=4 492 B6R1.11 CC(O)C1CC1 2202-1-14 [0,1,0,1,0,0|0,0,2]=4 493 B6R1.11 N=C(N)C1CC1 3241-5-X2 [0,1,0,1,0,0|1,0,0]=3 494 B6R1.11 O=C(Cl)C1CC1 2216-5-X1 [0,1,0,1,0,0|0,0,0]=2 495 B6R1.11 O=C(O)C1CC1 2221-1-X1 [0,1,0,1,0,0|0,0,0]=2 496 B6R1.11 OB(O)C1CC1 P911-A-22 [0,1,0,1,0,0|1,0,1]=4 497 B6R1.6 BrCC1CCC1 1200-9-21 [0,1,0,1,0,0|1,0,1]=4 498 B6R1.6 COC1CNC1 4H07-5-01 [0,1,0,1,0,0|1,0,1]=4 499 B6R1.6 CSC1CNC1 7H66-1-65 [0,1,0,1,0,0|1,0,1]=4 500 B6R1.6 N#CC1CCC1 3237-1-05 [0,1,0,1,0,0|1,0,1]=4 501 B6R1.6 N#CC1CNC1 3H37-5-20 [0,1,0,1,0,0|1,0,1]=4 502 B6R1.6 NCC1CCC1 3230-5-03 [0,1,0,1,0,0|1,0,1]=4 503 B6R1.6 NCC1CNC1 3H30-5-8B [0,1,0,1,0,0|1,0,1]=4 504 B6R1.6 O=CC1CCC1 2215-1-03 [0,1,0,1,0,0|0,0,0]=2 505 B6R1.6 OCC1COC1 2H10-1-44 [0,1,0,1,0,0|0,0,2]=4 506 B6R1.7 CC1(CCl)CO1 2110-5-X1 [0,1,0,1,0,0|0,0,2]=4 507 B6R1.7 N#CC1(N)CC1 3237-5-X0 [0,1,0,1,0,0|1,0,1]=4