0 B4R0.1 C#CC(=O)O 2521-1-01 [0,0,0,0,0,0|0,0,2]=2 1 B4R0.1 C#CC(C)O 2502-1-01 [0,0,0,0,0,0|1,0,3]=4 2 B4R0.1 C#CC(N)=O 4148-1-01 [0,0,0,0,0,0|1,0,2]=3 3 B4R0.1 C#C[C@@H](C)O 2502-1-R1 [0,0,0,0,0,0|1,0,3]=4 4 B4R0.1 C=C(Br)CC 1300-9-24 [0,0,0,0,0,0|2,0,0]=2 5 B4R0.1 C=C(C)CBr 1300-9-00 [0,0,0,0,0,0|3,0,0]=3 6 B4R0.1 C=C(C)CC 1300-1-21 [0,0,0,0,0,0|2,0,0]=2 7 B4R0.1 C=C(C)CN 3330-1-X1 [0,0,0,0,0,0|3,0,0]=3 8 B4R0.1 C=C(C)CN 3330-5-X0 [0,0,0,0,0,0|3,0,0]=3 9 B4R0.1 C=C(C)OC 2307-1-01 [0,0,0,0,0,0|3,0,0]=3 10 B4R0.1 C=C(Cl)C#N 3337-5-X3 [0,0,0,0,0,0|3,0,1]=4 11 B4R0.1 C=C(Cl)CCl 1300-5-15 [0,0,0,0,0,0|3,0,0]=3 12 B4R0.1 C=C(Cl)CF 1300-7-23 [0,0,0,0,0,0|3,0,0]=3 13 B4R0.1 C=C(Cl)CO 2301-5-02 [0,0,0,0,0,0|3,0,0]=3 14 B4R0.1 C=C(Cl)CO 2301-5-02T [0,0,0,0,0,0|3,0,0]=3 15 B4R0.1 C=C(F)CBr 1300-B-49 [0,0,0,0,0,0|3,0,0]=3 16 B4R0.1 C=C(F)CCl 1300-7-14 [0,0,0,0,0,0|3,0,0]=3 17 B4R0.1 C=C(F)CN 3330-3-32 [0,0,0,0,0,0|3,0,0]=3 18 B4R0.1 C=C(F)CO 2301-3-03 [0,0,0,0,0,0|3,0,0]=3 19 B4R0.1 C=CC(=C)C 1300-1-49 [0,0,0,0,0,0|2,0,2]=4 20 B4R0.1 CC(=O)C=O 2117-1-X0 [0,0,0,0,0,0|2,0,1]=3 21 B4R0.1 CC(=O)C=O 2117-1-X0A [0,0,0,0,0,0|2,0,1]=3 22 B4R0.1 CC(=O)CF 2117-3-10 [0,0,0,0,0,0|2,0,0]=2 23 B4R0.1 CC(=O)CO 2120-1-01 [0,0,0,0,0,0|2,0,0]=2 24 B4R0.1 CC(=O)NN 4156-1-2V [0,0,0,0,0,0|3,0,0]=3 25 B4R0.1 CC(F)CO 2101-3-64 [0,0,0,0,0,0|3,0,1]=4 26 B4R0.1 CC(N)CO 4156-1-92 [0,0,0,0,0,0|3,0,1]=4 27 B4R0.1 CC(O)CF 2102-3-12 [0,0,0,0,0,0|2,0,1]=3 28 B4R0.1 CC(O)CO 2104-1-12 [0,0,0,0,0,0|2,0,1]=3 29 B4R0.1 CC=C(Cl)Cl 1300-5-42 [0,0,0,0,0,0|2,0,1]=3 30 B4R0.1 CCB(O)O 6160-1-X1 [0,0,0,0,0,0|1,0,1]=2 31 B4R0.1 CCC(=N)N 3141-5-03 [0,0,0,0,0,0|2,0,0]=2 32 B4R0.1 CCC(C)Cl 1100-5-25 [0,0,0,0,0,0|2,0,1]=3 33 B4R0.1 CCC(C)F 1100-3-47 [0,0,0,0,0,0|2,0,1]=3 34 B4R0.1 CCC(C)I 1100-H-X6 [0,0,0,0,0,0|2,0,1]=3 35 B4R0.1 CC[C@@H](C)O 2101-1-R1 [0,0,0,0,0,0|1,0,1]=2 36 B4R0.1 CNC(N)=S 7167-1-20 [0,0,0,0,0,0|2,1,0]=3 37 B4R0.1 COC(=N)N 8153-1-01 [0,0,0,0,0,0|3,0,0]=3 38 B4R0.1 COC(Cl)Cl 2107-5-05 [0,0,0,0,0,0|3,0,1]=4 39 B4R0.1 CSC(=N)N 7167-H-X1 [0,0,0,0,0,0|3,0,0]=3 40 B4R0.1 CSC(=N)N 8167-1-01 [0,0,0,0,0,0|3,0,0]=3 41 B4R0.1 C[C@@H](N)CO 4156-1-R3 [0,0,0,0,0,0|3,0,1]=4 42 B4R0.1 C[C@@H](O)CN 4156-1-R2 [0,0,0,0,0,0|2,0,1]=3 43 B4R0.1 C[C@@H](O)CO 2104-1-R3 [0,0,0,0,0,0|2,0,1]=3 44 B4R0.1 C[C@H](O)CN 4156-1-S2 [0,0,0,0,0,0|2,0,1]=3 45 B4R0.1 C[C@H](O)CO 2104-1-S3 [0,0,0,0,0,0|2,0,1]=3 46 B4R0.1 C\C(Cl)=C/Cl 1300-5-18 [0,0,0,0,0,0|3,0,1]=4 47 B4R0.1 C\C(Cl)=C\Cl 1300-5-Z0 [0,0,0,0,0,0|3,0,1]=4 48 B4R0.1 C\C(N)=N\O 4147-1-X0 [0,0,0,0,0,0|4,0,0]=4 49 B4R0.1 ClC=C(Cl)Cl 1300-5-03 [0,0,0,0,0,0|3,0,1]=4 50 B4R0.1 ClCC(Cl)Cl 1100-5-X2 [0,0,0,0,0,0|3,0,1]=4 51 B4R0.1 FC(Cl)CCl 1100-7-28 [0,0,0,0,0,0|3,0,1]=4 52 B4R0.1 FC(F)CBr 1100-B-07 [0,0,0,0,0,0|3,0,1]=4 53 B4R0.1 FC(F)CI 1100-K-32 [0,0,0,0,0,0|3,0,1]=4 54 B4R0.1 N=C(N)CCl 3141-5-X3 [0,0,0,0,0,0|3,0,0]=3 55 B4R0.1 NC(=O)CBr 4148-9-X4 [0,0,0,0,0,0|2,0,0]=2 56 B4R0.1 NC(=O)CCl 4148-5-00 [0,0,0,0,0,0|2,0,0]=2 57 B4R0.1 NCC(F)F 3130-3-03 [0,0,0,0,0,0|3,0,1]=4 58 B4R0.1 NCC(F)F 3130-7-03 [0,0,0,0,0,0|3,0,1]=4 59 B4R0.1 O=C(Br)CBr 2116-9-03 [0,0,0,0,0,0|2,0,0]=2 60 B4R0.1 O=C(Cl)SCl 6171-5-00 [0,0,0,0,0,0|3,0,0]=3 61 B4R0.1 O=C(O)CBr 2121-9-01 [0,0,0,0,0,0|1,0,0]=1 62 B4R0.1 O=C(O)CI 2121-H-00 [0,0,0,0,0,0|1,0,0]=1 63 B4R0.1 O=C(O)CO 2129-1-20 [0,0,0,0,0,0|1,0,0]=1 64 B4R0.1 O=CC(=O)O 2129-1-X4 [0,0,0,0,0,0|1,0,1]=2 65 B4R0.1 O=S([O-])CO 6165-1-06 [0,0,0,0,0,0|2,0,1]=3 66 B4R0.1 O=[N+]([O-])CBr 4154-9-X0 [0,0,0,0,0,0|2,0,1]=3 67 B4R0.1 OCC(F)F 2101-3-02 [0,0,0,0,0,0|3,0,1]=4 68 B4R0.1 ON=C(Br)Br 4147-9-00 [0,0,0,0,0,0|4,0,0]=4 69 B4R0.1 [C@@H](C)(N)CC 3130-1-S1 [0,0,0,0,0,0|2,0,1]=3 70 B4R0.1 [C@@H](C)(N)CO 4156-1-Y5 [0,0,0,0,0,0|3,0,1]=4 71 B4R0.1 [C@H](C)(N)CC 3130-1-R1 [0,0,0,0,0,0|2,0,1]=3 72 B3R0.1 BrCCI 1100-S-04 [1,0,0,0,0,0|2,0,1]=4 73 B3R0.1 C#CCC 1500-1-05 [1,0,0,0,0,0|1,0,1]=3 74 B3R0.1 C#CCCl 1500-5-02 [1,0,0,0,0,0|2,0,1]=4 75 B3R0.1 C=CCBr 1300-9-02 [1,0,0,0,0,0|2,0,0]=3 76 B3R0.1 C=CCC 1300-1-25 [1,0,0,0,0,0|1,0,0]=2 77 B3R0.1 C=CCCl 1300-5-10 [1,0,0,0,0,0|2,0,0]=3 78 B3R0.1 C=CCF 1300-3-09 [1,0,0,0,0,0|2,0,0]=3 79 B3R0.1 C=CCI 1300-H-01 [1,0,0,0,0,0|2,0,0]=3 80 B3R0.1 CC#CC 1500-1-02 [1,0,0,0,0,0|1,0,2]=4 81 B3R0.1 CCC=O 2115-1-05 [1,0,0,0,0,0|0,0,0]=1 82 B3R0.1 CCCBr 1100-9-37 [1,0,0,0,0,0|1,0,1]=3 83 B3R0.1 CCCC 1100-1-X0 [1,0,0,0,0,0|1,0,1]=3 84 B3R0.1 CCCCl 1100-5-01 [1,0,0,0,0,0|1,0,1]=3 85 B3R0.1 CCCI 1100-H-X9 [1,0,0,0,0,0|1,0,1]=3 86 B3R0.1 CCNN 3139-5-05 [1,0,0,0,0,0|2,0,0]=3 87 B3R0.1 CNOC 4147-5-01 [1,0,0,0,0,0|3,0,0]=4 88 B3R0.1 COCBr 2107-9-01 [1,0,0,0,0,0|2,0,1]=4 89 B3R0.1 C\C=C/C 1300-1-29 [1,0,0,0,0,0|1,0,1]=3 90 B3R0.1 C\C=C\C 1300-1-04 [1,0,0,0,0,0|1,0,1]=3 91 B3R0.1 C\C=C\Cl 1300-5-17 [1,0,0,0,0,0|1,0,1]=3 92 B3R0.1 C\C=C\Cl 1300-5-E1 [1,0,0,0,0,0|1,0,1]=3 93 B3R0.1 ClCCCl 1100-5-15 [1,0,0,0,0,0|2,0,1]=4 94 B3R0.1 ClCCI 1100-M-00 [1,0,0,0,0,0|2,0,1]=4 95 B3R0.1 Cl\C=C\Cl 1300-5-13 [1,0,0,0,0,0|2,0,1]=4 96 B3R0.1 FCCCl 1100-7-05 [1,0,0,0,0,0|2,0,1]=4 97 B3R0.1 FCCI 1100-K-18 [1,0,0,0,0,0|2,0,1]=4 98 B3R0.1 N#CCBr 3137-9-02 [1,0,0,0,0,0|2,0,1]=4 99 B3R0.1 NCCBr 3130-9-X1 [1,0,0,0,0,0|2,0,1]=4 100 B3R0.1 NCCCl 3130-5-01 [1,0,0,0,0,0|2,0,1]=4 101 B3R0.1 NCCF 3130-7-04 [1,0,0,0,0,0|2,0,1]=4 102 B3R0.1 NCCS 7161-5-01 [1,0,0,0,0,0|1,1,1]=4 103 B3R0.1 OCCBr 2101-9-02 [1,0,0,0,0,0|1,0,1]=3 104 B3R0.2 C=C(C)C 1300-1-06 [1,0,0,0,0,0|2,0,0]=3 105 B3R0.2 C=C(C)Cl 1300-5-21 [1,0,0,0,0,0|2,0,0]=3 106 B3R0.2 C=C(Cl)Cl 1300-5-11 [1,0,0,0,0,0|2,0,1]=4 107 B3R0.2 C=C(F)Cl 1300-7-03 [1,0,0,0,0,0|2,0,1]=4 108 B3R0.2 CB(O)O 6160-1-X6 [1,0,0,0,0,0|1,0,1]=3 109 B3R0.2 CC(=O)Cl 2116-5-01 [1,0,0,0,0,0|1,0,0]=2 110 B3R0.2 CC(=O)O 4141-1-X0 [1,0,0,0,0,0|0,0,0]=1 111 B3R0.2 CC(=O)[O-] 2122-1-02 [1,0,0,0,0,0|0,0,1]=2 112 B3R0.2 CC(=O)[O-] 2122-1-19 [1,0,0,0,0,0|0,0,1]=2 113 B3R0.2 CC(=O)[O-] 2122-1-29 [1,0,0,0,0,0|0,0,1]=2 114 B3R0.2 CC(=O)[O-] 2122-1-46 [1,0,0,0,0,0|0,0,1]=2 115 B3R0.2 CC(=O)[O-] 2122-1-46H [1,0,0,0,0,0|0,0,1]=2 116 B3R0.2 CC(=O)[O-] M029-1-01 [1,0,0,0,0,0|0,0,1]=2 117 B3R0.2 CC(=O)[O-] M056-1-X0 [1,0,0,0,0,0|0,0,1]=2 118 B3R0.2 CC(=O)[S-] 6161-1-05 [1,0,0,0,0,0|0,1,0]=2 119 B3R0.2 CC(C)Br 1100-9-02 [1,0,0,0,0,0|2,0,1]=4 120 B3R0.2 CC(C)C 1100-1-19 [1,0,0,0,0,0|2,0,1]=4 121 B3R0.2 CC(C)I 1100-H-03 [1,0,0,0,0,0|2,0,1]=4 122 B3R0.2 CC(C)N 3130-5-X1 [1,0,0,0,0,0|2,0,1]=4 123 B3R0.2 CC(Cl)Cl 1100-5-12 [1,0,0,0,0,0|2,0,1]=4 124 B3R0.2 CC(F)Br 1100-B-20 [1,0,0,0,0,0|2,0,1]=4 125 B3R0.2 CC(F)Cl 1100-7-04SM [1,0,0,0,0,0|2,0,1]=4 126 B3R0.2 CC(F)F 1100-3-05 [1,0,0,0,0,0|2,0,1]=4 127 B3R0.2 CC(N)=S 7167-1-X0 [1,0,0,0,0,0|1,1,0]=3 128 B3R0.2 CN(C)C 3132-1-05 [1,0,0,0,0,0|3,0,0]=4 129 B3R0.2 CN(C)C 8132-1-X0 [1,0,0,0,0,0|3,0,0]=4 130 B3R0.2 CS(=O)[O-] 6165-1-X0 [1,0,0,0,0,0|1,0,1]=3 131 B3R0.2 C[S+](C)C 5171-H-01 [1,0,0,0,0,0|3,0,0]=4 132 B3R0.2 N=C(N)Cl 3141-5-X4 [1,0,0,0,0,0|3,0,0]=4 133 B3R0.2 N=C(N)N 3141-5-X1 [1,0,0,0,0,0|3,0,0]=4 134 B3R0.2 NC(N)=O 4153-1-01 [1,0,0,0,0,0|2,0,0]=3 135 B3R0.2 O=C([O-])[O-] M019-0-02 [1,0,0,0,0,0|1,0,1]=3 136 B3R0.2 O=C([O-])[O-] M021-1-04 [1,0,0,0,0,0|1,0,1]=3 137 B3R0.2 O=S([O-])O M011-1-06 [1,0,0,0,0,0|2,0,0]=3 138 B3R0.2 O=S([O-])O M011-1-06HP [1,0,0,0,0,0|2,0,0]=3 139 B3R0.2 O=S([O-])[O-] M019-0-01 [1,0,0,0,0,0|2,0,1]=4 140 B3R0.2 O=[N+]([O-])[O-] M020-1-X0 [1,0,0,0,0,0|2,0,1]=4 141 B3R0.2 O=[N+]([O-])[O-] M021-1-05 [1,0,0,0,0,0|2,0,1]=4 142 B3R0.2 O=[N+]([O-])[O-] M057-1-01 [1,0,0,0,0,0|2,0,1]=4 143 B5R0.1 C=CCC(C)O 2302-1-00 [0,1,0,0,0,0|1,0,2]=4 144 B5R0.1 C=COC(C)=O 2324-1-50 [0,1,0,0,0,0|1,0,2]=4 145 B5R0.1 CC#CC(=O)O 2521-1-13 [0,1,0,0,0,0|0,0,1]=2 146 B5R0.1 CC(C)=CCBr 1300-9-X0 [0,1,0,0,0,0|2,0,1]=4 147 B5R0.1 CC(C)=CCCl 1300-5-X0 [0,1,0,0,0,0|2,0,1]=4 148 B5R0.1 CC(C)CCI 1100-H-X4 [0,1,0,0,0,0|2,0,1]=4 149 B5R0.1 CC(C)CCN 3130-1-X4 [0,1,0,0,0,0|2,0,1]=4 150 B5R0.1 CC(C)CCO 2101-1-53 [0,1,0,0,0,0|2,0,1]=4 151 B5R0.1 CC(N)CCO 4156-1-4D [0,1,0,0,0,0|2,0,1]=4 152 B5R0.1 CCCB(O)O 6160-1-X5 [0,1,0,0,0,0|1,0,1]=3 153 B5R0.1 CCCC(=O)Cl 2116-5-09 [0,1,0,0,0,0|1,0,0]=2 154 B5R0.1 CCCC(=O)[O-] 2122-1-X1 [0,1,0,0,0,0|0,0,1]=2 155 B5R0.1 CCCC(C)C 1100-1-04 [0,1,0,0,0,0|2,0,1]=4 156 B5R0.1 CCCC(C)O 2102-1-52 [0,1,0,0,0,0|1,0,1]=3 157 B5R0.1 CCNC(N)=O 4153-1-X1 [0,1,0,0,0,0|1,0,0]=2 158 B5R0.1 CCOC(=S)[S-] 6167-1-02 [0,1,0,0,0,0|0,2,0]=3 159 B5R0.1 CN(C)CCN 3132-1-X2 [0,1,0,0,0,0|3,0,0]=4 160 B5R0.1 COCC(=O)Cl 2116-5-X4 [0,1,0,0,0,0|1,0,0]=2 161 B5R0.1 CSCC(=O)O 6166-1-05 [0,1,0,0,0,0|0,0,0]=1 162 B5R0.1 C[C@@H](N)CCO 4156-1-RB [0,1,0,0,0,0|2,0,1]=4 163 B5R0.1 C[C@@H](O)CCO 2101-1-X0 [0,1,0,0,0,0|1,0,1]=3 164 B5R0.1 ClCC=C(Cl)Cl 1300-5-07 [0,1,0,0,0,0|2,0,1]=4 165 B5R0.1 N#CCC(N)=S 7167-1-W0 [0,1,0,0,0,0|1,1,1]=4 166 B5R0.1 NC(=O)CCBr 4148-9-00 [0,1,0,0,0,0|1,0,0]=2 167 B5R0.1 NC(=O)CCCl 4148-5-02 [0,1,0,0,0,0|1,0,0]=2 168 B5R0.1 O=C(O)CCO 2129-1-Y8 [0,1,0,0,0,0|0,0,0]=1 169 B5R0.3 C#CC(=O)OC 2523-1-X1 [0,1,0,0,0,0|0,0,2]=3 170 B5R0.3 C#CC(O)CC 2502-1-02 [0,1,0,0,0,0|1,0,1]=3 171 B5R0.3 C=C(CCl)CCl 1300-5-X1 [0,1,0,0,0,0|3,0,0]=4 172 B5R0.3 C=C(CO)CO 2304-1-X0 [0,1,0,0,0,0|2,0,0]=3 173 B5R0.3 CCC(=O)CBr 2117-9-01 [0,1,0,0,0,0|1,0,0]=2 174 B5R0.3 CCC(C)C=O 2115-1-0C [0,1,0,0,0,0|1,0,1]=3 175 B5R0.3 CCC(C)CN 3130-1-X5 [0,1,0,0,0,0|2,0,1]=4 176 B5R0.3 CCC(N)CC 3130-1-14 [0,1,0,0,0,0|2,0,1]=4 177 B5R0.3 CCC(N)CO 4156-1-38 [0,1,0,0,0,0|1,0,1]=3 178 B5R0.3 CCC(O)CN 4156-1-Z4 [0,1,0,0,0,0|1,0,1]=3 179 B5R0.3 CC[C@@H](N)CO 4156-1-R4 [0,1,0,0,0,0|1,0,1]=3 180 B5R0.3 CC[C@H](N)CO 4156-1-W2 [0,1,0,0,0,0|1,0,1]=3 181 B5R0.3 CNC(=S)NN 7167-1-19 [0,1,0,0,0,0|2,1,0]=4 182 B5R0.3 COC(=O)CBr 2123-9-36 [0,1,0,0,0,0|1,0,0]=2 183 B5R0.3 COC(=O)CN 4158-5-40 [0,1,0,0,0,0|1,0,0]=2 184 B5R0.3 COC(=O)CO 2129-1-X2 [0,1,0,0,0,0|1,0,0]=2 185 B5R0.3 COC(=O)CS 6161-1-X3 [0,1,0,0,0,0|1,0,0]=2 186 B5R0.3 COC(=O)NN 4156-1-39 [0,1,0,0,0,0|2,0,0]=3 187 B5R0.3 COS(=O)OC 6164-1-13 [0,1,0,0,0,0|2,0,0]=3 188 B5R0.3 CO[PH](=O)OC 6177-1-0G [0,1,0,0,0,0|2,0,0]=3 189 B5R0.3 CSC(=N)NN 7167-H-X0 [0,1,0,0,0,0|3,0,0]=4 190 B5R0.3 CSC(=S)NN 8169-1-0B [0,1,0,0,0,0|2,1,0]=4 191 B5R0.3 C\C(C=O)=C/N 4356-1-X1 [0,1,0,0,0,0|2,0,1]=4 192 B5R0.3 NC(CO)CO 4104-1-X0 [0,1,0,0,0,0|2,0,1]=4 193 B5R0.3 NCC(O)CN 4156-1-Y7 [0,1,0,0,0,0|2,0,1]=4 194 B5R0.3 NCC(O)CO 4156-1-Z8 [0,1,0,0,0,0|1,0,2]=4 195 B5R0.3 O=C(CBr)CBr 2117-9-03 [0,1,0,0,0,0|2,0,0]=3 196 B5R0.3 O=C(CF)CF 2117-3-09 [0,1,0,0,0,0|2,0,0]=3 197 B5R0.3 OC(CBr)CBr 2101-9-X1 [0,1,0,0,0,0|2,0,1]=4 198 B5R0.3 OC(CCl)CCl 2102-5-13 [0,1,0,0,0,0|2,0,1]=4 199 B5R0.3 OC(CF)CCl 2102-7-02 [0,1,0,0,0,0|2,0,1]=4 200 B5R0.3 OC(CF)CF 2102-3-13 [0,1,0,0,0,0|2,0,1]=4 201 B5R0.3 OCC(O)CBr 2104-9-01 [0,1,0,0,0,0|1,0,2]=4 202 B5R0.3 OCC(O)CS 6161-1-X4 [0,1,0,0,0,0|1,0,2]=4 203 B5R0.4 CC(C)(O)CN 4156-1-05 [0,1,0,0,0,0|2,0,1]=4 204 B5R0.4 CC(C)(O)CO 2104-1-09 [0,1,0,0,0,0|2,0,1]=4 205 B5R0.4 CCC(C)(C)C 1100-1-32 [0,1,0,0,0,0|2,0,1]=4 206 B5R0.4 CCC(C)(F)F 1100-3-98 [0,1,0,0,0,0|2,0,1]=4 207 B5R0.4 CCC(Cl)(Cl)Cl 1100-5-06 [0,1,0,0,0,0|2,0,1]=4 208 B5R0.4 CCC(F)(F)Br 1100-B-38 [0,1,0,0,0,0|2,0,1]=4 209 B5R0.4 CCS(C)(=O)=O 6163-1-0B [0,1,0,0,0,0|1,0,1]=3 210 B5R0.4 CCS(N)(=O)=O 8169-1-03 [0,1,0,0,0,0|1,0,1]=3 211 B5R0.4 CNS(C)(=O)=O 8169-1-11 [0,1,0,0,0,0|2,0,1]=4 212 B5R0.4 NOS(=O)(=O)O P612-A-67 [0,1,0,0,0,0|3,0,0]=4 213 B5R0.4 O=S(=O)(Cl)CCl 6162-5-X1 [0,1,0,0,0,0|2,0,1]=4 214 B5R0.5 C=C(C)C(C)C 1300-1-24 [0,1,0,0,0,0|2,0,0]=3 215 B5R0.5 C=C(F)C(=O)O 2321-3-06 [0,1,0,0,0,0|0,0,2]=3 216 B5R0.5 CC(=O)C(=O)O 2129-1-03 [0,1,0,0,0,0|0,0,1]=2 217 B5R0.5 CC(=O)C(C)=O 2118-1-05 [0,1,0,0,0,0|1,0,1]=3 218 B5R0.5 CC(=O)C(C)C 2117-1-13 [0,1,0,0,0,0|1,0,0]=2 219 B5R0.5 CC(=O)C(C)F 2117-3-11 [0,1,0,0,0,0|1,0,0]=2 220 B5R0.5 CC(=O)C(F)F 2117-3-13 [0,1,0,0,0,0|2,0,0]=3 221 B5R0.5 CC(=O)N(C)C 4148-1-08 [0,1,0,0,0,0|2,0,0]=3 222 B5R0.5 CC(Br)C(N)=O 4157-9-X1 [0,1,0,0,0,0|1,0,0]=2 223 B5R0.5 CC(C)=C(C)C 1300-1-X1 [0,1,0,0,0,0|2,0,1]=4 224 B5R0.5 CC(C)B(O)O 6160-1-X0 [0,1,0,0,0,0|1,0,1]=3 225 B5R0.5 CC(C)C(=N)N 3141-5-X0 [0,1,0,0,0,0|2,0,0]=3 226 B5R0.5 CC(C)C(=O)Cl 2116-5-05 [0,1,0,0,0,0|1,0,0]=2 227 B5R0.5 CC(Cl)C(Cl)Cl 1100-5-31 [0,1,0,0,0,0|2,0,1]=4 228 B5R0.5 CC(F)C(=O)O 2121-3-95 [0,1,0,0,0,0|0,0,0]=1 229 B5R0.5 CC(N)C(N)=O 4158-5-X5 [0,1,0,0,0,0|1,0,0]=2 230 B5R0.5 CC(O)C(C)O 2104-1-07 [0,1,0,0,0,0|1,0,1]=3 231 B5R0.5 CN(C)C(=N)N 3141-5-00 [0,1,0,0,0,0|3,0,0]=4 232 B5R0.5 CN(C)C(=S)Cl P911-A-76 [0,1,0,0,0,0|2,1,0]=4 233 B5R0.5 CN(C)C(=S)[S-] 5167-1-01 [0,1,0,0,0,0|1,2,0]=4 234 B5R0.5 C[C@@H](Cl)C(=O)O 2121-5-R1 [0,1,0,0,0,0|0,0,0]=1 235 B5R0.5 C[C@@H](O)C(N)=O 4148-1-R1 [0,1,0,0,0,0|1,0,0]=2 236 B5R0.5 C[C@@H](O)[C@@H](C)O 2104-1-R1 [0,1,0,0,0,0|1,0,1]=3 237 B5R0.5 C[C@H](N)C(=O)O 4157-1-S5 [0,1,0,0,0,0|0,0,0]=1 238 B5R0.5 C[C@H](N)C(N)=O 4148-5-04 [0,1,0,0,0,0|1,0,0]=2 239 B5R0.5 C[C@H](O)C(=O)O 2129-1-S8 [0,1,0,0,0,0|0,0,0]=1 240 B5R0.5 C[C@H](O)[C@H](C)O 2104-1-X2 [0,1,0,0,0,0|1,0,1]=3 241 B5R0.5 NC(=O)C(Cl)Cl 4148-5-X4 [0,1,0,0,0,0|2,0,0]=3 242 B5R0.5 NC(=O)C(F)Br 4148-B-02 [0,1,0,0,0,0|2,0,0]=3 243 B5R0.5 NC(=O)C(F)Cl 4148-7-03 [0,1,0,0,0,0|2,0,0]=3 244 B5R0.5 NC(=O)C(F)F 4148-3-18 [0,1,0,0,0,0|2,0,0]=3 245 B5R0.5 NC(=O)C(F)I 4148-K-01 [0,1,0,0,0,0|2,0,0]=3 246 B5R0.5 NC(=O)C(N)=O 4148-1-18 [0,1,0,0,0,0|2,0,1]=4 247 B5R0.5 O=C(Cl)C(=O)Cl 2116-4-02 [0,1,0,0,0,0|2,0,1]=4 248 B5R0.5 O=C(Cl)C(Cl)Cl 2116-5-00 [0,1,0,0,0,0|2,0,0]=3 249 B5R0.5 O=C(O)C(=O)O 2121-1-12 [0,1,0,0,0,0|1,0,1]=3 250 B5R0.5 O=C(O)C(F)Br 2121-B-03 [0,1,0,0,0,0|1,0,0]=2 251 B5R0.5 O=C(O)C(F)Cl 2121-7-03 [0,1,0,0,0,0|1,0,0]=2 252 B5R0.5 O=C(O)C(F)F 2121-3-05 [0,1,0,0,0,0|1,0,0]=2 253 B5R0.5 O=C(O)C(F)I 2121-K-01 [0,1,0,0,0,0|1,0,0]=2 254 B5R0.5 O=C([O-])C(=O)[O-] 2122-0-00 [0,1,0,0,0,0|1,0,2]=4 255 B5R0.5 O=C([O-])C(=O)[O-] 2122-1-06 [0,1,0,0,0,0|1,0,2]=4 256 B5R0.5 O=C([O-])C(=O)[O-] M068-1-X0 [0,1,0,0,0,0|1,0,2]=4 257 B5R0.5 O=C([O-])C(=O)[O-] M068-1-X1 [0,1,0,0,0,0|1,0,2]=4 258 B5R0.5 O=C([O-])C(F)Br 2122-B-01 [0,1,0,0,0,0|1,0,1]=3 259 B5R0.5 O=C([O-])C(F)Cl 2122-7-01 [0,1,0,0,0,0|1,0,1]=3 260 B5R0.5 O=C([O-])C(F)F 2122-3-02 [0,1,0,0,0,0|1,0,1]=3 261 B5R0.5 O=C([O-])C(F)F 2122-3-07 [0,1,0,0,0,0|1,0,1]=3 262 B5R0.5 [C@@H](C)(Cl)C(=O)O 2121-5-S1 [0,1,0,0,0,0|0,0,0]=1 263 B5R1.2 BrC1CCC1 1200-9-17 [0,0,0,1,0,0|2,0,1]=4 264 B5R1.2 NC1CCC1 3230-1-X4 [0,0,0,1,0,0|2,0,1]=4 265 B5R1.2 O=C1CCC1 2217-1-X6 [0,0,0,1,0,0|1,0,0]=2 266 B5R1.2 O=C1CCN1 4H48-1-F4 [0,0,0,1,0,0|1,0,0]=2 267 B5R1.2 O=C1CNC1 4H56-5-05 [0,0,0,1,0,0|2,0,0]=3 268 B5R1.2 O=C1COC1 2H17-1-05 [0,0,0,1,0,0|2,0,0]=3 269 B5R1.2 O=C1CSC1 6H66-1-39 [0,0,0,1,0,0|2,0,0]=3 270 B5R1.2 OC1CNC1 4H01-5-63 [0,0,0,1,0,0|2,0,1]=4 271 B5R1.2 OC1COC1 2H01-1-X3 [0,0,0,1,0,0|2,0,1]=4 272 B5R1.3 ClCC1CO1 2109-5-01 [0,0,0,1,0,0|2,0,1]=4 273 B5R1.3 ClC[C@@H]1CO1 2109-5-X0 [0,0,0,1,0,0|2,0,1]=4 274 B5R1.3 ClC[C@H]1CO1 2109-5-X1 [0,0,0,1,0,0|2,0,1]=4 275 B5R1.3 FCC1CO1 2109-3-20 [0,0,0,1,0,0|2,0,1]=4 276 B5R1.3 OC[C@@H]1CO1 2109-1-R2 [0,0,0,1,0,0|2,0,1]=4 277 B5R1.3 OC[C@H]1CO1 2109-1-S1 [0,0,0,1,0,0|2,0,1]=4 278 B5R1.4 C[C@@H]1O[C@@H]1C 2109-1-Z0 [0,0,0,1,0,0|1,0,1]=3 279 B5R1.4 C[C@@H]1O[C@H]1C 2109-1-E0 [0,0,0,1,0,0|1,0,1]=3 280 B5R1.5 CC1(N)CC1 3230-5-01 [0,0,0,1,0,0|2,0,1]=4 281 B2R0.1 C#CC 1500-1-01 [2,0,0,0,0,0|0,0,2]=4 282 B2R0.1 C=CBr 1300-9-01 [2,0,0,0,0,0|1,0,1]=4 283 B2R0.1 C=CBr 1300-9-01ST [2,0,0,0,0,0|1,0,1]=4 284 B2R0.1 C=CC 1300-1-02 [2,0,0,0,0,0|0,0,1]=3 285 B2R0.1 CCBr 1100-9-04 [2,0,0,0,0,0|1,0,0]=3 286 B2R0.1 CCI 1100-H-10 [2,0,0,0,0,0|1,0,0]=3 287 B2R0.1 CCN 3130-1-10 [2,0,0,0,0,0|1,0,0]=3 288 B2R0.1 CC[O-] 9122-1-X0 [2,0,0,0,0,0|0,0,1]=3 289 B2R0.1 CNC 3131-1-X3 [2,0,0,0,0,0|1,0,1]=4 290 B2R0.1 CNO 4156-5-10 [2,0,0,0,0,0|1,0,0]=3 291 B2R0.1 COC 2107-1-01 [2,0,0,0,0,0|1,0,1]=4 292 B2R0.1 CON 4147-5-X3 [2,0,0,0,0,0|2,0,0]=4 293 B2R0.1 ClCBr 1100-D-01 [2,0,0,0,0,0|2,0,0]=4 294 B2R0.1 ClCCl 1100-5-02 [2,0,0,0,0,0|2,0,0]=4 295 B2R0.1 ClCI 1100-L-02 [2,0,0,0,0,0|2,0,0]=4 296 B2R0.1 FCF 1100-3-02 [2,0,0,0,0,0|2,0,0]=4 297 B2R0.1 ICI 1100-H-02 [2,0,0,0,0,0|2,0,0]=4 298 B2R0.1 O=C[O-] 2122-1-07 [2,0,0,0,0,0|0,0,1]=3 299 B2R0.1 O=C[O-] 9130-1-00 [2,0,0,0,0,0|0,0,1]=3 300 B2R0.1 O=[Si]=O SI24001A [2,0,0,0,0,0|0,1,1]=4 301 B4R0.2 BrCCCBr 1100-9-13 [1,1,0,0,0,0|1,0,1]=4 302 B4R0.2 C#CCCC 1500-1-X1 [1,1,0,0,0,0|1,0,1]=4 303 B4R0.2 C#CCCO P311-A-35 [1,1,0,0,0,0|0,0,2]=4 304 B4R0.2 C#COCC 2507-1-01 [1,1,0,0,0,0|1,0,1]=4 305 B4R0.2 C=CCCBr 1300-9-04 [1,1,0,0,0,0|1,0,0]=3 306 B4R0.2 C=CCCC 1300-1-09 [1,1,0,0,0,0|1,0,0]=3 307 B4R0.2 CC#CCO 2501-1-04 [1,1,0,0,0,0|0,0,2]=4 308 B4R0.2 CCCC#N 3137-1-Y3 [1,1,0,0,0,0|1,0,1]=4 309 B4R0.2 CCCCBr 1100-9-15 [1,1,0,0,0,0|1,0,1]=4 310 B4R0.2 CCCCF 1100-3-32 [1,1,0,0,0,0|1,0,1]=4 311 B4R0.2 CCNCC 3133-5-06 [1,1,0,0,0,0|1,0,1]=4 312 B4R0.2 CCOCC 6160-3-09 [1,1,0,0,0,0|1,0,1]=4 313 B4R0.2 CCOCCl 2107-5-01 [1,1,0,0,0,0|1,0,1]=4 314 B4R0.2 CNCCCl 3133-5-05 [1,1,0,0,0,0|1,0,1]=4 315 B4R0.2 CNCCN 3131-1-11 [1,1,0,0,0,0|1,0,1]=4 316 B4R0.2 CNCCO 4156-1-3Y [1,1,0,0,0,0|0,0,1]=3 317 B4R0.2 COCC#N 4137-1-Y6 [1,1,0,0,0,0|1,0,1]=4 318 B4R0.2 COCCBr 2107-9-X1 [1,1,0,0,0,0|1,0,1]=4 319 B4R0.2 COCCCl 2107-5-0R [1,1,0,0,0,0|1,0,1]=4 320 B4R0.2 COCCN 4130-1-X3 [1,1,0,0,0,0|1,0,1]=4 321 B4R0.2 COCOC 2108-1-07 [1,1,0,0,0,0|1,0,1]=4 322 B4R0.2 CSCCN 7166-1-X1 [1,1,0,0,0,0|1,0,1]=4 323 B4R0.2 C\C=C\CC 1300-1-05 [1,1,0,0,0,0|1,0,0]=3 324 B4R0.2 ClCCCCl 1100-5-19 [1,1,0,0,0,0|1,0,1]=4 325 B4R0.2 ClCCCI 1100-M-01 [1,1,0,0,0,0|1,0,1]=4 326 B4R0.2 Cl\C=C\CCl 1300-5-28 [1,1,0,0,0,0|1,0,1]=4 327 B4R0.2 FCCCF 1100-3-16 [1,1,0,0,0,0|1,0,1]=4 328 B4R0.2 FCCCI 1100-K-35 [1,1,0,0,0,0|1,0,1]=4 329 B4R0.2 ICCCI 1100-H-X0 [1,1,0,0,0,0|1,0,1]=4 330 B4R0.2 N#CCCO 4137-1-Y3 [1,1,0,0,0,0|0,0,2]=4 331 B4R0.2 NCCCBr 3130-9-X0 [1,1,0,0,0,0|1,0,1]=4 332 B4R0.2 NCCCCl 3130-5-03 [1,1,0,0,0,0|1,0,1]=4 333 B4R0.2 NCCCF 3130-7-13 [1,1,0,0,0,0|1,0,1]=4 334 B4R0.2 NNCCO 4139-1-01 [1,1,0,0,0,0|1,0,1]=4 335 B4R0.2 OCCCBr 2101-9-X2 [1,1,0,0,0,0|0,0,1]=3 336 B4R0.2 OCCCCl 2101-5-13 [1,1,0,0,0,0|0,0,1]=3 337 B4R0.2 OCCCF 2101-3-50 [1,1,0,0,0,0|0,0,1]=3 338 B4R0.2 OCCCI 2101-H-01 [1,1,0,0,0,0|0,0,1]=3 339 B4R0.2 OCCCO 2104-1-11 [1,1,0,0,0,0|0,0,1]=3 340 B4R0.3 CC(C)(C)O 2103-1-01 [1,1,0,0,0,0|1,0,1]=4 341 B4R0.3 CS(=O)(=O)Cl 6162-5-01 [1,1,0,0,0,0|1,0,1]=4 342 B4R0.3 CS(=O)(=O)F 6162-3-01 [1,1,0,0,0,0|1,0,1]=4 343 B4R0.3 CS(=O)(=O)O 6164-1-17 [1,1,0,0,0,0|1,0,0]=3 344 B4R0.3 CS(C)(=N)=O 8169-1-04 [1,1,0,0,0,0|2,0,0]=4 345 B4R0.3 CS(N)(=O)=O 8169-1-X1 [1,1,0,0,0,0|1,0,1]=4 346 B4R0.3 C[S+](C)(C)=O 6165-5-00 [1,1,0,0,0,0|2,0,0]=4 347 B4R0.3 C[S+](C)(C)=O 6165-H-X0 [1,1,0,0,0,0|2,0,0]=4 348 B4R0.3 C[Si](C)(C)O 6182-1-X0 [1,1,0,0,0,0|1,1,0]=4 349 B4R0.3 O=P(O)(F)F M001-3-33 [1,1,0,0,0,0|2,0,0]=4 350 B4R0.3 O=P(O)(O)O M015-1-42 [1,1,0,0,0,0|2,0,0]=4 351 B4R0.3 O=[As]([O-])(O)O M033-0-01 [1,1,0,0,0,0|2,0,0]=4 352 B6R0.1 CCCC(=N)NO 4141-1-X1 [0,2,0,0,0,0|1,0,0]=3 353 B6R0.1 CCCC(=O)NN 4156-1-15 [0,2,0,0,0,0|1,0,0]=3 354 B6R0.1 CCCC(O)CO 2104-1-0A [0,2,0,0,0,0|0,0,2]=4 355 B6R0.1 CCNC(=S)NN 7167-1-11 [0,2,0,0,0,0|1,1,0]=4 356 B6R0.1 CCOC(=O)C=O 2323-1-X0 [0,2,0,0,0,0|0,0,1]=3 357 B6R0.1 CCOC(=O)CCl 2123-5-01 [0,2,0,0,0,0|1,0,0]=3 358 B6R0.1 CCOC(=O)CN 4158-5-25 [0,2,0,0,0,0|1,0,0]=3 359 B6R0.1 CCOC(=O)CS 6161-1-03 [0,2,0,0,0,0|0,1,0]=3 360 B6R0.1 CCOC(=O)NN 4156-1-55 [0,2,0,0,0,0|1,0,0]=3 361 B6R0.1 CNC(=O)CC#N 4148-1-X3 [0,2,0,0,0,0|1,0,1]=4 362 B6R0.1 CNC(=O)CCN 4148-1-13 [0,2,0,0,0,0|1,0,0]=3 363 B6R0.1 CNCC(=O)OC 4158-5-X0 [0,2,0,0,0,0|0,0,0]=2 364 B6R0.1 COC(=O)CC#N 4137-1-X2 [0,2,0,0,0,0|0,0,1]=3 365 B6R0.1 COC(=O)CCN 4158-1-02 [0,2,0,0,0,0|0,0,0]=2 366 B6R0.1 COC(=O)CSC 6166-1-06 [0,2,0,0,0,0|0,0,0]=2 367 B6R0.1 COCC(O)CO 2107-1-11 [0,2,0,0,0,0|0,0,2]=4 368 B6R0.1 OCC[C@H](O)CO 2104-1-S1 [0,2,0,0,0,0|0,0,2]=4 369 B6R0.1 [C-]#[N+]CC(=O)OC 4149-1-06 [0,2,0,0,0,0|0,0,1]=3 370 B6R0.2 CC(=O)CC(C)=O 2118-1-01 [0,2,0,0,0,0|1,0,0]=3 371 B6R0.2 CC(=O)CC(C)C 2118-1-02 [0,2,0,0,0,0|1,0,0]=3 372 B6R0.2 CC(=O)\C=C(\C)N 4356-1-06 [0,2,0,0,0,0|1,0,1]=4 373 B6R0.2 CC(=O)\C=C(\C)[O-] 9128-1-X0 [0,2,0,0,0,0|1,0,1]=4 374 B6R0.2 CC(C)=CC(=O)O 2321-1-X4 [0,2,0,0,0,0|0,0,1]=3 375 B6R0.2 CC(C)CB(O)O 6160-1-X3 [0,2,0,0,0,0|1,0,1]=4 376 B6R0.2 CC(C)CC(N)=O 4148-1-Y7 [0,2,0,0,0,0|1,0,0]=3 377 B6R0.2 CC(C)NC(N)=S 7167-1-18 [0,2,0,0,0,0|1,1,0]=4 378 B6R0.2 CC(Cl)OC(=O)Cl 2116-5-X1 [0,2,0,0,0,0|1,0,0]=3 379 B6R0.2 CC(O)CC(=O)[O-] 2129-1-35 [0,2,0,0,0,0|0,0,1]=3 380 B6R0.2 CC(O)CC(C)O 2104-1-X3 [0,2,0,0,0,0|1,0,1]=4 381 B6R0.2 CN(C)CC(=O)O 4158-1-40 [0,2,0,0,0,0|0,0,0]=2 382 B6R0.2 CN(C)CC(N)=S 7167-5-01 [0,2,0,0,0,0|1,1,0]=4 383 B6R0.2 C[C@@H](O)C[C@@H](C)O 2104-1-28 [0,2,0,0,0,0|1,0,1]=4 384 B6R0.2 O=C(O)CC(=O)O 2121-1-05 [0,2,0,0,0,0|0,0,1]=3 385 B6R0.3 C=C(F)C(=O)OC 2324-3-76 [0,2,0,0,0,0|0,0,2]=4 386 B6R0.3 CC(=O)C(=O)CBr 2118-9-01 [0,2,0,0,0,0|1,0,1]=4 387 B6R0.3 CC(C#N)C(=O)O 4137-1-0Z [0,2,0,0,0,0|0,0,0]=2 388 B6R0.3 CC(C)C(=N)NO 4156-1-Z3 [0,2,0,0,0,0|1,0,0]=3 389 B6R0.3 CC(C)C(N)CO 4156-1-88 [0,2,0,0,0,0|1,0,1]=4 390 B6R0.3 CC(C)[C@@H](N)CO 4156-1-R5 [0,2,0,0,0,0|1,0,1]=4 391 B6R0.3 CC(C)[C@H](N)CO 4156-1-S5 [0,2,0,0,0,0|1,0,1]=4 392 B6R0.3 CCC(=O)C(C)C 2117-1-18 [0,2,0,0,0,0|1,0,0]=3 393 B6R0.3 CCC(N)C(=O)O 4157-1-16 [0,2,0,0,0,0|0,0,0]=2 394 B6R0.3 CCN(C)C(=O)Cl 4148-5-18 [0,2,0,0,0,0|1,0,0]=3 395 B6R0.3 CC[C@H](O)C(=O)O 2129-1-SF [0,2,0,0,0,0|0,0,0]=2 396 B6R0.3 CN(C)C(=O)CBr 4148-9-08 [0,2,0,0,0,0|2,0,0]=4 397 B6R0.3 CNC(=O)C(=O)O 4156-1-Y4 [0,2,0,0,0,0|0,0,1]=3 398 B6R0.3 CNC(=O)C(C)N 4148-1-1M [0,2,0,0,0,0|1,0,0]=3 399 B6R0.3 CNC(=O)C(F)Br 4148-B-03 [0,2,0,0,0,0|2,0,0]=4 400 B6R0.3 CNC(=O)C(F)Cl 4148-7-04 [0,2,0,0,0,0|2,0,0]=4 401 B6R0.3 CNC(=O)C(F)I 4148-K-02 [0,2,0,0,0,0|2,0,0]=4 402 B6R0.3 CN[C@@H](C)C(=O)O 4157-1-07 [0,2,0,0,0,0|0,0,0]=2 403 B6R0.3 COC(=O)C(=O)Cl 2129-5-0K [0,2,0,0,0,0|1,0,1]=4 404 B6R0.3 COC(=O)C(C)Cl 2123-5-05 [0,2,0,0,0,0|0,0,0]=2 405 B6R0.3 COC(=O)C(C)F 2123-3-1X [0,2,0,0,0,0|0,0,0]=2 406 B6R0.3 COC(=O)C(C)O 2129-1-70 [0,2,0,0,0,0|0,0,0]=2 407 B6R0.3 COC(=O)C(F)F 2123-3-02 [0,2,0,0,0,0|1,0,0]=3 408 B6R0.3 COC(=O)[C@H](C)N 4158-5-45 [0,2,0,0,0,0|0,0,0]=2 409 B6R0.3 CON(C)C(C)=O 4148-1-44 [0,2,0,0,0,0|2,0,0]=4 410 B6R0.3 C\C(=N\O)C(F)F 4147-3-02 [0,2,0,0,0,0|2,0,0]=4 411 B6R0.3 C\C=C(/C)C(=O)O 2321-1-17 [0,2,0,0,0,0|0,0,1]=3 412 B6R0.3 C\C=C(/C)C(=O)O 2321-1-E0 [0,2,0,0,0,0|0,0,1]=3 413 B6R0.3 C\C=C(/C)C(C)=O 2317-1-02 [0,2,0,0,0,0|1,0,1]=4 414 B6R0.3 N#CC(N)C(N)=O 4148-1-X1 [0,2,0,0,0,0|1,0,1]=4 415 B6R0.3 NCC(F)C(=O)O 4157-3-02 [0,2,0,0,0,0|0,0,0]=2 416 B6R0.3 N[C@@H](CS)C(=O)O 8158-1-01 [0,2,0,0,0,0|0,0,0]=2 417 B6R0.3 O=C(O)C(=O)CBr 2129-9-X3 [0,2,0,0,0,0|0,0,1]=3 418 B6R0.3 [C@@H](N)(CC)C(=O)O 4157-1-X5 [0,2,0,0,0,0|0,0,0]=2 419 B6R0.3 [C@H](N)(CC)C(=O)O 4157-1-X4 [0,2,0,0,0,0|0,0,0]=2 420 B6R0.4 C#CCCC(=O)O 2521-1-02 [0,2,0,0,0,0|0,0,0]=2 421 B6R0.4 C#CCNC(N)=O 4553-1-01 [0,2,0,0,0,0|1,0,1]=4 422 B6R0.4 C=CCCC(=O)Cl 2316-5-06 [0,2,0,0,0,0|1,0,0]=3 423 B6R0.4 C=CCC[C@@H](C)O 2302-1-R1 [0,2,0,0,0,0|1,0,1]=4 424 B6R0.4 C=CCOC(C)=O 2324-1-08 [0,2,0,0,0,0|1,0,1]=4 425 B6R0.4 CC(=O)CCCCl 2117-5-52 [0,2,0,0,0,0|1,0,0]=3 426 B6R0.4 CC(=O)NCCCl 4148-5-15 [0,2,0,0,0,0|1,0,0]=3 427 B6R0.4 CCC#CC(=O)O 2521-1-12 [0,2,0,0,0,0|0,0,0]=2 428 B6R0.4 CCCCB(O)O 6160-1-06 [0,2,0,0,0,0|1,0,1]=4 429 B6R0.4 CCCCC(=O)O 2121-1-0C [0,2,0,0,0,0|0,0,0]=2 430 B6R0.4 CCCNC(N)=S 7167-1-23 [0,2,0,0,0,0|1,1,0]=4 431 B6R0.4 CCCOC(C)=O 2123-1-32 [0,2,0,0,0,0|1,0,0]=3 432 B6R0.4 CCCO[N+](=O)[O-] 4154-1-11 [0,2,0,0,0,0|1,0,1]=4 433 B6R0.4 CCOCC(=O)Cl 2116-5-0F [0,2,0,0,0,0|1,0,0]=3 434 B6R0.4 CNCCC(N)=O 4148-1-30 [0,2,0,0,0,0|1,0,0]=3 435 B6R0.4 FC(F)=CCCBr 1300-B-25 [0,2,0,0,0,0|2,0,0]=4 436 B6R0.4 NC(=O)NCCO 4153-1-02 [0,2,0,0,0,0|1,0,0]=3 437 B6R0.4 NCCCC(=O)O 4157-1-X2 [0,2,0,0,0,0|0,0,0]=2 438 B6R0.4 NCCNC(N)=O 4153-5-07 [0,2,0,0,0,0|1,0,0]=3 439 B6R0.4 O=C(Cl)CCCCl 2116-5-X5 [0,2,0,0,0,0|1,0,0]=3 440 B6R0.5 CCCS(=O)(=O)Cl 6162-5-05 [0,2,0,0,0,0|1,0,1]=4 441 B6R0.5 CCCS(N)(=O)=O P612-A-86 [0,2,0,0,0,0|1,0,1]=4 442 B6R0.5 CCOP(C)(=O)O 6177-1-37 [0,2,0,0,0,0|1,0,0]=3 443 B6R0.5 CS(=O)(=O)CCN 8163-5-X0 [0,2,0,0,0,0|1,0,1]=4 444 B6R0.5 NCCP(=O)(O)O 8177-1-35 [0,2,0,0,0,0|1,0,0]=3 445 B6R0.5 O=S(=O)(O)CCO 6164-1-0E [0,2,0,0,0,0|1,0,0]=3 446 B6R0.8 COP(=O)(O)OC 6175-1-X2 [0,2,0,0,0,0|2,0,0]=4 447 B6R0.8 COP(C)(=O)OC 8177-1-X2 [0,2,0,0,0,0|2,0,0]=4 448 B6R0.9 COC(C=O)OC 2115-1-X1 [0,2,0,0,0,0|1,0,1]=4 449 B6R0.7 CC(=O)C(C)(C)C 2117-1-05 [0,2,0,0,0,0|1,0,0]=3 450 B6R0.7 CC(=O)C(F)(F)Cl 2117-7-03 [0,2,0,0,0,0|2,0,0]=4 451 B6R0.7 CC(=O)C(F)(F)F 2117-3-01 [0,2,0,0,0,0|2,0,0]=4 452 B6R0.7 CC(=O)C(F)(F)F 2117-3-60 [0,2,0,0,0,0|2,0,0]=4 453 B6R0.7 CC(C)(Br)C(N)=O 4148-9-X0 [0,2,0,0,0,0|1,0,0]=3 454 B6R0.7 CC(C)(C)C(=N)N 4141-5-X0 [0,2,0,0,0,0|2,0,0]=4 455 B6R0.7 CC(C)(C)C(N)=O 4148-1-26 [0,2,0,0,0,0|1,0,0]=3 456 B6R0.7 CC(C)(C)C(N)=S 7169-1-00 [0,2,0,0,0,0|1,1,0]=4 457 B6R0.7 CC(C)(C)S(N)=O 8169-1-01 [0,2,0,0,0,0|2,0,0]=4 458 B6R0.7 CC(C)(C)[S@@](N)=O 8169-1-S2 [0,2,0,0,0,0|2,0,0]=4 459 B6R0.7 CC(C)(C)[S@](N)=O P311-A-51 [0,2,0,0,0,0|2,0,0]=4 460 B6R0.7 CC(C)(F)C(=O)O 2121-3-57 [0,2,0,0,0,0|0,0,0]=2 461 B6R0.7 CC(C)(O)C(=O)O 2129-1-10 [0,2,0,0,0,0|0,0,0]=2 462 B6R0.7 CC(F)(Br)C(=O)O 2121-B-06 [0,2,0,0,0,0|0,0,0]=2 463 B6R0.7 CC(F)(F)C(=O)O 2121-3-52 [0,2,0,0,0,0|0,0,0]=2 464 B6R0.7 CC(F)(F)C(=O)[O-] 2122-3-52 [0,2,0,0,0,0|0,0,1]=3 465 B6R0.7 CC(F)(F)C(N)=O 4148-3-X1 [0,2,0,0,0,0|1,0,0]=3 466 B6R0.7 NC(=O)C(Cl)(Cl)Cl 4148-5-14 [0,2,0,0,0,0|2,0,0]=4 467 B6R0.7 NC(=O)C(F)(Br)Br 4148-B-04 [0,2,0,0,0,0|2,0,0]=4 468 B6R0.7 NC(=O)C(F)(F)Br 4148-B-01 [0,2,0,0,0,0|2,0,0]=4 469 B6R0.7 NC(=O)C(F)(F)F 4148-3-03 [0,2,0,0,0,0|2,0,0]=4 470 B6R0.7 O=C(Br)C(F)(F)Br 2116-B-X1 [0,2,0,0,0,0|2,0,0]=4 471 B6R0.7 O=C(Cl)C(F)(F)Br 2116-E-01 [0,2,0,0,0,0|2,0,0]=4 472 B6R0.7 O=C(Cl)C(F)(F)Cl 2116-6-04 [0,2,0,0,0,0|2,0,0]=4 473 B6R0.7 O=C(F)C(F)(F)I 2116-J-X0 [0,2,0,0,0,0|2,0,0]=4 474 B6R0.7 O=C(O)C(Cl)(Cl)Cl 2121-5-X0 [0,2,0,0,0,0|1,0,0]=3 475 B6R0.7 O=C(O)C(F)(Br)Br 2121-B-01 [0,2,0,0,0,0|1,0,0]=3 476 B6R0.7 O=C(O)C(F)(Cl)Cl 2121-7-07 [0,2,0,0,0,0|1,0,0]=3 477 B6R0.7 O=C(O)C(F)(F)Br 2121-B-02 [0,2,0,0,0,0|1,0,0]=3 478 B6R0.7 O=C(O)C(F)(F)Cl 2121-7-01 [0,2,0,0,0,0|1,0,0]=3 479 B6R0.7 O=C(O)C(F)(F)F 2121-3-01 [0,2,0,0,0,0|1,0,0]=3 480 B6R0.7 O=C(O)C(F)(F)F 2121-3-02 [0,2,0,0,0,0|1,0,0]=3 481 B6R0.7 O=C(O)C(F)(F)F 2121-3-02L [0,2,0,0,0,0|1,0,0]=3 482 B6R0.7 O=C(O)C(F)(F)F 4H33-3-00 [0,2,0,0,0,0|1,0,0]=3 483 B6R0.7 O=C([O-])C(F)(Cl)Cl 2122-6-02 [0,2,0,0,0,0|1,0,1]=4 484 B6R0.7 O=C([O-])C(F)(F)Br 2122-A-01 [0,2,0,0,0,0|1,0,1]=4 485 B6R0.7 O=C([O-])C(F)(F)Br 2122-A-02 [0,2,0,0,0,0|1,0,1]=4 486 B6R0.7 O=C([O-])C(F)(F)Cl 2122-6-01 [0,2,0,0,0,0|1,0,1]=4 487 B6R0.7 O=C([O-])C(F)(F)F 2122-2-01 [0,2,0,0,0,0|1,0,1]=4 488 B6R0.7 O=C([O-])C(F)(F)F 2122-2-02 [0,2,0,0,0,0|1,0,1]=4 489 B6R0.7 O=C([O-])C(F)(F)F 2122-2-03 [0,2,0,0,0,0|1,0,1]=4 490 B6R0.7 O=C([O-])C(F)(F)F 2122-2-04 [0,2,0,0,0,0|1,0,1]=4 491 B6R0.7 O=C([O-])C(F)(F)F 2122-2-X0 [0,2,0,0,0,0|1,0,1]=4 492 B6R0.7 O=C([O-])C(F)(F)F 2122-2-X1 [0,2,0,0,0,0|1,0,1]=4 493 B6R0.7 O=C([O-])C(F)(F)F 2122-2-X3 [0,2,0,0,0,0|1,0,1]=4 494 B6R0.7 O=C([O-])C(F)(F)F 2122-2-X4 [0,2,0,0,0,0|1,0,1]=4 495 B6R0.7 O=C([O-])C(F)(F)F 4122-3-03 [0,2,0,0,0,0|1,0,1]=4 496 B4R1.1 C1CNC1 3H31-5-W1 [1,0,0,1,0,0|1,0,1]=4 497 B4R1.1 C1CNC1 P612-A-70 [1,0,0,1,0,0|1,0,1]=4 498 B4R1.2 BrC1CC1 1200-9-02 [1,0,0,1,0,0|1,0,1]=4 499 B4R1.2 NC1CC1 3230-1-X2 [1,0,0,1,0,0|1,0,1]=4 500 B6R1.2 CC1CCCO1 2H10-1-01 [0,1,0,1,0,0|1,0,1]=4 501 B6R1.2 CC1OCCO1 2H08-1-01 [0,1,0,1,0,0|1,0,1]=4 502 B6R1.2 NC1=NCCS1 7H30-5-01 [0,1,0,1,0,0|1,1,0]=4 503 B6R1.2 NC1CCOC1 4H30-1-07 [0,1,0,1,0,0|1,0,1]=4 504 B6R1.2 NC1CCOC1 4H56-5-2A [0,1,0,1,0,0|1,0,1]=4 505 B6R1.2 N[C@@H]1CCOC1 4H56-1-R04 [0,1,0,1,0,0|1,0,1]=4 506 B6R1.2 N[C@@H]1CCOC1 4H56-5-R0 [0,1,0,1,0,0|1,0,1]=4 507 B6R1.2 N[C@H]1CCOC1 4H56-1-S13 [0,1,0,1,0,0|1,0,1]=4 508 B6R1.2 O=C1C=CCC1 2417-1-X0 [0,1,0,1,0,0|1,0,0]=3 509 B6R1.2 O=C1CCCC1 2217-1-01 [0,1,0,1,0,0|1,0,0]=3 510 B6R1.2 O=C1CCNC1 4H17-5-04 [0,1,0,1,0,0|1,0,0]=3 511 B6R1.2 O=C1CCOC1 2H17-1-Y1 [0,1,0,1,0,0|0,0,0]=2 512 B6R1.2 O=C1CCSC1 6H66-1-Y6 [0,1,0,1,0,0|0,1,0]=3 513 B6R1.2 O=C1NCCS1 8H70-1-8S [0,1,0,1,0,0|0,1,0]=3 514 B6R1.2 OC1CCNC1 4H01-5-23 [0,1,0,1,0,0|1,0,1]=4 515 B6R1.2 OC1CCNC1 4H56-1-831 [0,1,0,1,0,0|1,0,1]=4 516 B6R1.2 OC1CCOC1 2H10-1-87 [0,1,0,1,0,0|0,0,2]=4 517 B6R1.2 O[C@@H]1CCNC1 4H01-1-M0 [0,1,0,1,0,0|1,0,1]=4 518 B6R1.2 O[C@@H]1CCNC1 4H56-1-R3 [0,1,0,1,0,0|1,0,1]=4 519 B6R1.2 O[C@@H]1CCOC1 2H01-1-Y2 [0,1,0,1,0,0|0,0,2]=4 520 B6R1.2 O[C@H]1CCNC1 4H01-1-M4 [0,1,0,1,0,0|1,0,1]=4 521 B6R1.2 O[C@H]1CCNC1 4H56-5-J2 [0,1,0,1,0,0|1,0,1]=4 522 B6R1.2 O[C@H]1CCOC1 G311-A-08 [0,1,0,1,0,0|0,0,2]=4 523 B6R1.2 S=C1CCCN1 7H67-1-31 [0,1,0,1,0,0|1,1,0]=4 524 B6R1.5 NC1CC(O)C1 4256-1-30 [0,1,0,1,0,0|1,0,1]=4 525 B6R1.11 CC(=O)C1CC1 2217-1-X9 [0,1,0,1,0,0|1,0,0]=3 526 B6R1.11 CC(O)C1CC1 2202-1-14 [0,1,0,1,0,0|1,0,1]=4 527 B6R1.11 N=C(N)C1CC1 3241-5-X2 [0,1,0,1,0,0|2,0,0]=4 528 B6R1.11 O=C(Cl)C1CC1 2216-5-X1 [0,1,0,1,0,0|1,0,0]=3 529 B6R1.11 O=C(O)C1CC1 2221-1-X1 [0,1,0,1,0,0|0,0,0]=2 530 B6R1.11 OB(O)C1CC1 P911-A-22 [0,1,0,1,0,0|1,0,1]=4 531 B6R1.6 O=CC1CCC1 2215-1-03 [0,1,0,1,0,0|1,0,1]=4