0 B4R0.1 C#CC(=O)O 2521-1-01 [0,0,0,0,0,0|3,0,0]=3 1 B4R0.1 C#CC(C)O 2502-1-01 [0,0,0,0,0,0|2,0,2]=4 2 B4R0.1 C#CC(N)=O 4148-1-01 [0,0,0,0,0,0|3,0,0]=3 3 B4R0.1 C#C[C@@H](C)O 2502-1-R1 [0,0,0,0,0,0|2,0,2]=4 4 B4R0.1 C=C(Br)CC 1300-9-24 [0,0,0,0,0,0|3,0,1]=4 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|3,0,0]=3 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|2,0,0]=2 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|3,0,1]=4 12 B4R0.1 C=C(Cl)CF 1300-7-23 [0,0,0,0,0,0|3,0,1]=4 13 B4R0.1 C=C(Cl)CO 2301-5-02 [0,0,0,0,0,0|2,0,1]=3 14 B4R0.1 C=C(Cl)CO 2301-5-02T [0,0,0,0,0,0|2,0,1]=3 15 B4R0.1 C=C(F)CBr 1300-B-49 [0,0,0,0,0,0|3,0,1]=4 16 B4R0.1 C=C(F)CCl 1300-7-14 [0,0,0,0,0,0|3,0,1]=4 17 B4R0.1 C=C(F)CN 3330-3-32 [0,0,0,0,0,0|3,0,1]=4 18 B4R0.1 C=C(F)CO 2301-3-03 [0,0,0,0,0,0|2,0,1]=3 19 B4R0.1 C=CC(=C)C 1300-1-49 [0,0,0,0,0,0|3,0,0]=3 20 B4R0.1 C=CC(C)C 1300-1-26 [0,0,0,0,0,0|3,0,1]=4 21 B4R0.1 C=CC(C)Cl 1300-5-41 [0,0,0,0,0,0|3,0,1]=4 22 B4R0.1 CC(=O)C=O 2117-1-X0 [0,0,0,0,0,0|1,0,1]=2 23 B4R0.1 CC(=O)C=O 2117-1-X0A [0,0,0,0,0,0|1,0,1]=2 24 B4R0.1 CC(=O)CF 2117-3-10 [0,0,0,0,0,0|2,0,0]=2 25 B4R0.1 CC(=O)CO 2120-1-01 [0,0,0,0,0,0|1,0,0]=1 26 B4R0.1 CC(=O)NN 4156-1-2V [0,0,0,0,0,0|2,0,0]=2 27 B4R0.1 CC(C)C#N 3137-1-Y4 [0,0,0,0,0,0|3,0,1]=4 28 B4R0.1 CC(C)C=O 2115-1-13 [0,0,0,0,0,0|2,0,2]=4 29 B4R0.1 CC(C)NN 3139-5-X2 [0,0,0,0,0,0|3,0,1]=4 30 B4R0.1 CC(C)[Mg]Cl 9112-5-04 [0,0,0,0,0,0|3,0,1]=4 31 B4R0.1 CC(F)CO 2101-3-64 [0,0,0,0,0,0|2,0,1]=3 32 B4R0.1 CC(N)CO 4156-1-92 [0,0,0,0,0,0|2,0,1]=3 33 B4R0.1 CC(O)CF 2102-3-12 [0,0,0,0,0,0|2,0,2]=4 34 B4R0.1 CC(O)CO 2104-1-12 [0,0,0,0,0,0|1,0,2]=3 35 B4R0.1 CC=C(Cl)Cl 1300-5-42 [0,0,0,0,0,0|4,0,0]=4 36 B4R0.1 CCC(=N)N 3141-5-03 [0,0,0,0,0,0|4,0,0]=4 37 B4R0.1 CCC(C)Cl 1100-5-25 [0,0,0,0,0,0|3,0,1]=4 38 B4R0.1 CCC(C)F 1100-3-47 [0,0,0,0,0,0|3,0,1]=4 39 B4R0.1 CCC(C)I 1100-H-X6 [0,0,0,0,0,0|3,0,1]=4 40 B4R0.1 CC[C@@H](C)O 2101-1-R1 [0,0,0,0,0,0|2,0,2]=4 41 B4R0.1 CN(C)C=O 4148-1-03 [0,0,0,0,0,0|3,0,1]=4 42 B4R0.1 CNC(N)=S 7167-1-20 [0,0,0,0,0,0|3,1,0]=4 43 B4R0.1 COC(=N)N 8153-1-01 [0,0,0,0,0,0|3,0,0]=3 44 B4R0.1 COC(Cl)Cl 2107-5-05 [0,0,0,0,0,0|3,0,1]=4 45 B4R0.1 CSC(=N)N 7167-H-X1 [0,0,0,0,0,0|3,1,0]=4 46 B4R0.1 CSC(=N)N 8167-1-01 [0,0,0,0,0,0|3,1,0]=4 47 B4R0.1 C[C@@H](N)CO 4156-1-R3 [0,0,0,0,0,0|2,0,1]=3 48 B4R0.1 C[C@@H](O)CN 4156-1-R2 [0,0,0,0,0,0|2,0,2]=4 49 B4R0.1 C[C@@H](O)CO 2104-1-R3 [0,0,0,0,0,0|1,0,2]=3 50 B4R0.1 C[C@H](O)CN 4156-1-S2 [0,0,0,0,0,0|2,0,2]=4 51 B4R0.1 C[C@H](O)CO 2104-1-S3 [0,0,0,0,0,0|1,0,2]=3 52 B4R0.1 C\C(Cl)=C/Cl 1300-5-18 [0,0,0,0,0,0|3,0,0]=3 53 B4R0.1 C\C(Cl)=C\Cl 1300-5-Z0 [0,0,0,0,0,0|3,0,0]=3 54 B4R0.1 C\C(N)=N\O 4147-1-X0 [0,0,0,0,0,0|2,0,0]=2 55 B4R0.1 ClC=C(Cl)Cl 1300-5-03 [0,0,0,0,0,0|4,0,0]=4 56 B4R0.1 N=C(N)CCl 3141-5-X3 [0,0,0,0,0,0|4,0,0]=4 57 B4R0.1 NC(=O)CBr 4148-9-X4 [0,0,0,0,0,0|3,0,0]=3 58 B4R0.1 NC(=O)CCl 4148-5-00 [0,0,0,0,0,0|3,0,0]=3 59 B4R0.1 O=C(Br)CBr 2116-9-03 [0,0,0,0,0,0|3,0,0]=3 60 B4R0.1 O=C(Cl)SCl 6171-5-00 [0,0,0,0,0,0|2,1,0]=3 61 B4R0.1 O=C(O)CBr 2121-9-01 [0,0,0,0,0,0|3,0,0]=3 62 B4R0.1 O=C(O)CI 2121-H-00 [0,0,0,0,0,0|3,0,0]=3 63 B4R0.1 O=C(O)CO 2129-1-20 [0,0,0,0,0,0|2,0,0]=2 64 B4R0.1 O=CC(=O)O 2129-1-X4 [0,0,0,0,0,0|2,0,1]=3 65 B4R0.1 O=S([O-])CO 6165-1-06 [0,0,0,0,0,0|3,0,0]=3 66 B4R0.1 O=[N+]([O-])CBr 4154-9-X0 [0,0,0,0,0,0|4,0,0]=4 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|3,0,0]=3 69 B4R0.1 [C@@H](C)(N)CC 3130-1-S1 [0,0,0,0,0,0|3,0,1]=4 70 B4R0.1 [C@@H](C)(N)CO 4156-1-Y5 [0,0,0,0,0,0|2,0,1]=3 71 B4R0.1 [C@H](C)(N)CC 3130-1-R1 [0,0,0,0,0,0|3,0,1]=4 72 B3R0.1 C#CCC 1500-1-05 [1,0,0,0,0,0|2,0,1]=4 73 B3R0.1 C=CCBr 1300-9-02 [1,0,0,0,0,0|2,0,1]=4 74 B3R0.1 C=CCC 1300-1-25 [1,0,0,0,0,0|2,0,1]=4 75 B3R0.1 C=CCCl 1300-5-10 [1,0,0,0,0,0|2,0,1]=4 76 B3R0.1 C=CCF 1300-3-09 [1,0,0,0,0,0|2,0,1]=4 77 B3R0.1 C=CCI 1300-H-01 [1,0,0,0,0,0|2,0,1]=4 78 B3R0.1 CC#CC 1500-1-02 [1,0,0,0,0,0|2,0,1]=4 79 B3R0.1 CCC=O 2115-1-05 [1,0,0,0,0,0|2,0,0]=3 80 B3R0.1 CCCBr 1100-9-37 [1,0,0,0,0,0|2,0,1]=4 81 B3R0.1 CCCC 1100-1-X0 [1,0,0,0,0,0|2,0,1]=4 82 B3R0.1 CCCCl 1100-5-01 [1,0,0,0,0,0|2,0,1]=4 83 B3R0.1 CCCI 1100-H-X9 [1,0,0,0,0,0|2,0,1]=4 84 B3R0.1 CCNN 3139-5-05 [1,0,0,0,0,0|2,0,1]=4 85 B3R0.1 CNOC 4147-5-01 [1,0,0,0,0,0|2,0,0]=3 86 B3R0.1 COCBr 2107-9-01 [1,0,0,0,0,0|2,0,1]=4 87 B3R0.1 C\C=C/C 1300-1-29 [1,0,0,0,0,0|2,0,0]=3 88 B3R0.1 C\C=C\C 1300-1-04 [1,0,0,0,0,0|2,0,0]=3 89 B3R0.1 C\C=C\Cl 1300-5-17 [1,0,0,0,0,0|2,0,0]=3 90 B3R0.1 C\C=C\Cl 1300-5-E1 [1,0,0,0,0,0|2,0,0]=3 91 B3R0.1 Cl\C=C\Cl 1300-5-13 [1,0,0,0,0,0|3,0,0]=4 92 B3R0.1 OCCBr 2101-9-02 [1,0,0,0,0,0|2,0,1]=4 93 B3R0.2 C=C(C)C 1300-1-06 [1,0,0,0,0,0|2,0,0]=3 94 B3R0.2 C=C(C)Cl 1300-5-21 [1,0,0,0,0,0|2,0,0]=3 95 B3R0.2 C=C(Cl)Cl 1300-5-11 [1,0,0,0,0,0|2,0,1]=4 96 B3R0.2 C=C(F)Cl 1300-7-03 [1,0,0,0,0,0|2,0,1]=4 97 B3R0.2 CB(O)O 6160-1-X6 [1,0,0,0,0,0|1,0,1]=3 98 B3R0.2 CC(=O)Cl 2116-5-01 [1,0,0,0,0,0|1,0,0]=2 99 B3R0.2 CC(=O)O 4141-1-X0 [1,0,0,0,0,0|0,0,0]=1 100 B3R0.2 CC(=O)[O-] 2122-1-02 [1,0,0,0,0,0|0,0,1]=2 101 B3R0.2 CC(=O)[O-] 2122-1-19 [1,0,0,0,0,0|0,0,1]=2 102 B3R0.2 CC(=O)[O-] 2122-1-29 [1,0,0,0,0,0|0,0,1]=2 103 B3R0.2 CC(=O)[O-] 2122-1-46 [1,0,0,0,0,0|0,0,1]=2 104 B3R0.2 CC(=O)[O-] 2122-1-46H [1,0,0,0,0,0|0,0,1]=2 105 B3R0.2 CC(=O)[O-] M029-1-01 [1,0,0,0,0,0|0,0,1]=2 106 B3R0.2 CC(=O)[O-] M056-1-X0 [1,0,0,0,0,0|0,0,1]=2 107 B3R0.2 CC(=O)[S-] 6161-1-05 [1,0,0,0,0,0|0,1,0]=2 108 B3R0.2 CC(C)Br 1100-9-02 [1,0,0,0,0,0|2,0,1]=4 109 B3R0.2 CC(C)C 1100-1-19 [1,0,0,0,0,0|2,0,1]=4 110 B3R0.2 CC(C)I 1100-H-03 [1,0,0,0,0,0|2,0,1]=4 111 B3R0.2 CC(C)N 3130-5-X1 [1,0,0,0,0,0|2,0,1]=4 112 B3R0.2 CC(Cl)Cl 1100-5-12 [1,0,0,0,0,0|2,0,1]=4 113 B3R0.2 CC(F)Br 1100-B-20 [1,0,0,0,0,0|2,0,1]=4 114 B3R0.2 CC(F)Cl 1100-7-04SM [1,0,0,0,0,0|2,0,1]=4 115 B3R0.2 CC(F)F 1100-3-05 [1,0,0,0,0,0|2,0,1]=4 116 B3R0.2 CC(N)=S 7167-1-X0 [1,0,0,0,0,0|1,1,0]=3 117 B3R0.2 CN(C)C 3132-1-05 [1,0,0,0,0,0|3,0,0]=4 118 B3R0.2 CN(C)C 8132-1-X0 [1,0,0,0,0,0|3,0,0]=4 119 B3R0.2 CS(=O)[O-] 6165-1-X0 [1,0,0,0,0,0|1,0,1]=3 120 B3R0.2 C[S+](C)C 5171-H-01 [1,0,0,0,0,0|3,0,0]=4 121 B3R0.2 N=C(N)Cl 3141-5-X4 [1,0,0,0,0,0|3,0,0]=4 122 B3R0.2 N=C(N)N 3141-5-X1 [1,0,0,0,0,0|3,0,0]=4 123 B3R0.2 NC(N)=O 4153-1-01 [1,0,0,0,0,0|2,0,0]=3 124 B3R0.2 O=C([O-])[O-] M019-0-02 [1,0,0,0,0,0|1,0,1]=3 125 B3R0.2 O=C([O-])[O-] M021-1-04 [1,0,0,0,0,0|1,0,1]=3 126 B3R0.2 O=S([O-])O M011-1-06 [1,0,0,0,0,0|2,0,0]=3 127 B3R0.2 O=S([O-])O M011-1-06HP [1,0,0,0,0,0|2,0,0]=3 128 B3R0.2 O=S([O-])[O-] M019-0-01 [1,0,0,0,0,0|2,0,1]=4 129 B3R0.2 O=[N+]([O-])[O-] M020-1-X0 [1,0,0,0,0,0|2,0,1]=4 130 B3R0.2 O=[N+]([O-])[O-] M021-1-05 [1,0,0,0,0,0|2,0,1]=4 131 B3R0.2 O=[N+]([O-])[O-] M057-1-01 [1,0,0,0,0,0|2,0,1]=4 132 B5R0.1 C=COC(C)=O 2324-1-50 [0,1,0,0,0,0|1,0,0]=2 133 B5R0.1 CC#CC(=O)O 2521-1-13 [0,1,0,0,0,0|3,0,0]=4 134 B5R0.1 CC(C)=CCBr 1300-9-X0 [0,1,0,0,0,0|3,0,0]=4 135 B5R0.1 CC(C)=CCCl 1300-5-X0 [0,1,0,0,0,0|3,0,0]=4 136 B5R0.1 CC(C)CCO 2101-1-53 [0,1,0,0,0,0|2,0,1]=4 137 B5R0.1 CC(N)CCO 4156-1-4D [0,1,0,0,0,0|2,0,1]=4 138 B5R0.1 CCCC(=O)Cl 2116-5-09 [0,1,0,0,0,0|3,0,0]=4 139 B5R0.1 CCCC(=O)[O-] 2122-1-X1 [0,1,0,0,0,0|3,0,0]=4 140 B5R0.1 CCNC(N)=O 4153-1-X1 [0,1,0,0,0,0|3,0,0]=4 141 B5R0.1 CCOC(=S)[S-] 6167-1-02 [0,1,0,0,0,0|2,1,0]=4 142 B5R0.1 COCC(=O)Cl 2116-5-X4 [0,1,0,0,0,0|2,0,0]=3 143 B5R0.1 CSCC(=O)O 6166-1-05 [0,1,0,0,0,0|2,1,0]=4 144 B5R0.1 C[C@@H](N)CCO 4156-1-RB [0,1,0,0,0,0|2,0,1]=4 145 B5R0.1 C[C@@H](O)CCO 2101-1-X0 [0,1,0,0,0,0|1,0,2]=4 146 B5R0.1 NC(=O)CCBr 4148-9-00 [0,1,0,0,0,0|3,0,0]=4 147 B5R0.1 NC(=O)CCCl 4148-5-02 [0,1,0,0,0,0|3,0,0]=4 148 B5R0.1 O=C(O)CCO 2129-1-Y8 [0,1,0,0,0,0|2,0,0]=3 149 B5R0.3 C#CC(=O)OC 2523-1-X1 [0,1,0,0,0,0|1,0,1]=3 150 B5R0.3 C=C(CCl)CCl 1300-5-X1 [0,1,0,0,0,0|3,0,0]=4 151 B5R0.3 C=C(CO)CO 2304-1-X0 [0,1,0,0,0,0|2,0,0]=3 152 B5R0.3 CCC(=O)CBr 2117-9-01 [0,1,0,0,0,0|2,0,0]=3 153 B5R0.3 CCC(C)C=O 2115-1-0C [0,1,0,0,0,0|2,0,1]=4 154 B5R0.3 CCC(N)CO 4156-1-38 [0,1,0,0,0,0|2,0,1]=4 155 B5R0.3 CC[C@@H](N)CO 4156-1-R4 [0,1,0,0,0,0|2,0,1]=4 156 B5R0.3 CC[C@H](N)CO 4156-1-W2 [0,1,0,0,0,0|2,0,1]=4 157 B5R0.3 CNC(=S)NN 7167-1-19 [0,1,0,0,0,0|2,1,0]=4 158 B5R0.3 COC(=O)CBr 2123-9-36 [0,1,0,0,0,0|1,0,0]=2 159 B5R0.3 COC(=O)CN 4158-5-40 [0,1,0,0,0,0|1,0,0]=2 160 B5R0.3 COC(=O)CO 2129-1-X2 [0,1,0,0,0,0|1,0,0]=2 161 B5R0.3 COC(=O)CS 6161-1-X3 [0,1,0,0,0,0|1,0,0]=2 162 B5R0.3 COC(=O)NN 4156-1-39 [0,1,0,0,0,0|2,0,0]=3 163 B5R0.3 COS(=O)OC 6164-1-13 [0,1,0,0,0,0|2,0,0]=3 164 B5R0.3 CO[PH](=O)OC 6177-1-0G [0,1,0,0,0,0|2,0,0]=3 165 B5R0.3 CSC(=N)NN 7167-H-X0 [0,1,0,0,0,0|3,0,0]=4 166 B5R0.3 CSC(=S)NN 8169-1-0B [0,1,0,0,0,0|2,1,0]=4 167 B5R0.3 C\C(C=O)=C/N 4356-1-X1 [0,1,0,0,0,0|2,0,0]=3 168 B5R0.3 NC(CO)CO 4104-1-X0 [0,1,0,0,0,0|2,0,1]=4 169 B5R0.3 NCC(O)CO 4156-1-Z8 [0,1,0,0,0,0|1,0,2]=4 170 B5R0.3 O=C(CBr)CBr 2117-9-03 [0,1,0,0,0,0|2,0,0]=3 171 B5R0.3 O=C(CF)CF 2117-3-09 [0,1,0,0,0,0|2,0,0]=3 172 B5R0.3 OCC(O)CBr 2104-9-01 [0,1,0,0,0,0|1,0,2]=4 173 B5R0.3 OCC(O)CS 6161-1-X4 [0,1,0,0,0,0|1,0,2]=4 174 B5R0.4 CC(C)(C)CO 2101-1-08 [0,1,0,0,0,0|2,0,1]=4 175 B5R0.4 CC(C)(C)NO 4147-5-X0 [0,1,0,0,0,0|2,0,1]=4 176 B5R0.4 CC(C)(F)CO 2101-3-97 [0,1,0,0,0,0|2,0,1]=4 177 B5R0.4 CC(C)(N)CO 4156-1-X8 [0,1,0,0,0,0|2,0,1]=4 178 B5R0.4 CC(C)(O)CO 2104-1-09 [0,1,0,0,0,0|1,0,2]=4 179 B5R0.4 CC(F)(F)CO 2101-3-52 [0,1,0,0,0,0|2,0,1]=4 180 B5R0.4 CCS(C)(=O)=O 6163-1-0B [0,1,0,0,0,0|3,0,0]=4 181 B5R0.4 CNS(C)(=O)=O 8169-1-11 [0,1,0,0,0,0|3,0,0]=4 182 B5R0.4 NOS(=O)(=O)O P612-A-67 [0,1,0,0,0,0|3,0,0]=4 183 B5R0.5 C=C(C)C(C)C 1300-1-24 [0,1,0,0,0,0|3,0,0]=4 184 B5R0.5 C=C(F)C(=O)O 2321-3-06 [0,1,0,0,0,0|2,0,1]=4 185 B5R0.5 CC(=O)C(=O)O 2129-1-03 [0,1,0,0,0,0|1,0,0]=2 186 B5R0.5 CC(=O)C(C)=O 2118-1-05 [0,1,0,0,0,0|1,0,1]=3 187 B5R0.5 CC(=O)C(C)C 2117-1-13 [0,1,0,0,0,0|2,0,0]=3 188 B5R0.5 CC(=O)C(C)F 2117-3-11 [0,1,0,0,0,0|2,0,0]=3 189 B5R0.5 CC(=O)C(F)F 2117-3-13 [0,1,0,0,0,0|2,0,0]=3 190 B5R0.5 CC(=O)N(C)C 4148-1-08 [0,1,0,0,0,0|2,0,0]=3 191 B5R0.5 CC(Br)C(N)=O 4157-9-X1 [0,1,0,0,0,0|3,0,0]=4 192 B5R0.5 CC(C)=C(C)C 1300-1-X1 [0,1,0,0,0,0|3,0,0]=4 193 B5R0.5 CC(C)B(O)O 6160-1-X0 [0,1,0,0,0,0|2,0,1]=4 194 B5R0.5 CC(C)C(=O)Cl 2116-5-05 [0,1,0,0,0,0|3,0,0]=4 195 B5R0.5 CC(F)C(=O)O 2121-3-95 [0,1,0,0,0,0|2,0,1]=4 196 B5R0.5 CC(N)C(N)=O 4158-5-X5 [0,1,0,0,0,0|3,0,0]=4 197 B5R0.5 CC(O)C(C)O 2104-1-07 [0,1,0,0,0,0|1,0,2]=4 198 B5R0.5 C[C@@H](Cl)C(=O)O 2121-5-R1 [0,1,0,0,0,0|2,0,1]=4 199 B5R0.5 C[C@@H](O)C(N)=O 4148-1-R1 [0,1,0,0,0,0|2,0,0]=3 200 B5R0.5 C[C@@H](O)[C@@H](C)O 2104-1-R1 [0,1,0,0,0,0|1,0,2]=4 201 B5R0.5 C[C@H](N)C(=O)O 4157-1-S5 [0,1,0,0,0,0|2,0,1]=4 202 B5R0.5 C[C@H](N)C(N)=O 4148-5-04 [0,1,0,0,0,0|3,0,0]=4 203 B5R0.5 C[C@H](O)C(=O)O 2129-1-S8 [0,1,0,0,0,0|2,0,0]=3 204 B5R0.5 C[C@H](O)[C@H](C)O 2104-1-X2 [0,1,0,0,0,0|1,0,2]=4 205 B5R0.5 NC(=O)C(Cl)Cl 4148-5-X4 [0,1,0,0,0,0|3,0,0]=4 206 B5R0.5 NC(=O)C(F)Br 4148-B-02 [0,1,0,0,0,0|3,0,0]=4 207 B5R0.5 NC(=O)C(F)Cl 4148-7-03 [0,1,0,0,0,0|3,0,0]=4 208 B5R0.5 NC(=O)C(F)F 4148-3-18 [0,1,0,0,0,0|3,0,0]=4 209 B5R0.5 NC(=O)C(F)I 4148-K-01 [0,1,0,0,0,0|3,0,0]=4 210 B5R0.5 NC(=O)C(N)=O 4148-1-18 [0,1,0,0,0,0|2,0,1]=4 211 B5R0.5 O=C(Cl)C(=O)Cl 2116-4-02 [0,1,0,0,0,0|2,0,1]=4 212 B5R0.5 O=C(Cl)C(Cl)Cl 2116-5-00 [0,1,0,0,0,0|3,0,0]=4 213 B5R0.5 O=C(O)C(=O)O 2121-1-12 [0,1,0,0,0,0|2,0,0]=3 214 B5R0.5 O=C(O)C(F)Br 2121-B-03 [0,1,0,0,0,0|3,0,0]=4 215 B5R0.5 O=C(O)C(F)Cl 2121-7-03 [0,1,0,0,0,0|3,0,0]=4 216 B5R0.5 O=C(O)C(F)F 2121-3-05 [0,1,0,0,0,0|3,0,0]=4 217 B5R0.5 O=C(O)C(F)I 2121-K-01 [0,1,0,0,0,0|3,0,0]=4 218 B5R0.5 O=C([O-])C(=O)[O-] 2122-0-00 [0,1,0,0,0,0|2,0,1]=4 219 B5R0.5 O=C([O-])C(=O)[O-] 2122-1-06 [0,1,0,0,0,0|2,0,1]=4 220 B5R0.5 O=C([O-])C(=O)[O-] M068-1-X0 [0,1,0,0,0,0|2,0,1]=4 221 B5R0.5 O=C([O-])C(=O)[O-] M068-1-X1 [0,1,0,0,0,0|2,0,1]=4 222 B5R0.5 O=C([O-])C(F)Br 2122-B-01 [0,1,0,0,0,0|3,0,0]=4 223 B5R0.5 O=C([O-])C(F)Cl 2122-7-01 [0,1,0,0,0,0|3,0,0]=4 224 B5R0.5 O=C([O-])C(F)F 2122-3-02 [0,1,0,0,0,0|3,0,0]=4 225 B5R0.5 O=C([O-])C(F)F 2122-3-07 [0,1,0,0,0,0|3,0,0]=4 226 B5R0.5 [C@@H](C)(Cl)C(=O)O 2121-5-S1 [0,1,0,0,0,0|2,0,1]=4 227 B5R1.2 BrC1COC1 2H10-9-07 [0,0,0,1,0,0|2,0,1]=4 228 B5R1.2 IC1COC1 2H10-H-05 [0,0,0,1,0,0|2,0,1]=4 229 B5R1.2 O=C1CCC1 2217-1-X6 [0,0,0,1,0,0|2,0,0]=3 230 B5R1.2 O=C1CCN1 4H48-1-F4 [0,0,0,1,0,0|2,0,0]=3 231 B5R1.2 O=C1CNC1 4H56-5-05 [0,0,0,1,0,0|2,0,0]=3 232 B5R1.2 O=C1COC1 2H17-1-05 [0,0,0,1,0,0|1,0,0]=2 233 B5R1.2 O=C1CSC1 6H66-1-39 [0,0,0,1,0,0|1,1,0]=3 234 B5R1.2 OC1COC1 2H01-1-X3 [0,0,0,1,0,0|1,0,2]=4 235 B5R1.3 OCC1CC1 2301-1-X2 [0,0,0,1,0,0|2,0,1]=4 236 B5R1.3 OC[C@@H]1CO1 2109-1-R2 [0,0,0,1,0,0|1,0,2]=4 237 B5R1.3 OC[C@H]1CO1 2109-1-S1 [0,0,0,1,0,0|1,0,2]=4 238 B5R1.5 CC1(C)CO1 2109-1-03 [0,0,0,1,0,0|2,0,1]=4 239 B2R0.1 C#CC 1500-1-01 [2,0,0,0,0,0|1,0,1]=4 240 B2R0.1 C=CBr 1300-9-01 [2,0,0,0,0,0|1,0,1]=4 241 B2R0.1 C=CBr 1300-9-01ST [2,0,0,0,0,0|1,0,1]=4 242 B2R0.1 C=CC 1300-1-02 [2,0,0,0,0,0|1,0,0]=3 243 B2R0.1 CCBr 1100-9-04 [2,0,0,0,0,0|1,0,1]=4 244 B2R0.1 CCI 1100-H-10 [2,0,0,0,0,0|1,0,1]=4 245 B2R0.1 CCN 3130-1-10 [2,0,0,0,0,0|1,0,1]=4 246 B2R0.1 CC[O-] 9122-1-X0 [2,0,0,0,0,0|0,0,2]=4 247 B2R0.1 CNC 3131-1-X3 [2,0,0,0,0,0|2,0,0]=4 248 B2R0.1 CNO 4156-5-10 [2,0,0,0,0,0|1,0,0]=3 249 B2R0.1 COC 2107-1-01 [2,0,0,0,0,0|1,0,0]=3 250 B2R0.1 CON 4147-5-X3 [2,0,0,0,0,0|1,0,0]=3 251 B2R0.1 O=C[O-] 2122-1-07 [2,0,0,0,0,0|0,0,1]=3 252 B2R0.1 O=C[O-] 9130-1-00 [2,0,0,0,0,0|0,0,1]=3 253 B2R0.1 O=[Si]=O SI24001A [2,0,0,0,0,0|0,1,1]=4 254 B4R0.2 C#COCC 2507-1-01 [1,1,0,0,0,0|1,0,1]=4 255 B4R0.2 CC#CCO 2501-1-04 [1,1,0,0,0,0|1,0,1]=4 256 B4R0.2 CCOCC 6160-3-09 [1,1,0,0,0,0|1,0,1]=4 257 B4R0.2 CCOCCl 2107-5-01 [1,1,0,0,0,0|1,0,1]=4 258 B4R0.2 CNCCO 4156-1-3Y [1,1,0,0,0,0|1,0,1]=4 259 B4R0.2 COCCBr 2107-9-X1 [1,1,0,0,0,0|1,0,1]=4 260 B4R0.2 COCCCl 2107-5-0R [1,1,0,0,0,0|1,0,1]=4 261 B4R0.2 COCCN 4130-1-X3 [1,1,0,0,0,0|1,0,1]=4 262 B4R0.2 COCOC 2108-1-07 [1,1,0,0,0,0|1,0,1]=4 263 B4R0.2 C\C=C\CC 1300-1-05 [1,1,0,0,0,0|2,0,0]=4 264 B4R0.2 Cl\C=C\CCl 1300-5-28 [1,1,0,0,0,0|2,0,0]=4 265 B4R0.2 OCCCBr 2101-9-X2 [1,1,0,0,0,0|1,0,1]=4 266 B4R0.2 OCCCCl 2101-5-13 [1,1,0,0,0,0|1,0,1]=4 267 B4R0.2 OCCCF 2101-3-50 [1,1,0,0,0,0|1,0,1]=4 268 B4R0.2 OCCCI 2101-H-01 [1,1,0,0,0,0|1,0,1]=4 269 B4R0.2 OCCCO 2104-1-11 [1,1,0,0,0,0|1,0,1]=4 270 B4R0.3 CC(C)(C)O 2103-1-01 [1,1,0,0,0,0|1,0,1]=4 271 B4R0.3 CS(=O)(=O)Cl 6162-5-01 [1,1,0,0,0,0|1,0,1]=4 272 B4R0.3 CS(=O)(=O)F 6162-3-01 [1,1,0,0,0,0|1,0,1]=4 273 B4R0.3 CS(=O)(=O)O 6164-1-17 [1,1,0,0,0,0|1,0,0]=3 274 B4R0.3 CS(C)(=N)=O 8169-1-04 [1,1,0,0,0,0|2,0,0]=4 275 B4R0.3 CS(N)(=O)=O 8169-1-X1 [1,1,0,0,0,0|1,0,1]=4 276 B4R0.3 C[S+](C)(C)=O 6165-5-00 [1,1,0,0,0,0|2,0,0]=4 277 B4R0.3 C[S+](C)(C)=O 6165-H-X0 [1,1,0,0,0,0|2,0,0]=4 278 B4R0.3 C[Si](C)(C)O 6182-1-X0 [1,1,0,0,0,0|1,1,0]=4 279 B4R0.3 O=P(O)(F)F M001-3-33 [1,1,0,0,0,0|2,0,0]=4 280 B4R0.3 O=P(O)(O)O M015-1-42 [1,1,0,0,0,0|2,0,0]=4 281 B4R0.3 O=[As]([O-])(O)O M033-0-01 [1,1,0,0,0,0|2,0,0]=4 282 B6R0.1 CCCC(=N)NO 4141-1-X1 [0,2,0,0,0,0|2,0,0]=4 283 B6R0.1 CCCC(=O)NN 4156-1-15 [0,2,0,0,0,0|2,0,0]=4 284 B6R0.1 CCOC(=O)C=O 2323-1-X0 [0,2,0,0,0,0|1,0,1]=4 285 B6R0.1 CCOC(=O)CCl 2123-5-01 [0,2,0,0,0,0|1,0,0]=3 286 B6R0.1 CCOC(=O)CN 4158-5-25 [0,2,0,0,0,0|1,0,0]=3 287 B6R0.1 CCOC(=O)CS 6161-1-03 [0,2,0,0,0,0|1,0,0]=3 288 B6R0.1 CCOC(=O)NN 4156-1-55 [0,2,0,0,0,0|2,0,0]=4 289 B6R0.1 CNC(=O)CC#N 4148-1-X3 [0,2,0,0,0,0|2,0,0]=4 290 B6R0.1 CNC(=O)CCN 4148-1-13 [0,2,0,0,0,0|2,0,0]=4 291 B6R0.1 CNCC(=O)OC 4158-5-X0 [0,2,0,0,0,0|1,0,0]=3 292 B6R0.1 COC(=O)CC#N 4137-1-X2 [0,2,0,0,0,0|1,0,0]=3 293 B6R0.1 COC(=O)CCN 4158-1-02 [0,2,0,0,0,0|1,0,0]=3 294 B6R0.1 COC(=O)CSC 6166-1-06 [0,2,0,0,0,0|1,0,0]=3 295 B6R0.1 [C-]#[N+]CC(=O)OC 4149-1-06 [0,2,0,0,0,0|1,0,0]=3 296 B6R0.2 CC(=O)CC(C)=O 2118-1-01 [0,2,0,0,0,0|1,0,1]=4 297 B6R0.2 CC(=O)CC(C)C 2118-1-02 [0,2,0,0,0,0|2,0,0]=4 298 B6R0.2 CC(=O)NC(=N)N 3153-1-X0 [0,2,0,0,0,0|2,0,0]=4 299 B6R0.2 CC(=O)\C=C(\C)N 4356-1-06 [0,2,0,0,0,0|2,0,0]=4 300 B6R0.2 CC(=O)\C=C(\C)[O-] 9128-1-X0 [0,2,0,0,0,0|1,0,1]=4 301 B6R0.2 CC(C)=CB(O)O 6360-1-X3 [0,2,0,0,0,0|2,0,0]=4 302 B6R0.2 CC(C)=CC(=O)O 2321-1-X4 [0,2,0,0,0,0|2,0,0]=4 303 B6R0.2 CC(Cl)OC(=O)Cl 2116-5-X1 [0,2,0,0,0,0|2,0,0]=4 304 B6R0.2 CC(O)CC(=O)[O-] 2129-1-35 [0,2,0,0,0,0|2,0,0]=4 305 B6R0.2 O=C(O)CC(=O)O 2121-1-05 [0,2,0,0,0,0|2,0,0]=4 306 B6R0.3 C=C(F)C(=O)OC 2324-3-76 [0,2,0,0,0,0|1,0,1]=4 307 B6R0.3 CC(=O)C(=O)CBr 2118-9-01 [0,2,0,0,0,0|1,0,1]=4 308 B6R0.3 CC(C)C(=N)NO 4156-1-Z3 [0,2,0,0,0,0|2,0,0]=4 309 B6R0.3 CCC(=O)C(C)C 2117-1-18 [0,2,0,0,0,0|2,0,0]=4 310 B6R0.3 CC[C@H](O)C(=O)O 2129-1-SF [0,2,0,0,0,0|2,0,0]=4 311 B6R0.3 CN(C)C(=O)CBr 4148-9-08 [0,2,0,0,0,0|2,0,0]=4 312 B6R0.3 CNC(=O)C(=O)O 4156-1-Y4 [0,2,0,0,0,0|1,0,0]=3 313 B6R0.3 CNC(=O)C(C)N 4148-1-1M [0,2,0,0,0,0|2,0,0]=4 314 B6R0.3 CNC(=O)C(F)Br 4148-B-03 [0,2,0,0,0,0|2,0,0]=4 315 B6R0.3 CNC(=O)C(F)Cl 4148-7-04 [0,2,0,0,0,0|2,0,0]=4 316 B6R0.3 CNC(=O)C(F)I 4148-K-02 [0,2,0,0,0,0|2,0,0]=4 317 B6R0.3 COC(=O)C(=O)Cl 2129-5-0K [0,2,0,0,0,0|1,0,1]=4 318 B6R0.3 COC(=O)C(C)Cl 2123-5-05 [0,2,0,0,0,0|1,0,0]=3 319 B6R0.3 COC(=O)C(C)F 2123-3-1X [0,2,0,0,0,0|1,0,0]=3 320 B6R0.3 COC(=O)C(C)O 2129-1-70 [0,2,0,0,0,0|1,0,0]=3 321 B6R0.3 COC(=O)C(F)F 2123-3-02 [0,2,0,0,0,0|1,0,0]=3 322 B6R0.3 COC(=O)[C@H](C)N 4158-5-45 [0,2,0,0,0,0|1,0,0]=3 323 B6R0.3 CON(C)C(C)=O 4148-1-44 [0,2,0,0,0,0|1,0,0]=3 324 B6R0.3 C\C(=N\O)C(F)F 4147-3-02 [0,2,0,0,0,0|2,0,0]=4 325 B6R0.3 C\C=C(/C)C(=O)O 2321-1-17 [0,2,0,0,0,0|2,0,0]=4 326 B6R0.3 C\C=C(/C)C(=O)O 2321-1-E0 [0,2,0,0,0,0|2,0,0]=4 327 B6R0.3 C\C=C(/C)C(C)=O 2317-1-02 [0,2,0,0,0,0|2,0,0]=4 328 B6R0.3 O=C(O)C(=O)CBr 2129-9-X3 [0,2,0,0,0,0|1,0,0]=3 329 B6R0.4 C=CCOC(C)=O 2324-1-08 [0,2,0,0,0,0|1,0,0]=3 330 B6R0.4 CC(=O)CCCCl 2117-5-52 [0,2,0,0,0,0|2,0,0]=4 331 B6R0.4 CC(=O)NCCCl 4148-5-15 [0,2,0,0,0,0|2,0,0]=4 332 B6R0.4 CC(C)OCCO 2107-1-0H [0,2,0,0,0,0|1,0,1]=4 333 B6R0.4 CCCOC(C)=O 2123-1-32 [0,2,0,0,0,0|1,0,0]=3 334 B6R0.4 CCOCC(=O)Cl 2116-5-0F [0,2,0,0,0,0|2,0,0]=4 335 B6R0.4 NC(=O)NCCO 4153-1-02 [0,2,0,0,0,0|2,0,0]=4 336 B6R0.5 CCOP(C)(=O)O 6177-1-37 [0,2,0,0,0,0|2,0,0]=4 337 B6R0.8 COP(=O)(O)OC 6175-1-X2 [0,2,0,0,0,0|2,0,0]=4 338 B6R0.8 COP(C)(=O)OC 8177-1-X2 [0,2,0,0,0,0|2,0,0]=4 339 B6R0.9 COC(C=O)OC 2115-1-X1 [0,2,0,0,0,0|1,0,1]=4 340 B6R0.7 CC(=O)C(C)(C)C 2117-1-05 [0,2,0,0,0,0|2,0,0]=4 341 B6R0.7 CC(=O)C(F)(F)Cl 2117-7-03 [0,2,0,0,0,0|2,0,0]=4 342 B6R0.7 CC(=O)C(F)(F)F 2117-3-01 [0,2,0,0,0,0|2,0,0]=4 343 B6R0.7 CC(=O)C(F)(F)F 2117-3-60 [0,2,0,0,0,0|2,0,0]=4 344 B6R0.7 CC(C)(O)C(=O)O 2129-1-10 [0,2,0,0,0,0|2,0,0]=4 345 B6R1.2 CC1=COC=N1 4H56-1-0RS [0,1,0,1,0,0|2,0,0]=4 346 B6R1.2 O=C1C=CCC1 2417-1-X0 [0,1,0,1,0,0|2,0,0]=4 347 B6R1.2 O=C1CCCC1 2217-1-01 [0,1,0,1,0,0|2,0,0]=4 348 B6R1.2 O=C1CCNC1 4H17-5-04 [0,1,0,1,0,0|2,0,0]=4 349 B6R1.2 O=C1CCOC1 2H17-1-Y1 [0,1,0,1,0,0|1,0,0]=3 350 B6R1.2 O=C1CCSC1 6H66-1-Y6 [0,1,0,1,0,0|1,1,0]=4 351 B6R1.2 O=C1NCCS1 8H70-1-8S [0,1,0,1,0,0|1,1,0]=4 352 B6R1.11 CC(=O)C1CC1 2217-1-X9 [0,1,0,1,0,0|2,0,0]=4