0 B3R0.1 BrCCI 1100-S-04 [0,0,0,0,0,0|2,1,0]=3 1 B3R0.1 C#CCC 1500-1-05 [0,0,0,0,0,0|2,0,1]=3 2 B3R0.1 C#CCCl 1500-5-02 [0,0,0,0,0,0|1,0,1]=2 3 B3R0.1 C=CCBr 1300-9-02 [0,0,0,0,0,0|1,1,1]=3 4 B3R0.1 C=CCC 1300-1-25 [0,0,0,0,0,0|2,0,1]=3 5 B3R0.1 C=CCCl 1300-5-10 [0,0,0,0,0,0|1,0,1]=2 6 B3R0.1 C=CCF 1300-3-09 [0,0,0,0,0,0|1,1,1]=3 7 B3R0.1 C=CCI 1300-H-01 [0,0,0,0,0,0|1,1,1]=3 8 B3R0.1 CC#CC 1500-1-02 [0,0,0,0,0,0|2,0,1]=3 9 B3R0.1 CCC=O 2115-1-05 [0,0,0,0,0,0|2,0,1]=3 10 B3R0.1 CCCBr 1100-9-37 [0,0,0,0,0,0|1,1,0]=2 11 B3R0.1 CCCC 1100-1-X0 [0,0,0,0,0,0|2,0,0]=2 12 B3R0.1 CCCCl 1100-5-01 [0,0,0,0,0,0|1,0,0]=1 13 B3R0.1 CCCI 1100-H-X9 [0,0,0,0,0,0|1,1,0]=2 14 B3R0.1 CCNN 3139-5-05 [0,0,0,0,0,0|3,0,0]=3 15 B3R0.1 CNOC 4147-5-01 [0,0,0,0,0,0|2,0,0]=2 16 B3R0.1 COCBr 2107-9-01 [0,0,0,0,0,0|0,1,0]=1 17 B3R0.1 C\C=C/C 1300-1-29 [0,0,0,0,0,0|2,0,1]=3 18 B3R0.1 C\C=C\C 1300-1-04 [0,0,0,0,0,0|2,0,1]=3 19 B3R0.1 C\C=C\Cl 1300-5-17 [0,0,0,0,0,0|1,0,1]=2 20 B3R0.1 C\C=C\Cl 1300-5-E1 [0,0,0,0,0,0|1,0,1]=2 21 B3R0.1 ClCCCl 1100-5-15 [0,0,0,0,0,0|2,0,0]=2 22 B3R0.1 ClCCI 1100-M-00 [0,0,0,0,0,0|2,0,0]=2 23 B3R0.1 Cl\C=C\Cl 1300-5-13 [0,0,0,0,0,0|2,0,1]=3 24 B3R0.1 FCCCl 1100-7-05 [0,0,0,0,0,0|2,0,0]=2 25 B3R0.1 FCCI 1100-K-18 [0,0,0,0,0,0|2,1,0]=3 26 B3R0.1 F[Hg][Hg]F M080-2-02 [0,0,0,0,0,0|3,1,0]=4 27 B3R0.1 N#CCBr 3137-9-02 [0,0,0,0,0,0|2,1,0]=3 28 B3R0.1 NCCBr 3130-9-X1 [0,0,0,0,0,0|2,1,0]=3 29 B3R0.1 NCCCl 3130-5-01 [0,0,0,0,0,0|2,0,0]=2 30 B3R0.1 NCCF 3130-7-04 [0,0,0,0,0,0|2,1,0]=3 31 B3R0.1 NCCS 7161-5-01 [0,0,0,0,0,0|3,0,0]=3 32 B3R0.1 OCCBr 2101-9-02 [0,0,0,0,0,0|2,1,0]=3 33 B2R0.1 C#CC 1500-1-01 [1,0,0,0,0,0|1,0,1]=3 34 B2R0.1 C=CBr 1300-9-01 [1,0,0,0,0,0|0,1,2]=4 35 B2R0.1 C=CBr 1300-9-01ST [1,0,0,0,0,0|0,1,2]=4 36 B2R0.1 C=CC 1300-1-02 [1,0,0,0,0,0|1,0,1]=3 37 B2R0.1 CCBr 1100-9-04 [1,0,0,0,0,0|0,1,0]=2 38 B2R0.1 CCI 1100-H-10 [1,0,0,0,0,0|0,1,0]=2 39 B2R0.1 CCN 3130-1-10 [1,0,0,0,0,0|1,0,0]=2 40 B2R0.1 CC[O-] 9122-1-X0 [1,0,0,0,0,0|1,0,0]=2 41 B2R0.1 CNC 3131-1-X3 [1,0,0,0,0,0|1,0,0]=2 42 B2R0.1 CNO 4156-5-10 [1,0,0,0,0,0|2,0,0]=3 43 B2R0.1 COC 2107-1-01 [1,0,0,0,0,0|0,0,0]=1 44 B2R0.1 CON 4147-5-X3 [1,0,0,0,0,0|1,0,0]=2 45 B2R0.1 ClCBr 1100-D-01 [1,0,0,0,0,0|1,0,0]=2 46 B2R0.1 ClCCl 1100-5-02 [1,0,0,0,0,0|1,0,0]=2 47 B2R0.1 ClCI 1100-L-02 [1,0,0,0,0,0|1,0,0]=2 48 B2R0.1 FCF 1100-3-02 [1,0,0,0,0,0|1,1,0]=3 49 B2R0.1 F[Ni]F M028-2-24 [1,0,0,0,0,0|2,1,0]=4 50 B2R0.1 F[Xe]F M054-2-01 [1,0,0,0,0,0|2,1,0]=4 51 B2R0.1 ICI 1100-H-02 [1,0,0,0,0,0|1,1,0]=3 52 B2R0.1 N#CN 3137-1-Y5 [1,0,0,0,0,0|2,0,1]=4 53 B2R0.1 N#C[S-] 7168-1-29 [1,0,0,0,0,0|1,1,1]=4 54 B2R0.1 N#C[S-] 8168-1-00 [1,0,0,0,0,0|1,1,1]=4 55 B2R0.1 N#C[S-] M019-0-30 [1,0,0,0,0,0|1,1,1]=4 56 B2R0.1 O=C[O-] 2122-1-07 [1,0,0,0,0,0|1,0,2]=4 57 B2R0.1 O=C[O-] 9130-1-00 [1,0,0,0,0,0|1,0,2]=4 58 B2R0.1 O=[Si]=O SI24001A [1,0,0,0,0,0|1,1,1]=4 59 B2R0.1 S=C=S 5166-0-01 [1,0,0,0,0,0|1,1,1]=4 60 B2R0.1 [BH3-]C#N M011-3-60 [1,0,0,0,0,0|2,0,1]=4 61 B4R0.1 C#CC(C)O 2502-1-01 [0,1,0,0,0,0|2,0,1]=4 62 B4R0.1 C#C[C@@H](C)O 2502-1-R1 [0,1,0,0,0,0|2,0,1]=4 63 B4R0.1 C=C(Br)CC 1300-9-24 [0,1,0,0,0,0|1,1,1]=4 64 B4R0.1 C=C(C)CBr 1300-9-00 [0,1,0,0,0,0|1,1,0]=3 65 B4R0.1 C=C(C)CC 1300-1-21 [0,1,0,0,0,0|2,0,0]=3 66 B4R0.1 C=C(C)CN 3330-1-X1 [0,1,0,0,0,0|2,0,0]=3 67 B4R0.1 C=C(C)CN 3330-5-X0 [0,1,0,0,0,0|2,0,0]=3 68 B4R0.1 C=C(C)OC 2307-1-01 [0,1,0,0,0,0|1,0,1]=3 69 B4R0.1 C=C(Cl)C#N 3337-5-X3 [0,1,0,0,0,0|2,0,1]=4 70 B4R0.1 C=C(Cl)CCl 1300-5-15 [0,1,0,0,0,0|1,0,1]=3 71 B4R0.1 C=C(Cl)CF 1300-7-23 [0,1,0,0,0,0|1,1,1]=4 72 B4R0.1 C=C(Cl)CO 2301-5-02 [0,1,0,0,0,0|2,0,1]=4 73 B4R0.1 C=C(Cl)CO 2301-5-02T [0,1,0,0,0,0|2,0,1]=4 74 B4R0.1 C=C(F)CBr 1300-B-49 [0,1,0,0,0,0|1,1,1]=4 75 B4R0.1 C=C(F)CCl 1300-7-14 [0,1,0,0,0,0|1,0,1]=3 76 B4R0.1 C=C(F)CN 3330-3-32 [0,1,0,0,0,0|2,0,1]=4 77 B4R0.1 C=C(F)CO 2301-3-03 [0,1,0,0,0,0|2,0,1]=4 78 B4R0.1 C=CC(=C)C 1300-1-49 [0,1,0,0,0,0|2,0,1]=4 79 B4R0.1 C=CC(C)C 1300-1-26 [0,1,0,0,0,0|2,0,1]=4 80 B4R0.1 C=CC(C)Cl 1300-5-41 [0,1,0,0,0,0|1,0,1]=3 81 B4R0.1 CC(=O)C=O 2117-1-X0 [0,1,0,0,0,0|2,0,1]=4 82 B4R0.1 CC(=O)C=O 2117-1-X0A [0,1,0,0,0,0|2,0,1]=4 83 B4R0.1 CC(=O)CF 2117-3-10 [0,1,0,0,0,0|1,1,0]=3 84 B4R0.1 CC(=O)CO 2120-1-01 [0,1,0,0,0,0|2,0,0]=3 85 B4R0.1 CC(=O)NN 4156-1-2V [0,1,0,0,0,0|3,0,0]=4 86 B4R0.1 CC(C)C#N 3137-1-Y4 [0,1,0,0,0,0|2,0,1]=4 87 B4R0.1 CC(C)C=O 2115-1-13 [0,1,0,0,0,0|2,0,1]=4 88 B4R0.1 CC(C)NN 3139-5-X2 [0,1,0,0,0,0|3,0,0]=4 89 B4R0.1 CC(C)[Mg]Cl 9112-5-04 [0,1,0,0,0,0|2,0,0]=3 90 B4R0.1 CC(F)CO 2101-3-64 [0,1,0,0,0,0|2,0,0]=3 91 B4R0.1 CC(N)CO 4156-1-92 [0,1,0,0,0,0|2,0,0]=3 92 B4R0.1 CC(O)CF 2102-3-12 [0,1,0,0,0,0|1,1,0]=3 93 B4R0.1 CC(O)CO 2104-1-12 [0,1,0,0,0,0|2,0,0]=3 94 B4R0.1 CC=C(Cl)Cl 1300-5-42 [0,1,0,0,0,0|1,0,1]=3 95 B4R0.1 CCB(O)O 6160-1-X1 [0,1,0,0,0,0|3,0,0]=4 96 B4R0.1 CCC(=N)N 3141-5-03 [0,1,0,0,0,0|2,0,1]=4 97 B4R0.1 CCC(C)Cl 1100-5-25 [0,1,0,0,0,0|1,0,0]=2 98 B4R0.1 CCC(C)F 1100-3-47 [0,1,0,0,0,0|1,1,0]=3 99 B4R0.1 CCC(C)I 1100-H-X6 [0,1,0,0,0,0|1,1,0]=3 100 B4R0.1 CC[C@@H](C)O 2101-1-R1 [0,1,0,0,0,0|2,0,0]=3 101 B4R0.1 CN(C)C=O 4148-1-03 [0,1,0,0,0,0|2,0,1]=4 102 B4R0.1 CNC(N)=S 7167-1-20 [0,1,0,0,0,0|2,0,1]=4 103 B4R0.1 COC(=N)N 8153-1-01 [0,1,0,0,0,0|1,0,1]=3 104 B4R0.1 COC(Cl)Cl 2107-5-05 [0,1,0,0,0,0|0,0,0]=1 105 B4R0.1 CSC(=N)N 7167-H-X1 [0,1,0,0,0,0|1,1,1]=4 106 B4R0.1 CSC(=N)N 8167-1-01 [0,1,0,0,0,0|1,1,1]=4 107 B4R0.1 C[C@@H](N)CO 4156-1-R3 [0,1,0,0,0,0|2,0,0]=3 108 B4R0.1 C[C@@H](O)CN 4156-1-R2 [0,1,0,0,0,0|2,0,0]=3 109 B4R0.1 C[C@@H](O)CO 2104-1-R3 [0,1,0,0,0,0|2,0,0]=3 110 B4R0.1 C[C@H](O)CN 4156-1-S2 [0,1,0,0,0,0|2,0,0]=3 111 B4R0.1 C[C@H](O)CO 2104-1-S3 [0,1,0,0,0,0|2,0,0]=3 112 B4R0.1 C\C(Cl)=C/Cl 1300-5-18 [0,1,0,0,0,0|1,0,1]=3 113 B4R0.1 C\C(Cl)=C\Cl 1300-5-Z0 [0,1,0,0,0,0|1,0,1]=3 114 B4R0.1 C\C(N)=N\O 4147-1-X0 [0,1,0,0,0,0|3,0,0]=4 115 B4R0.1 ClC=C(Cl)Cl 1300-5-03 [0,1,0,0,0,0|2,0,1]=4 116 B4R0.1 ClCC(Cl)Cl 1100-5-X2 [0,1,0,0,0,0|2,0,0]=3 117 B4R0.1 FC(Cl)CCl 1100-7-28 [0,1,0,0,0,0|2,0,0]=3 118 B4R0.1 FC(F)CBr 1100-B-07 [0,1,0,0,0,0|2,1,0]=4 119 B4R0.1 FC(F)CI 1100-K-32 [0,1,0,0,0,0|2,1,0]=4 120 B4R0.1 N#CC(F)F 3137-3-22 [0,1,0,0,0,0|2,1,0]=4 121 B4R0.1 N=C(N)CCl 3141-5-X3 [0,1,0,0,0,0|2,0,0]=3 122 B4R0.1 NC(=O)CBr 4148-9-X4 [0,1,0,0,0,0|2,1,0]=4 123 B4R0.1 NC(=O)CCl 4148-5-00 [0,1,0,0,0,0|2,0,0]=3 124 B4R0.1 NCC(F)F 3130-3-03 [0,1,0,0,0,0|2,1,0]=4 125 B4R0.1 NCC(F)F 3130-7-03 [0,1,0,0,0,0|2,1,0]=4 126 B4R0.1 O=C(Br)CBr 2116-9-03 [0,1,0,0,0,0|2,1,0]=4 127 B4R0.1 O=C(Cl)SCl 6171-5-00 [0,1,0,0,0,0|1,1,1]=4 128 B4R0.1 O=C(O)CBr 2121-9-01 [0,1,0,0,0,0|2,1,0]=4 129 B4R0.1 O=C(O)CI 2121-H-00 [0,1,0,0,0,0|2,1,0]=4 130 B4R0.1 O=C(O)CO 2129-1-20 [0,1,0,0,0,0|3,0,0]=4 131 B4R0.1 O=S([O-])CO 6165-1-06 [0,1,0,0,0,0|2,1,0]=4 132 B4R0.1 O=[N+]([O-])CBr 4154-9-X0 [0,1,0,0,0,0|2,1,0]=4 133 B4R0.1 OCC(F)F 2101-3-02 [0,1,0,0,0,0|2,1,0]=4 134 B4R0.1 [C@@H](C)(N)CC 3130-1-S1 [0,1,0,0,0,0|2,0,0]=3 135 B4R0.1 [C@@H](C)(N)CO 4156-1-Y5 [0,1,0,0,0,0|2,0,0]=3 136 B4R0.1 [C@H](C)(N)CC 3130-1-R1 [0,1,0,0,0,0|2,0,0]=3 137 B4R0.2 BrCCCBr 1100-9-13 [0,1,0,0,0,0|1,1,0]=3 138 B4R0.2 C#CCCC 1500-1-X1 [0,1,0,0,0,0|2,0,0]=3 139 B4R0.2 C#CCCO P311-A-35 [0,1,0,0,0,0|2,0,1]=4 140 B4R0.2 C#COCC 2507-1-01 [0,1,0,0,0,0|1,0,1]=3 141 B4R0.2 C=CCCBr 1300-9-04 [0,1,0,0,0,0|1,1,1]=4 142 B4R0.2 C=CCCC 1300-1-09 [0,1,0,0,0,0|2,0,0]=3 143 B4R0.2 CC#CCBr 1500-9-X1 [0,1,0,0,0,0|1,1,0]=3 144 B4R0.2 CC#CCO 2501-1-04 [0,1,0,0,0,0|2,0,0]=3 145 B4R0.2 CCCC#N 3137-1-Y3 [0,1,0,0,0,0|2,0,0]=3 146 B4R0.2 CCCCBr 1100-9-15 [0,1,0,0,0,0|1,1,0]=3 147 B4R0.2 CCCCF 1100-3-32 [0,1,0,0,0,0|1,1,0]=3 148 B4R0.2 CCNCC 3133-5-06 [0,1,0,0,0,0|2,0,0]=3 149 B4R0.2 CCOCC 6160-3-09 [0,1,0,0,0,0|1,0,0]=2 150 B4R0.2 CCOCCl 2107-5-01 [0,1,0,0,0,0|0,0,0]=1 151 B4R0.2 CNCCCl 3133-5-05 [0,1,0,0,0,0|1,0,0]=2 152 B4R0.2 CNCCN 3131-1-11 [0,1,0,0,0,0|2,0,0]=3 153 B4R0.2 CNCCO 4156-1-3Y [0,1,0,0,0,0|2,0,0]=3 154 B4R0.2 COCC#N 4137-1-Y6 [0,1,0,0,0,0|1,0,0]=2 155 B4R0.2 COCCBr 2107-9-X1 [0,1,0,0,0,0|0,1,0]=2 156 B4R0.2 COCCCl 2107-5-0R [0,1,0,0,0,0|0,0,0]=1 157 B4R0.2 COCCN 4130-1-X3 [0,1,0,0,0,0|1,0,0]=2 158 B4R0.2 COCOC 2108-1-07 [0,1,0,0,0,0|1,0,0]=2 159 B4R0.2 CSCCN 7166-1-X1 [0,1,0,0,0,0|1,1,0]=3 160 B4R0.2 C\C=C\CC 1300-1-05 [0,1,0,0,0,0|2,0,0]=3 161 B4R0.2 ClCCCCl 1100-5-19 [0,1,0,0,0,0|1,0,0]=2 162 B4R0.2 ClCCCI 1100-M-01 [0,1,0,0,0,0|1,0,0]=2 163 B4R0.2 Cl\C=C\CCl 1300-5-28 [0,1,0,0,0,0|1,0,1]=3 164 B4R0.2 FCCCF 1100-3-16 [0,1,0,0,0,0|1,1,0]=3 165 B4R0.2 FCCCI 1100-K-35 [0,1,0,0,0,0|1,1,0]=3 166 B4R0.2 ICCCI 1100-H-X0 [0,1,0,0,0,0|1,1,0]=3 167 B4R0.2 N#CCCO 4137-1-Y3 [0,1,0,0,0,0|2,0,1]=4 168 B4R0.2 NCCCBr 3130-9-X0 [0,1,0,0,0,0|1,1,0]=3 169 B4R0.2 NCCCCl 3130-5-03 [0,1,0,0,0,0|1,0,0]=2 170 B4R0.2 NCCCF 3130-7-13 [0,1,0,0,0,0|1,1,0]=3 171 B4R0.2 NNCCO 4139-1-01 [0,1,0,0,0,0|3,0,0]=4 172 B4R0.2 OCCCBr 2101-9-X2 [0,1,0,0,0,0|1,1,0]=3 173 B4R0.2 OCCCCl 2101-5-13 [0,1,0,0,0,0|1,0,0]=2 174 B4R0.2 OCCCF 2101-3-50 [0,1,0,0,0,0|1,1,0]=3 175 B4R0.2 OCCCI 2101-H-01 [0,1,0,0,0,0|1,1,0]=3 176 B4R0.2 OCCCO 2104-1-11 [0,1,0,0,0,0|2,0,0]=3 177 B4R1.1 C1CNC1 3H31-5-W1 [0,0,0,1,0,0|2,0,0]=3 178 B4R1.1 C1CNC1 P612-A-70 [0,0,0,1,0,0|2,0,0]=3 179 B4R1.2 BrC1CC1 1200-9-02 [0,0,0,1,0,0|1,1,0]=3 180 B4R1.2 NC1CC1 3230-1-X2 [0,0,0,1,0,0|2,0,0]=3 181 B1R0.1 CCl 1100-5-16 [2,0,0,0,0,0|0,0,0]=2 182 B1R0.1 CF 1100-3-01 [2,0,0,0,0,0|0,1,0]=3 183 B1R0.1 CI 1100-H-01 [2,0,0,0,0,0|0,1,0]=3 184 B1R0.1 C[S-] 5161-1-X1 [2,0,0,0,0,0|0,1,0]=3 185 B1R0.1 C[S-] 5161-1-X1S [2,0,0,0,0,0|0,1,0]=3 186 B1R0.1 ClCl M017-4-01 [2,0,0,0,0,0|1,0,0]=3 187 B1R0.1 NO M007-5-03 [2,0,0,0,0,0|1,0,0]=3 188 B1R0.1 O=[Mg] M012-0-00 [2,0,0,0,0,0|1,0,1]=4 189 B1R0.1 [Cu][Zn] M030-0-29 [2,0,0,0,0,0|2,0,0]=4 190 B3R0.2 BrC(Br)Br 1100-9-03 [1,1,0,0,0,0|1,1,0]=4 191 B3R0.2 C=C(C)C 1300-1-06 [1,1,0,0,0,0|1,0,0]=3 192 B3R0.2 C=C(C)Cl 1300-5-21 [1,1,0,0,0,0|0,0,1]=3 193 B3R0.2 C=C(Cl)Cl 1300-5-11 [1,1,0,0,0,0|0,0,2]=4 194 B3R0.2 C=C(F)Cl 1300-7-03 [1,1,0,0,0,0|0,0,2]=4 195 B3R0.2 CB(O)O 6160-1-X6 [1,1,0,0,0,0|2,0,0]=4 196 B3R0.2 CC(=O)Cl 2116-5-01 [1,1,0,0,0,0|0,0,1]=3 197 B3R0.2 CC(=O)O 4141-1-X0 [1,1,0,0,0,0|1,0,1]=4 198 B3R0.2 CC(=O)[O-] 2122-1-02 [1,1,0,0,0,0|1,0,1]=4 199 B3R0.2 CC(=O)[O-] 2122-1-19 [1,1,0,0,0,0|1,0,1]=4 200 B3R0.2 CC(=O)[O-] 2122-1-29 [1,1,0,0,0,0|1,0,1]=4 201 B3R0.2 CC(=O)[O-] 2122-1-46 [1,1,0,0,0,0|1,0,1]=4 202 B3R0.2 CC(=O)[O-] 2122-1-46H [1,1,0,0,0,0|1,0,1]=4 203 B3R0.2 CC(=O)[O-] M029-1-01 [1,1,0,0,0,0|1,0,1]=4 204 B3R0.2 CC(=O)[O-] M056-1-X0 [1,1,0,0,0,0|1,0,1]=4 205 B3R0.2 CC(=O)[S-] 6161-1-05 [1,1,0,0,0,0|1,0,1]=4 206 B3R0.2 CC(C)Br 1100-9-02 [1,1,0,0,0,0|0,1,0]=3 207 B3R0.2 CC(C)C 1100-1-19 [1,1,0,0,0,0|1,0,0]=3 208 B3R0.2 CC(C)I 1100-H-03 [1,1,0,0,0,0|0,1,0]=3 209 B3R0.2 CC(C)N 3130-5-X1 [1,1,0,0,0,0|1,0,0]=3 210 B3R0.2 CC(Cl)Cl 1100-5-12 [1,1,0,0,0,0|0,0,0]=2 211 B3R0.2 CC(F)Br 1100-B-20 [1,1,0,0,0,0|0,1,0]=3 212 B3R0.2 CC(F)Cl 1100-7-04SM [1,1,0,0,0,0|0,0,0]=2 213 B3R0.2 CC(F)F 1100-3-05 [1,1,0,0,0,0|0,1,0]=3 214 B3R0.2 CC(N)=S 7167-1-X0 [1,1,0,0,0,0|1,0,1]=4 215 B3R0.2 CN(C)C 3132-1-05 [1,1,0,0,0,0|1,0,0]=3 216 B3R0.2 CN(C)C 8132-1-X0 [1,1,0,0,0,0|1,0,0]=3 217 B3R0.2 CS(=O)[O-] 6165-1-X0 [1,1,0,0,0,0|1,1,0]=4 218 B3R0.2 C[S+](C)C 5171-H-01 [1,1,0,0,0,0|0,1,0]=3 219 B3R0.2 Cl[Ce](Cl)Cl M058-5-01 [1,1,0,0,0,0|2,0,0]=4 220 B3R0.2 Cl[In](Cl)Cl M049-5-01 [1,1,0,0,0,0|2,0,0]=4 221 B3R0.2 FC(F)Br 1100-B-01 [1,1,0,0,0,0|1,1,0]=4 222 B3R0.2 FC(F)Cl 1100-7-03 [1,1,0,0,0,0|1,0,0]=3 223 B3R0.2 FC(F)I 1100-K-99 [1,1,0,0,0,0|1,1,0]=4 224 B3R0.2 N=C(N)Cl 3141-5-X4 [1,1,0,0,0,0|1,0,1]=4 225 B3R0.2 O=S([O-])O M011-1-06 [1,1,0,0,0,0|2,0,0]=4 226 B3R0.2 O=S([O-])O M011-1-06HP [1,1,0,0,0,0|2,0,0]=4 227 B5R0.1 C=CCC(C)O 2302-1-00 [0,2,0,0,0,0|2,0,0]=4 228 B5R0.1 C=COC(C)=O 2324-1-50 [0,2,0,0,0,0|1,0,1]=4 229 B5R0.1 CC(C)=CCBr 1300-9-X0 [0,2,0,0,0,0|1,1,0]=4 230 B5R0.1 CC(C)=CCCl 1300-5-X0 [0,2,0,0,0,0|1,0,0]=3 231 B5R0.1 CC(C)CCI 1100-H-X4 [0,2,0,0,0,0|1,1,0]=4 232 B5R0.1 CC(C)CCN 3130-1-X4 [0,2,0,0,0,0|2,0,0]=4 233 B5R0.1 CC(C)CCO 2101-1-53 [0,2,0,0,0,0|2,0,0]=4 234 B5R0.1 CC(C)CNN 3139-5-X0 [0,2,0,0,0,0|2,0,0]=4 235 B5R0.1 CC(N)CCO 4156-1-4D [0,2,0,0,0,0|2,0,0]=4 236 B5R0.1 CCCB(O)O 6160-1-X5 [0,2,0,0,0,0|2,0,0]=4 237 B5R0.1 CCCC(=O)Cl 2116-5-09 [0,2,0,0,0,0|1,0,0]=3 238 B5R0.1 CCCC(=O)[O-] 2122-1-X1 [0,2,0,0,0,0|2,0,0]=4 239 B5R0.1 CCCC(C)C 1100-1-04 [0,2,0,0,0,0|2,0,0]=4 240 B5R0.1 CCCC(C)O 2102-1-52 [0,2,0,0,0,0|2,0,0]=4 241 B5R0.1 CCOC(=S)[S-] 6167-1-02 [0,2,0,0,0,0|1,0,1]=4 242 B5R0.1 CN(C)CC#N 3137-1-03 [0,2,0,0,0,0|2,0,0]=4 243 B5R0.1 CN(C)CCN 3132-1-X2 [0,2,0,0,0,0|2,0,0]=4 244 B5R0.1 COCC(=O)Cl 2116-5-X4 [0,2,0,0,0,0|0,0,0]=2 245 B5R0.1 CSCC(=O)O 6166-1-05 [0,2,0,0,0,0|1,1,0]=4 246 B5R0.1 C[C@@H](N)CCO 4156-1-RB [0,2,0,0,0,0|2,0,0]=4 247 B5R0.1 C[C@@H](O)CCO 2101-1-X0 [0,2,0,0,0,0|2,0,0]=4 248 B5R0.1 ClCC=C(Cl)Cl 1300-5-07 [0,2,0,0,0,0|1,0,1]=4 249 B5R0.1 NC(=O)CCCl 4148-5-02 [0,2,0,0,0,0|1,0,1]=4 250 B5R0.3 C#CC(=O)OC 2523-1-X1 [0,2,0,0,0,0|1,0,1]=4 251 B5R0.3 C#CC(O)CC 2502-1-02 [0,2,0,0,0,0|2,0,0]=4 252 B5R0.3 C=C(CCl)CCl 1300-5-X1 [0,2,0,0,0,0|1,0,0]=3 253 B5R0.3 C=C(CO)CO 2304-1-X0 [0,2,0,0,0,0|2,0,0]=4 254 B5R0.3 CCC(=O)CBr 2117-9-01 [0,2,0,0,0,0|1,1,0]=4 255 B5R0.3 CCC(C)C=O 2115-1-0C [0,2,0,0,0,0|2,0,0]=4 256 B5R0.3 CCC(C)CN 3130-1-X5 [0,2,0,0,0,0|2,0,0]=4 257 B5R0.3 CCC(N)CC 3130-1-14 [0,2,0,0,0,0|2,0,0]=4 258 B5R0.3 CCC(N)CO 4156-1-38 [0,2,0,0,0,0|2,0,0]=4 259 B5R0.3 CCC(O)CN 4156-1-Z4 [0,2,0,0,0,0|2,0,0]=4 260 B5R0.3 CC[C@@H](N)CO 4156-1-R4 [0,2,0,0,0,0|2,0,0]=4 261 B5R0.3 CC[C@H](N)CO 4156-1-W2 [0,2,0,0,0,0|2,0,0]=4 262 B5R0.3 COC(=O)CBr 2123-9-36 [0,2,0,0,0,0|0,1,0]=3 263 B5R0.3 COC(=O)CN 4158-5-40 [0,2,0,0,0,0|1,0,0]=3 264 B5R0.3 COC(=O)CO 2129-1-X2 [0,2,0,0,0,0|1,0,0]=3 265 B5R0.3 COC(=O)CS 6161-1-X3 [0,2,0,0,0,0|1,0,0]=3 266 B5R0.3 COC(=O)NN 4156-1-39 [0,2,0,0,0,0|1,0,1]=4 267 B5R0.3 COS(=O)OC 6164-1-13 [0,2,0,0,0,0|2,0,0]=4 268 B5R0.3 CO[PH](=O)OC 6177-1-0G [0,2,0,0,0,0|2,0,0]=4 269 B5R0.3 ClCC(Br)CBr 1100-D-12 [0,2,0,0,0,0|1,0,0]=3 270 B5R0.3 ClCC(Cl)CCl 1100-5-10 [0,2,0,0,0,0|1,0,0]=3 271 B5R0.3 FCC(Br)CBr 1100-B-28 [0,2,0,0,0,0|1,1,0]=4 272 B5R0.3 NC(CO)CO 4104-1-X0 [0,2,0,0,0,0|2,0,0]=4 273 B5R0.3 NCC(O)CN 4156-1-Y7 [0,2,0,0,0,0|2,0,0]=4 274 B5R0.3 NCC(O)CO 4156-1-Z8 [0,2,0,0,0,0|2,0,0]=4 275 B5R0.3 O=C(CBr)CBr 2117-9-03 [0,2,0,0,0,0|1,1,0]=4 276 B5R0.3 O=C(CF)CF 2117-3-09 [0,2,0,0,0,0|1,1,0]=4 277 B5R0.3 OC(CBr)CBr 2101-9-X1 [0,2,0,0,0,0|1,1,0]=4 278 B5R0.3 OC(CCl)CCl 2102-5-13 [0,2,0,0,0,0|1,0,0]=3 279 B5R0.3 OC(CF)CCl 2102-7-02 [0,2,0,0,0,0|1,0,0]=3 280 B5R0.3 OC(CF)CF 2102-3-13 [0,2,0,0,0,0|1,1,0]=4 281 B5R0.3 OCC(O)CBr 2104-9-01 [0,2,0,0,0,0|1,1,0]=4 282 B5R0.3 OCC(O)CS 6161-1-X4 [0,2,0,0,0,0|2,0,0]=4 283 B5R0.4 C=CC(Cl)(Cl)Cl 1300-5-02 [0,2,0,0,0,0|1,0,1]=4 284 B5R0.4 CC(C)(C)CCl 1100-5-20 [0,2,0,0,0,0|1,0,0]=3 285 B5R0.4 CC(C)(C)CO 2101-1-08 [0,2,0,0,0,0|2,0,0]=4 286 B5R0.4 CC(C)(Cl)CCl 1100-5-18 [0,2,0,0,0,0|1,0,0]=3 287 B5R0.4 CC(C)(F)CO 2101-3-97 [0,2,0,0,0,0|2,0,0]=4 288 B5R0.4 CC(C)(N)CO 4156-1-X8 [0,2,0,0,0,0|2,0,0]=4 289 B5R0.4 CC(C)(O)CN 4156-1-05 [0,2,0,0,0,0|2,0,0]=4 290 B5R0.4 CC(C)(O)CO 2104-1-09 [0,2,0,0,0,0|2,0,0]=4 291 B5R0.4 CC(F)(Cl)CCl 1100-7-49 [0,2,0,0,0,0|1,0,0]=3 292 B5R0.4 CC(F)(F)CCl 1100-7-64 [0,2,0,0,0,0|1,0,0]=3 293 B5R0.4 CC(F)(F)CN 3130-7-22 [0,2,0,0,0,0|2,0,0]=4 294 B5R0.4 CC(F)(F)CO 2101-3-52 [0,2,0,0,0,0|2,0,0]=4 295 B5R0.4 CCC(C)(C)C 1100-1-32 [0,2,0,0,0,0|2,0,0]=4 296 B5R0.4 CCC(C)(F)F 1100-3-98 [0,2,0,0,0,0|1,1,0]=4 297 B5R0.4 CCC(Cl)(Cl)Cl 1100-5-06 [0,2,0,0,0,0|1,0,0]=3 298 B5R0.4 CCC(F)(F)Br 1100-B-38 [0,2,0,0,0,0|1,1,0]=4 299 B5R0.4 CCS(C)(=O)=O 6163-1-0B [0,2,0,0,0,0|1,1,0]=4 300 B5R0.4 CNC(C)(C)C 3131-1-X1 [0,2,0,0,0,0|2,0,0]=4 301 B5R0.4 C[Si](C)(C)CCl 5181-5-25 [0,2,0,0,0,0|1,0,0]=3 302 B5R0.4 FC(Cl)(Br)CBr 1100-F-06 [0,2,0,0,0,0|2,0,0]=4 303 B5R0.4 FC(Cl)(Cl)CCl 1100-7-18 [0,2,0,0,0,0|2,0,0]=4 304 B5R0.4 FC(Cl)(Cl)SCl 5171-6-01 [0,2,0,0,0,0|1,1,0]=4 305 B5R0.4 FC(F)(Cl)CCl 1100-7-16 [0,2,0,0,0,0|2,0,0]=4 306 B5R0.4 FC(F)(F)CCl 1100-7-10 [0,2,0,0,0,0|2,0,0]=4 307 B5R0.4 FCC(F)(Cl)Cl 1100-7-15 [0,2,0,0,0,0|2,0,0]=4 308 B5R0.4 N#CC(Cl)(Cl)Cl 3137-4-X0 [0,2,0,0,0,0|2,0,0]=4 309 B5R0.4 O=S(=O)(Cl)CCl 6162-5-X1 [0,2,0,0,0,0|1,1,0]=4 310 B5R0.4 OCC(Cl)(Cl)Cl 2101-5-03 [0,2,0,0,0,0|2,0,0]=4 311 B5R0.4 OCC(F)(Cl)Cl 2101-7-02 [0,2,0,0,0,0|2,0,0]=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 CC(=O)C(C)C 2117-1-13 [0,2,0,0,0,0|2,0,0]=4 314 B5R0.5 CC(=O)C(C)F 2117-3-11 [0,2,0,0,0,0|1,1,0]=4 315 B5R0.5 CC(=O)C(F)F 2117-3-13 [0,2,0,0,0,0|1,1,0]=4 316 B5R0.5 CC(C)C(=O)Cl 2116-5-05 [0,2,0,0,0,0|1,0,1]=4 317 B5R0.5 CC(Cl)C(Cl)Cl 1100-5-31 [0,2,0,0,0,0|1,0,0]=3 318 B5R0.5 CC(O)C(C)O 2104-1-07 [0,2,0,0,0,0|2,0,0]=4 319 B5R0.5 CN(C)C(=S)Cl P911-A-76 [0,2,0,0,0,0|1,0,1]=4 320 B5R0.5 C[C@@H](Cl)C(=O)O 2121-5-R1 [0,2,0,0,0,0|2,0,0]=4 321 B5R0.5 C[C@@H](O)[C@@H](C)O 2104-1-R1 [0,2,0,0,0,0|2,0,0]=4 322 B5R0.5 C[C@H](O)[C@H](C)O 2104-1-X2 [0,2,0,0,0,0|2,0,0]=4 323 B5R0.5 FC(Cl)C(Cl)Cl 1100-7-17 [0,2,0,0,0,0|2,0,0]=4 324 B5R0.5 FC(F)C(Cl)Cl 1100-7-40 [0,2,0,0,0,0|2,0,0]=4 325 B5R0.5 NC(=O)C(Cl)Cl 4148-5-X4 [0,2,0,0,0,0|2,0,0]=4 326 B5R0.5 NC(=O)C(F)Cl 4148-7-03 [0,2,0,0,0,0|2,0,0]=4 327 B5R0.5 O=C(Cl)C(Cl)Cl 2116-5-00 [0,2,0,0,0,0|2,0,0]=4 328 B5R0.5 O=C(O)C(F)Cl 2121-7-03 [0,2,0,0,0,0|2,0,0]=4 329 B5R0.5 O=C([O-])C(F)Cl 2122-7-01 [0,2,0,0,0,0|2,0,0]=4 330 B5R0.5 [C@@H](C)(Cl)C(=O)O 2121-5-S1 [0,2,0,0,0,0|2,0,0]=4 331 B5R0.2 BrCCCCBr 1100-9-14 [0,2,0,0,0,0|1,1,0]=4 332 B5R0.2 BrC\C=C\CBr 1300-9-X6 [0,2,0,0,0,0|1,1,0]=4 333 B5R0.2 C#CCCCC 1500-1-X2 [0,2,0,0,0,0|2,0,0]=4 334 B5R0.2 C#CCCCCl 1500-5-X0 [0,2,0,0,0,0|1,0,0]=3 335 B5R0.2 C#CCCCO 2501-1-01 [0,2,0,0,0,0|2,0,0]=4 336 B5R0.2 C=CCCCBr 1300-9-13 [0,2,0,0,0,0|1,1,0]=4 337 B5R0.2 C=CCCCC 1300-1-48 [0,2,0,0,0,0|2,0,0]=4 338 B5R0.2 CCC#CCC 1500-1-09 [0,2,0,0,0,0|2,0,0]=4 339 B5R0.2 CCC#CCO 2501-1-13 [0,2,0,0,0,0|2,0,0]=4 340 B5R0.2 CCCCC=O 2115-1-00 [0,2,0,0,0,0|2,0,0]=4 341 B5R0.2 CCCCCC 1100-1-18 [0,2,0,0,0,0|2,0,0]=4 342 B5R0.2 CCCCCF 1100-3-65 [0,2,0,0,0,0|1,1,0]=4 343 B5R0.2 CCCCCN 3130-1-X6 [0,2,0,0,0,0|2,0,0]=4 344 B5R0.2 CCCN=C=S 7168-1-26 [0,2,0,0,0,0|2,0,0]=4 345 B5R0.2 CCNCCN 3130-1-X2 [0,2,0,0,0,0|2,0,0]=4 346 B5R0.2 CCSCCCl 5166-5-01 [0,2,0,0,0,0|0,1,0]=3 347 B5R0.2 CNCCNC 3131-1-17 [0,2,0,0,0,0|2,0,0]=4 348 B5R0.2 COCCCBr 2107-9-02 [0,2,0,0,0,0|0,1,0]=3 349 B5R0.2 COCCOC 2108-1-00 [0,2,0,0,0,0|1,0,0]=3 350 B5R0.2 COCN=C=S 8168-1-17 [0,2,0,0,0,0|1,0,0]=3 351 B5R0.2 CSCCCN 8166-1-X3 [0,2,0,0,0,0|1,1,0]=4 352 B5R0.2 ClCC#CCCl 1500-5-X1 [0,2,0,0,0,0|1,0,0]=3 353 B5R0.2 ClCCCCI 1100-M-14 [0,2,0,0,0,0|1,0,0]=3 354 B5R0.2 FCCCCBr 1100-B-22 [0,2,0,0,0,0|1,1,0]=4 355 B5R0.2 ICCCCI 1100-H-14 [0,2,0,0,0,0|1,1,0]=4 356 B5R0.2 O=C=NCCCl 4149-5-X0 [0,2,0,0,0,0|1,0,1]=4 357 B5R0.2 OCCCCF 2101-3-1V [0,2,0,0,0,0|1,1,0]=4 358 B5R0.2 S=C=NCCCl 7168-5-01 [0,2,0,0,0,0|1,0,1]=4 359 B5R0.2 SCCCCS 5161-1-05 [0,2,0,0,0,0|2,0,0]=4 360 B3R1.1 C1CC1 1200-1-03 [1,0,0,1,0,0|1,0,0]=3 361 B5R1.2 BrC1CCC1 1200-9-17 [0,1,0,1,0,0|1,1,0]=4 362 B5R1.2 BrC1COC1 2H10-9-07 [0,1,0,1,0,0|0,1,0]=3 363 B5R1.2 FC1CNC1 3231-7-01 [0,1,0,1,0,0|1,1,0]=4 364 B5R1.2 IC1COC1 2H10-H-05 [0,1,0,1,0,0|0,1,0]=3 365 B5R1.2 NC1CCC1 3230-1-X4 [0,1,0,1,0,0|2,0,0]=4 366 B5R1.2 NC1CNC1 3H30-5-38 [0,1,0,1,0,0|2,0,0]=4 367 B5R1.2 O=C1CCC1 2217-1-X6 [0,1,0,1,0,0|2,0,0]=4 368 B5R1.2 O=C1CNC1 4H56-5-05 [0,1,0,1,0,0|2,0,0]=4 369 B5R1.2 O=C1COC1 2H17-1-05 [0,1,0,1,0,0|1,0,0]=3 370 B5R1.2 O=C1CSC1 6H66-1-39 [0,1,0,1,0,0|1,1,0]=4 371 B5R1.2 OC1CNC1 4H01-5-63 [0,1,0,1,0,0|2,0,0]=4 372 B5R1.2 OC1COC1 2H01-1-X3 [0,1,0,1,0,0|1,0,0]=3 373 B5R1.3 BrCC1CC1 1200-9-X0 [0,1,0,1,0,0|1,1,0]=4 374 B5R1.3 C#CC1CC1 1500-1-04 [0,1,0,1,0,0|2,0,0]=4 375 B5R1.3 C=CC1CO1 2309-1-02 [0,1,0,1,0,0|1,0,0]=3 376 B5R1.3 CNC1CC1 3231-5-04 [0,1,0,1,0,0|2,0,0]=4 377 B5R1.3 ClCC1CC1 1200-5-01 [0,1,0,1,0,0|1,0,0]=3 378 B5R1.3 ClCC1CO1 2109-5-01 [0,1,0,1,0,0|0,0,0]=2 379 B5R1.3 ClC[C@@H]1CO1 2109-5-X0 [0,1,0,1,0,0|0,0,0]=2 380 B5R1.3 ClC[C@H]1CO1 2109-5-X1 [0,1,0,1,0,0|0,0,0]=2 381 B5R1.3 FCC1CO1 2109-3-20 [0,1,0,1,0,0|0,1,0]=3 382 B5R1.3 ICC1CC1 1200-H-04 [0,1,0,1,0,0|1,1,0]=4 383 B5R1.3 N#CC1CC1 3237-1-Y6 [0,1,0,1,0,0|2,0,0]=4 384 B5R1.3 NCC1CC1 P911-A-36 [0,1,0,1,0,0|2,0,0]=4 385 B5R1.3 O=CC1CC1 2215-1-X2 [0,1,0,1,0,0|2,0,0]=4 386 B5R1.3 OCC1CC1 2301-1-X2 [0,1,0,1,0,0|2,0,0]=4 387 B5R1.3 OC[C@@H]1CO1 2109-1-R2 [0,1,0,1,0,0|1,0,0]=3 388 B5R1.3 OC[C@H]1CO1 2109-1-S1 [0,1,0,1,0,0|1,0,0]=3 389 B5R1.4 C[C@@H]1O[C@@H]1C 2109-1-Z0 [0,1,0,1,0,0|1,0,0]=3 390 B5R1.4 C[C@@H]1O[C@H]1C 2109-1-E0 [0,1,0,1,0,0|1,0,0]=3 391 B5R1.5 CC1(C)CO1 2109-1-03 [0,1,0,1,0,0|1,0,0]=3 392 B5R1.5 CC1(N)CC1 3230-5-01 [0,1,0,1,0,0|2,0,0]=4 393 B5R1.1 C1=CCCC1 1400-1-05 [0,1,0,1,0,0|2,0,0]=4 394 B5R1.1 C1=CCNC1 3431-1-X0 [0,1,0,1,0,0|2,0,0]=4 395 B5R1.1 C1=CCOC1 2H10-1-00 [0,1,0,1,0,0|1,0,0]=3 396 B5R1.1 C1=COCC1 2H10-1-X7 [0,1,0,1,0,0|1,0,1]=4 397 B5R1.1 C1CCCC1 1200-1-05 [0,1,0,1,0,0|2,0,0]=4 398 B5R1.1 C1CCNC1 3H31-1-Z9 [0,1,0,1,0,0|2,0,0]=4 399 B5R1.1 C1CCOC1 6H60-1-13 [0,1,0,1,0,0|1,0,0]=3