0 B2R0.1 CCI 21355 [0,0,0,0,0,0|3,0,0]=3 1 B2R0.1 CCN 45201 [0,0,0,0,0,0|3,0,0]=3 2 B2R0.1 CC[O-] 26132 [0,0,0,0,0,0|2,0,1]=3 3 B2R0.1 CNC 18186 [0,0,0,0,0,0|2,0,1]=3 4 B2R0.1 CSC 14218 [0,0,0,0,0,0|3,0,0]=3 5 B2R0.1 CSC 36251 [0,0,0,0,0,0|3,0,0]=3 6 B2R0.1 C[Mg]Br 20745 [0,0,0,0,0,0|3,0,0]=3 7 B2R0.1 ClCBr 2209 [0,0,0,0,0,0|3,0,0]=3 8 B2R0.1 Cl[Co]Cl 25246 [0,0,0,0,0,0|3,0,0]=3 9 B2R0.1 FCBr 2382 [0,0,0,0,0,0|3,0,0]=3 10 B2R0.1 FCCl 35673 [0,0,0,0,0,0|3,0,0]=3 11 B2R0.1 N#CBr 12515 [0,0,0,0,0,0|3,0,0]=3 12 B2R0.1 N#C[Cu] 24249 [0,0,0,0,0,0|3,0,0]=3 13 B2R0.1 N#C[O-] 23312 [0,0,0,0,0,0|2,0,1]=3 14 B2R0.1 O=[PH2][O-] 12707 [0,0,0,0,0,0|0,1,1]=2 15 B1R0.1 CF 29083 [1,0,0,0,0,0|2,0,0]=3 16 B1R0.1 CN 29301 [1,0,0,0,0,0|1,0,1]=3 17 B1R0.1 C[S-] 7072 [1,0,0,0,0,0|1,1,0]=3 18 B1R0.1 ClI 21352 [1,0,0,0,0,0|2,0,0]=3 19 B1R0.1 NN 17422 [1,0,0,0,0,0|1,0,1]=3 20 B1R0.1 NN 21005 [1,0,0,0,0,0|1,0,1]=3 21 B1R0.1 NN 26395 [1,0,0,0,0,0|1,0,1]=3 22 B1R0.1 NO 23590 [1,0,0,0,0,0|0,0,1]=2 23 B1R0.1 [C-]#[O+] 35949 [1,0,0,0,0,0|1,0,1]=3 24 B3R0.1 C#CCBr 20264 [0,1,0,0,0,0|3,0,0]=4 25 B3R0.1 C#CCN 18842 [0,1,0,0,0,0|3,0,0]=4 26 B3R0.1 C#CCN 18845 [0,1,0,0,0,0|3,0,0]=4 27 B3R0.1 C#C[Mg]Br 18180 [0,1,0,0,0,0|3,0,0]=4 28 B3R0.1 C=CC=O 23303 [0,1,0,0,0,0|2,0,0]=3 29 B3R0.1 C=CCCl 35025 [0,1,0,0,0,0|3,0,0]=4 30 B3R0.1 C=CCI 12655 [0,1,0,0,0,0|3,0,0]=4 31 B3R0.1 C=CCN 19133 [0,1,0,0,0,0|3,0,0]=4 32 B3R0.1 CCCI 3977 [0,1,0,0,0,0|3,0,0]=4 33 B3R0.1 CCC[S-] 35319 [0,1,0,0,0,0|2,1,0]=4 34 B3R0.1 CCNC 10275 [0,1,0,0,0,0|2,0,1]=4 35 B3R0.1 CCNN 16833 [0,1,0,0,0,0|2,0,1]=4 36 B3R0.1 CCON 35706 [0,1,0,0,0,0|2,0,0]=3 37 B3R0.1 CC[Mg]Br 23799 [0,1,0,0,0,0|3,0,0]=4 38 B3R0.1 CNC=O 35283 [0,1,0,0,0,0|1,0,1]=3 39 B3R0.1 CNOC 25934 [0,1,0,0,0,0|1,0,1]=3 40 B3R0.1 COCBr 23167 [0,1,0,0,0,0|2,0,0]=3 41 B3R0.1 CSSC 9665 [0,1,0,0,0,0|2,1,0]=4 42 B3R0.1 N#CCBr 12656 [0,1,0,0,0,0|3,0,0]=4 43 B3R0.1 N#CCI 12543 [0,1,0,0,0,0|3,0,0]=4 44 B3R0.1 NCCBr 32344 [0,1,0,0,0,0|3,0,0]=4 45 B3R0.1 NCCF 19132 [0,1,0,0,0,0|3,0,0]=4 46 B3R0.1 NCCO 24767 [0,1,0,0,0,0|2,0,0]=3 47 B3R0.1 NNC=O 32333 [0,1,0,0,0,0|1,0,1]=3 48 B3R0.1 SCCS 12844 [0,1,0,0,0,0|1,2,0]=4 49 B3R0.2 C=C(C)Br 27228 [0,1,0,0,0,0|3,0,0]=4 50 B3R0.2 CB(O)O 6018 [0,1,0,0,0,0|1,0,1]=3 51 B3R0.2 CC(=O)Cl 17265 [0,1,0,0,0,0|2,0,0]=3 52 B3R0.2 CC(=O)O 22173 [0,1,0,0,0,0|1,0,0]=2 53 B3R0.2 CC(=O)[O-] 10966 [0,1,0,0,0,0|1,0,1]=3 54 B3R0.2 CC(=O)[O-] 18178 [0,1,0,0,0,0|1,0,1]=3 55 B3R0.2 CC(=O)[O-] 26340 [0,1,0,0,0,0|1,0,1]=3 56 B3R0.2 CC(=O)[O-] 3997 [0,1,0,0,0,0|1,0,1]=3 57 B3R0.2 CC(C)Br 18655 [0,1,0,0,0,0|3,0,0]=4 58 B3R0.2 CC(C)I 21400 [0,1,0,0,0,0|3,0,0]=4 59 B3R0.2 CC(F)F 21302 [0,1,0,0,0,0|3,0,0]=4 60 B3R0.2 CC(O)=S 28961 [0,1,0,0,0,0|1,1,0]=3 61 B3R0.2 CC([O-])=S 25455 [0,1,0,0,0,0|1,1,1]=4 62 B3R0.2 CN(C)C 18299 [0,1,0,0,0,0|2,0,1]=4 63 B3R0.2 CP(C)C 20413 [0,1,0,0,0,0|2,1,0]=4 64 B3R0.2 CS(=O)[O-] 28957 [0,1,0,0,0,0|1,0,1]=3 65 B3R0.2 CS(C)=O 44865 [0,1,0,0,0,0|2,0,0]=3 66 B3R0.2 C[PH](C)=O 29395 [0,1,0,0,0,0|1,1,0]=3 67 B3R0.2 C[S+](C)C 44700 [0,1,0,0,0,0|3,0,0]=4 68 B3R0.2 ClC(Br)Br 12531 [0,1,0,0,0,0|3,0,0]=4 69 B3R0.2 Cl[Ru](Cl)Cl 7652 [0,1,0,0,0,0|3,0,0]=4 70 B3R0.2 IC(I)I 28148 [0,1,0,0,0,0|3,0,0]=4 71 B3R0.2 N=C(N)N 21372 [0,1,0,0,0,0|3,0,0]=4 72 B3R0.2 N=C(N)N 36005 [0,1,0,0,0,0|3,0,0]=4 73 B3R0.2 O=C([O-])O 23592 [0,1,0,0,0,0|1,0,0]=2 74 B3R0.2 O=C([O-])[O-] 19981 [0,1,0,0,0,0|1,0,1]=3 75 B3R0.2 O=C([O-])[O-] 26167 [0,1,0,0,0,0|1,0,1]=3 76 B3R0.2 O=I(=O)[O-] 23596 [0,1,0,0,0,0|1,0,1]=3 77 B3R0.2 O=I(=O)[O-] 35037 [0,1,0,0,0,0|1,0,1]=3 78 B3R0.2 O=S(Br)Br 2023 [0,1,0,0,0,0|2,0,0]=3 79 B3R0.2 O=[Os](=O)=O 29022 [0,1,0,0,0,0|1,0,1]=3 80 B3R0.2 OB(O)O 10918 [0,1,0,0,0,0|1,0,1]=3 81 B3R0.2 PC(Cl)Cl 6473 [0,1,0,0,0,0|3,0,0]=4 82 B3R0.2 [O-]B([O-])[O-] 36100 [0,1,0,0,0,0|1,0,2]=4 83 B0R0.1 B 18303 [2,0,0,0,0,0|0,0,0]=2 84 B0R0.1 O 17617 [2,0,0,0,0,0|0,0,0]=2 85 B0R0.1 O 24809 [2,0,0,0,0,0|0,0,0]=2 86 B0R0.1 O 25288 [2,0,0,0,0,0|0,0,0]=2 87 B0R0.1 [18OH2] 2391 [2,0,0,0,0,0|0,0,0]=2 88 B0R0.1 [AlH7-] 21360 [2,0,0,0,0,0|0,0,0]=2 89 B0R0.1 [Cl-] 36197 [2,0,0,0,0,0|0,0,0]=2 90 B0R0.1 [Pd] 21560 [2,0,0,0,0,0|0,0,0]=2 91 B0R0.1 [S] 24703 [2,0,0,0,0,0|0,0,0]=2 92 B4R0.1 C#CC(=O)O 23201 [0,2,0,0,0,0|1,0,0]=3 93 B4R0.1 C#CC(C)=O 2024 [0,2,0,0,0,0|2,0,0]=4 94 B4R0.1 C#C[C@@H](C)O 20211 [0,2,0,0,0,0|2,0,0]=4 95 B4R0.1 C=CC(=O)O 21090 [0,2,0,0,0,0|1,0,0]=3 96 B4R0.1 C=CC(N)=O 14147 [0,2,0,0,0,0|2,0,0]=4 97 B4R0.1 C=C[N+](=O)[O-] 14436 [0,2,0,0,0,0|0,0,2]=4 98 B4R0.1 CC(=O)CBr 24199 [0,2,0,0,0,0|2,0,0]=4 99 B4R0.1 CC(O)CBr 12555 [0,2,0,0,0,0|2,0,0]=4 100 B4R0.1 CCB(O)O 7960 [0,2,0,0,0,0|1,0,1]=4 101 B4R0.1 CCC(C)O 6718 [0,2,0,0,0,0|2,0,0]=4 102 B4R0.1 CCC([NH-])=O 10938 [0,2,0,0,0,0|2,0,0]=4 103 B4R0.1 CCS(=O)[O-] 24643 [0,2,0,0,0,0|1,0,1]=4 104 B4R0.1 CC[C@@H](C)O 6717 [0,2,0,0,0,0|2,0,0]=4 105 B4R0.1 CN(C)C=O 23341 [0,2,0,0,0,0|1,0,1]=4 106 B4R0.1 COC(C)=N 2122 [0,2,0,0,0,0|2,0,0]=4 107 B4R0.1 COC(Cl)Cl 2376 [0,2,0,0,0,0|2,0,0]=4 108 B4R0.1 C[C@@H](Cl)CO 8287 [0,2,0,0,0,0|2,0,0]=4 109 B4R0.1 C[C@@H](N)CO 9884 [0,2,0,0,0,0|2,0,0]=4 110 B4R0.1 C[C@@H](O)CBr 23955 [0,2,0,0,0,0|2,0,0]=4 111 B4R0.1 C[C@@H](O)CCl 14071 [0,2,0,0,0,0|2,0,0]=4 112 B4R0.1 C[C@@H](O)CI 23956 [0,2,0,0,0,0|2,0,0]=4 113 B4R0.1 C[C@@H](O)CN 5721 [0,2,0,0,0,0|2,0,0]=4 114 B4R0.1 C[C@@H](O)CO 5857 [0,2,0,0,0,0|1,0,1]=4 115 B4R0.1 C[C@H](Cl)CO 8285 [0,2,0,0,0,0|2,0,0]=4 116 B4R0.1 C[C@H](N)CO 5710 [0,2,0,0,0,0|2,0,0]=4 117 B4R0.1 C[C@H](O)CBr 20478 [0,2,0,0,0,0|2,0,0]=4 118 B4R0.1 C[C@H](O)CCl 14072 [0,2,0,0,0,0|2,0,0]=4 119 B4R0.1 C[C@H](O)CN 5720 [0,2,0,0,0,0|2,0,0]=4 120 B4R0.1 C[C@H](O)CO 5853 [0,2,0,0,0,0|1,0,1]=4 121 B4R0.1 C\C(N)=N\O 31948 [0,2,0,0,0,0|1,0,0]=3 122 B4R0.1 NC(=O)CBr 31995 [0,2,0,0,0,0|2,0,0]=4 123 B4R0.1 NC(=O)CI 12542 [0,2,0,0,0,0|2,0,0]=4 124 B4R0.1 NCC(=O)O 18924 [0,2,0,0,0,0|1,0,0]=3 125 B4R0.1 NCC(=O)[O-] 26210 [0,2,0,0,0,0|1,0,1]=4 126 B4R0.1 NCC(=O)[O-] 9921 [0,2,0,0,0,0|1,0,1]=4 127 B4R0.1 NCC(N)=O 13019 [0,2,0,0,0,0|2,0,0]=4 128 B4R0.1 NNC(N)=O 15701 [0,2,0,0,0,0|1,0,1]=4 129 B4R0.1 O=C(Cl)CBr 24880 [0,2,0,0,0,0|2,0,0]=4 130 B4R0.1 O=C(O)CBr 13144 [0,2,0,0,0,0|1,0,0]=3 131 B4R0.1 O=CC(=O)O 19965 [0,2,0,0,0,0|1,0,0]=3 132 B4R0.1 OCC(F)F 26977 [0,2,0,0,0,0|2,0,0]=4 133 B4R0.1 ON=C(Br)Br 18640 [0,2,0,0,0,0|1,0,0]=3 134 B4R0.2 C#CCCO 13071 [0,2,0,0,0,0|2,0,0]=4 135 B4R0.2 C#CCOC 35042 [0,2,0,0,0,0|2,0,0]=4 136 B4R0.2 C#COCC 12592 [0,2,0,0,0,0|2,0,0]=4 137 B4R0.2 C=CCCO 18909 [0,2,0,0,0,0|2,0,0]=4 138 B4R0.2 C=COCC 18645 [0,2,0,0,0,0|2,0,0]=4 139 B4R0.2 CC#CCO 13061 [0,2,0,0,0,0|2,0,0]=4 140 B4R0.2 CCN=C=O 18636 [0,2,0,0,0,0|1,0,0]=3 141 B4R0.2 CCOCCl 18683 [0,2,0,0,0,0|2,0,0]=4 142 B4R0.2 COCC#N 28756 [0,2,0,0,0,0|2,0,0]=4 143 B4R0.2 COCCBr 2138 [0,2,0,0,0,0|2,0,0]=4 144 B4R0.2 COCCCl 1911 [0,2,0,0,0,0|2,0,0]=4 145 B4R0.2 COCCO 35138 [0,2,0,0,0,0|1,0,1]=4 146 B4R0.2 CSCCO 10846 [0,2,0,0,0,0|1,1,0]=4 147 B4R0.2 C\C=C\CO 21075 [0,2,0,0,0,0|2,0,0]=4 148 B4R0.2 N#CCC=O 18435 [0,2,0,0,0,0|2,0,0]=4 149 B4R0.2 N#CCCO 22156 [0,2,0,0,0,0|2,0,0]=4 150 B4R0.2 NNCCO 45109 [0,2,0,0,0,0|1,0,1]=4 151 B4R0.2 O=[Dy]O[Dy]=O 24590 [0,2,0,0,0,0|1,0,0]=3 152 B4R0.3 CC(C)(C)O 3012 [0,2,0,0,0,0|2,0,0]=4 153 B4R0.3 CC(O)(O)O 21654 [0,2,0,0,0,0|1,0,1]=4 154 B4R0.3 CP(=O)(Cl)Cl 25538 [0,2,0,0,0,0|1,1,0]=4 155 B4R0.3 CS(=O)(=O)Cl 1917 [0,2,0,0,0,0|1,0,1]=4 156 B4R0.3 CS(=O)(=O)O 11149 [0,2,0,0,0,0|1,0,0]=3 157 B4R0.3 CS(=O)(=O)[O-] 11154 [0,2,0,0,0,0|1,0,1]=4 158 B4R0.3 CS(=O)(=O)[O-] 2058 [0,2,0,0,0,0|1,0,1]=4 159 B4R0.3 C[Si](C)(C)O 26363 [0,2,0,0,0,0|2,0,0]=4 160 B4R0.3 NS(=O)(=O)Cl 21857 [0,2,0,0,0,0|1,0,1]=4 161 B4R0.3 O=I(=O)(=O)O 10330 [0,2,0,0,0,0|1,0,0]=3 162 B4R0.3 O=I(=O)(=O)[O-] 21354 [0,2,0,0,0,0|1,0,1]=4 163 B4R0.3 O=P(Br)(Br)Br 16710 [0,2,0,0,0,0|1,1,0]=4 164 B4R0.3 O=P([O-])([O-])[O-] 32371 [0,2,0,0,0,0|0,1,1]=4 165 B4R0.3 O=P([O-])([O-])[O-] 36056 [0,2,0,0,0,0|0,1,1]=4 166 B4R0.3 O=S(=O)(Cl)Cl 25435 [0,2,0,0,0,0|1,0,1]=4 167 B4R0.3 O=S(=O)(O)O 15719 [0,2,0,0,0,0|1,0,0]=3 168 B4R0.3 O=S(=O)(O)O 23245 [0,2,0,0,0,0|1,0,0]=3 169 B4R0.3 O=S(=O)(O)O 27282 [0,2,0,0,0,0|1,0,0]=3 170 B4R0.3 O=S(=O)(O)O 35641 [0,2,0,0,0,0|1,0,0]=3 171 B4R0.3 O=S(=O)([O-])[O-] 31942 [0,2,0,0,0,0|1,0,1]=4 172 B4R0.3 O=S(=O)([O-])[O-] 31944 [0,2,0,0,0,0|1,0,1]=4 173 B4R0.3 O[Si](O)(O)O 23349 [0,2,0,0,0,0|1,0,1]=4 174 B4R1.2 C[C@@H]1CO1 5829 [0,1,0,1,0,0|2,0,0]=4 175 B4R1.2 C[C@H]1CO1 5828 [0,1,0,1,0,0|2,0,0]=4 176 B4R1.2 OC1CC1 34599 [0,1,0,1,0,0|2,0,0]=4