0 B3R0.1 BrCCI OR460045 [0,0,0,0,0,0|2,0,0]=2 1 B3R0.1 C#CCBr OR01606 [0,0,0,0,0,0|1,0,2]=3 2 B3R0.1 C#CCC OR19587 [0,0,0,0,0,0|1,0,1]=2 3 B3R0.1 C#CCCl OR30795 [0,0,0,0,0,0|1,0,2]=3 4 B3R0.1 C#CCCl OR6425 [0,0,0,0,0,0|1,0,2]=3 5 B3R0.1 C=CC=C OR8596 [0,0,0,0,0,0|1,0,3]=4 6 B3R0.1 C=CCBr OR16937 [0,0,0,0,0,0|1,0,2]=3 7 B3R0.1 C=CCC OR8591 [0,0,0,0,0,0|1,0,1]=2 8 B3R0.1 C=CCCl OR3848 [0,0,0,0,0,0|1,0,2]=3 9 B3R0.1 C=CCI OR460034 [0,0,0,0,0,0|1,0,2]=3 10 B3R0.1 C=C[Mg]Br OR320074 [0,0,0,0,0,0|2,0,2]=4 11 B3R0.1 C=C[Mg]Cl OR320075 [0,0,0,0,0,0|2,0,2]=4 12 B3R0.1 CC#CC OR52506 [0,0,0,0,0,0|1,0,2]=3 13 B3R0.1 CC=CC OR61316 [0,0,0,0,0,0|1,0,2]=3 14 B3R0.1 CC=CCl OR40493 [0,0,0,0,0,0|1,0,2]=3 15 B3R0.1 CCC=O OR17251 [0,0,0,0,0,0|1,0,1]=2 16 B3R0.1 CCCC OR8385 [0,0,0,0,0,0|1,0,0]=1 17 B3R0.1 CCCCl OR460042 [0,0,0,0,0,0|1,0,0]=1 18 B3R0.1 CCCI OR4541 [0,0,0,0,0,0|1,0,0]=1 19 B3R0.1 CCCN OR15743 [0,0,0,0,0,0|0,0,0]=0 20 B3R0.1 CCNC OR30626 [0,0,0,0,0,0|2,0,0]=2 21 B3R0.1 CCNN OR939620 [0,0,0,0,0,0|1,0,0]=1 22 B3R0.1 CC[Mg]Br OR320091 [0,0,0,0,0,0|2,0,0]=2 23 B3R0.1 CC[Mg]Br OR320094 [0,0,0,0,0,0|2,0,0]=2 24 B3R0.1 CNOC OR12778 [0,0,0,0,0,0|3,0,0]=3 25 B3R0.1 COCBr OR11138 [0,0,0,0,0,0|2,0,0]=2 26 B3R0.1 CSCCl OR39998 [0,0,0,0,0,0|2,0,0]=2 27 B3R0.1 C\C=C/Cl OR4546 [0,0,0,0,0,0|1,0,2]=3 28 B3R0.1 C\C=C\C OR4472 [0,0,0,0,0,0|1,0,2]=3 29 B3R0.1 C\C=C\Cl OR6595 [0,0,0,0,0,0|1,0,2]=3 30 B3R0.1 ClCCI OR51875 [0,0,0,0,0,0|2,0,0]=2 31 B3R0.1 ICCI OR2622 [0,0,0,0,0,0|2,0,0]=2 32 B3R0.1 N#CCBr OR52127 [0,0,0,0,0,0|1,0,2]=3 33 B3R0.1 NCCBr OR1160 [0,0,0,0,0,0|1,0,0]=1 34 B3R0.1 NCCS OR9920T [0,0,0,0,0,0|1,0,0]=1 35 B3R0.1 N\C=N\O OR12756 [0,0,0,0,0,0|2,0,1]=3 36 B3R0.1 OCCBr OR30640 [0,0,0,0,0,0|2,0,0]=2 37 B2R0.1 C#CC OR4851 [1,0,0,0,0,0|0,0,2]=3 38 B2R0.1 C=C=C OR4738 [1,0,0,0,0,0|0,0,3]=4 39 B2R0.1 C=CBr OR40494 [1,0,0,0,0,0|1,0,2]=4 40 B2R0.1 CC#N OR10008 [1,0,0,0,0,0|0,0,2]=3 41 B2R0.1 CC#N OR46250 [1,0,0,0,0,0|0,0,2]=3 42 B2R0.1 CCBr OR30778 [1,0,0,0,0,0|1,0,0]=2 43 B2R0.1 CCI OR16933 [1,0,0,0,0,0|1,0,0]=2 44 B2R0.1 CCS OR41019 [1,0,0,0,0,0|1,0,0]=2 45 B2R0.1 CC[S-] OR45141 [1,0,0,0,0,0|1,0,0]=2 46 B2R0.1 CNC OR13973 [1,0,0,0,0,0|1,0,0]=2 47 B2R0.1 CNO OR12783 [1,0,0,0,0,0|2,0,0]=3 48 B2R0.1 COC OR51882 [1,0,0,0,0,0|1,0,0]=2 49 B2R0.1 CON OR18305 [1,0,0,0,0,0|1,0,0]=2 50 B2R0.1 C[Mg]Br OR320077 [1,0,0,0,0,0|2,0,0]=3 51 B2R0.1 C[Mg]Br OR320078 [1,0,0,0,0,0|2,0,0]=3 52 B2R0.1 C[Mg]Cl OR320084 [1,0,0,0,0,0|2,0,0]=3 53 B2R0.1 C[Mg]Cl OR320086 [1,0,0,0,0,0|2,0,0]=3 54 B2R0.1 ClCI OR30688 [1,0,0,0,0,0|2,0,0]=3 55 B2R0.1 ICI OR17001 [1,0,0,0,0,0|2,0,0]=3 56 B2R0.1 N#CN OR5505 [1,0,0,0,0,0|1,0,1]=3 57 B2R0.1 N#CN OR61501 [1,0,0,0,0,0|1,0,1]=3 58 B2R0.1 N#C[S-] OR5319 [1,0,0,0,0,0|1,0,2]=4 59 B2R0.1 N=CN OR42146 [1,0,0,0,0,0|1,0,1]=3 60 B4R0.1 C#CC(=C)C OR13594 [0,1,0,0,0,0|1,0,2]=4 61 B4R0.1 C#CC(C)=O OR7548 [0,1,0,0,0,0|1,0,2]=4 62 B4R0.1 C#CC(C)O OR01834 [0,1,0,0,0,0|1,0,1]=3 63 B4R0.1 C#C[C@@H](C)O OR16943 [0,1,0,0,0,0|1,0,1]=3 64 B4R0.1 C#C[C@H](C)O OR40593 [0,1,0,0,0,0|1,0,1]=3 65 B4R0.1 C=C(C)CBr OR17610 [0,1,0,0,0,0|1,0,1]=3 66 B4R0.1 C=C(C)CC OR14507 [0,1,0,0,0,0|1,0,1]=3 67 B4R0.1 C=C(C)CCl OR16423 [0,1,0,0,0,0|1,0,1]=3 68 B4R0.1 C=C(C)CN OR10897 [0,1,0,0,0,0|0,0,1]=2 69 B4R0.1 C=C(C)CN OR59958 [0,1,0,0,0,0|0,0,1]=2 70 B4R0.1 C=C(C)CO OR16426 [0,1,0,0,0,0|1,0,1]=3 71 B4R0.1 C=C(C)OC OR17619 [0,1,0,0,0,0|2,0,1]=4 72 B4R0.1 C=C(Cl)CCl OR5736 [0,1,0,0,0,0|1,0,2]=4 73 B4R0.1 C=C(Cl)CO OR9536 [0,1,0,0,0,0|1,0,2]=4 74 B4R0.1 C=CC(C)C OR460043 [0,1,0,0,0,0|1,0,1]=3 75 B4R0.1 C=CC(C)Cl OR55516 [0,1,0,0,0,0|1,0,1]=3 76 B4R0.1 CC(=O)C=O OR53061 [0,1,0,0,0,0|1,0,2]=4 77 B4R0.1 CC(=O)C=O OR5752 [0,1,0,0,0,0|1,0,2]=4 78 B4R0.1 CC(=O)CO OR17702 [0,1,0,0,0,0|1,0,1]=3 79 B4R0.1 CC(=O)NO OR6375T [0,1,0,0,0,0|2,0,1]=4 80 B4R0.1 CC(C)=CCl OR16424 [0,1,0,0,0,0|1,0,2]=4 81 B4R0.1 CC(C)C=O OR322092 [0,1,0,0,0,0|1,0,1]=3 82 B4R0.1 CC(C)CI OR2195 [0,1,0,0,0,0|1,0,0]=2 83 B4R0.1 CC(C)NN OR7919 [0,1,0,0,0,0|1,0,0]=2 84 B4R0.1 CC(C)NO OR59437 [0,1,0,0,0,0|2,0,0]=3 85 B4R0.1 CC(C)ON OR933332 [0,1,0,0,0,0|1,0,0]=2 86 B4R0.1 CC(C)[Mg]Br OR320105 [0,1,0,0,0,0|2,0,0]=3 87 B4R0.1 CC(C)[Mg]Br OR320106 [0,1,0,0,0,0|2,0,0]=3 88 B4R0.1 CC(C)[Mg]Cl OR320107 [0,1,0,0,0,0|2,0,0]=3 89 B4R0.1 CCB(O)O OR8874 [0,1,0,0,0,0|2,0,0]=3 90 B4R0.1 CCC(=N)N OR200136 [0,1,0,0,0,0|0,0,1]=2 91 B4R0.1 CCC(=O)[O-] OR70110 [0,1,0,0,0,0|1,0,1]=3 92 B4R0.1 CCC(C)Br OR4335 [0,1,0,0,0,0|1,0,0]=2 93 B4R0.1 CCC(C)Cl OR460003 [0,1,0,0,0,0|1,0,0]=2 94 B4R0.1 CCC(C)I OR5340 [0,1,0,0,0,0|1,0,0]=2 95 B4R0.1 CC[C@@H](C)N OR59999 [0,1,0,0,0,0|0,0,0]=1 96 B4R0.1 CC[C@@H](C)O OR304038 [0,1,0,0,0,0|1,0,0]=2 97 B4R0.1 CC[C@H](C)N OR60000 [0,1,0,0,0,0|0,0,0]=1 98 B4R0.1 CC[C@H](C)O OR4619 [0,1,0,0,0,0|1,0,0]=2 99 B4R0.1 CN(C)C#N OR12758 [0,1,0,0,0,0|1,0,2]=4 100 B4R0.1 COC(N)=O OR46510 [0,1,0,0,0,0|1,0,1]=3 101 B4R0.1 CSC(=N)N OR25052 [0,1,0,0,0,0|1,0,1]=3 102 B4R0.1 C[C@@H](N)CO OR0903 [0,1,0,0,0,0|1,0,0]=2 103 B4R0.1 C[C@@H](O)CN OR304058 [0,1,0,0,0,0|0,0,0]=1 104 B4R0.1 C[C@H](N)CO OR5875 [0,1,0,0,0,0|1,0,0]=2 105 B4R0.1 C[C@H](O)CN OR30797 [0,1,0,0,0,0|0,0,0]=1 106 B4R0.1 C\C(Cl)=C/Cl OR460035 [0,1,0,0,0,0|1,0,2]=4 107 B4R0.1 C\C(N)=N\O OR30585 [0,1,0,0,0,0|2,0,1]=4 108 B4R0.1 N#CC(Cl)Cl OR1953 [0,1,0,0,0,0|1,0,2]=4 109 B4R0.1 N=C(N)CCl OR3921 [0,1,0,0,0,0|1,0,1]=3 110 B4R0.1 N=C(N)NN OR52394 [0,1,0,0,0,0|2,0,1]=4 111 B4R0.1 NC(=O)CBr OR6592 [0,1,0,0,0,0|1,0,1]=3 112 B4R0.1 NC(=O)CCl OR12801 [0,1,0,0,0,0|1,0,1]=3 113 B4R0.1 NC(=O)CI OR59962 [0,1,0,0,0,0|1,0,1]=3 114 B4R0.1 NC(=O)CO OR21888 [0,1,0,0,0,0|1,0,1]=3 115 B4R0.1 NC(=O)CS OR24255 [0,1,0,0,0,0|1,0,1]=3 116 B4R0.1 NC(=O)NO OR9108 [0,1,0,0,0,0|2,0,1]=4 117 B4R0.1 O=C(Cl)CBr OR54475 [0,1,0,0,0,0|2,0,1]=4 118 B4R0.1 O=C(O)CBr OR6366 [0,1,0,0,0,0|2,0,1]=4 119 B4R0.1 O=C(O)CI OR322006 [0,1,0,0,0,0|2,0,1]=4 120 B4R0.1 O=C(O)CO OR13191 [0,1,0,0,0,0|2,0,1]=4 121 B4R0.1 O=C([O-])CS OR30627 [0,1,0,0,0,0|2,0,1]=4 122 B4R0.1 O=S([O-])CO OR922468 [0,1,0,0,0,0|3,0,0]=4 123 B4R0.1 O=[N+]([O-])CBr OR3067 [0,1,0,0,0,0|3,0,0]=4 124 B4R0.2 BrCCCBr OR0972 [0,1,0,0,0,0|1,0,0]=2 125 B4R0.2 C#CCCC OR5512 [0,1,0,0,0,0|1,0,0]=2 126 B4R0.2 C#CCCO OR1952 [0,1,0,0,0,0|1,0,1]=3 127 B4R0.2 C#COCC OR4769 [0,1,0,0,0,0|1,0,1]=3 128 B4R0.2 C=CCCBr OR8033 [0,1,0,0,0,0|1,0,1]=3 129 B4R0.2 C=CCCC OR5326 [0,1,0,0,0,0|1,0,0]=2 130 B4R0.2 C=CCNC OR3619 [0,1,0,0,0,0|0,0,2]=3 131 B4R0.2 C=CC[Mg]Br OR320140 [0,1,0,0,0,0|1,0,2]=4 132 B4R0.2 C=CC[Mg]Br OR320141 [0,1,0,0,0,0|1,0,2]=4 133 B4R0.2 C=CC[Mg]Cl OR320143 [0,1,0,0,0,0|1,0,2]=4 134 B4R0.2 C=CC[Mg]Cl OR320144 [0,1,0,0,0,0|1,0,2]=4 135 B4R0.2 CC#CCBr OR5530 [0,1,0,0,0,0|1,0,1]=3 136 B4R0.2 CC#CCO OR14505 [0,1,0,0,0,0|1,0,1]=3 137 B4R0.2 CC=CCCl OR5497 [0,1,0,0,0,0|1,0,1]=3 138 B4R0.2 CC=CCO OR18372 [0,1,0,0,0,0|1,0,1]=3 139 B4R0.2 CCCC#N OR9437 [0,1,0,0,0,0|0,0,1]=2 140 B4R0.2 CCCCBr OR460056 [0,1,0,0,0,0|1,0,0]=2 141 B4R0.2 CCCCI OR3174 [0,1,0,0,0,0|1,0,0]=2 142 B4R0.2 CCOC=O OR28814 [0,1,0,0,0,0|1,0,1]=3 143 B4R0.2 CNCCN OR6516 [0,1,0,0,0,0|0,0,0]=1 144 B4R0.2 COCC#N OR5269 [0,1,0,0,0,0|0,0,2]=3 145 B4R0.2 COCCBr OR11137 [0,1,0,0,0,0|1,0,0]=2 146 B4R0.2 COCCN OR59868 [0,1,0,0,0,0|0,0,0]=1 147 B4R0.2 CSCCN OR4873 [0,1,0,0,0,0|0,0,0]=1 148 B4R0.2 C\C=C\CCl OR51978 [0,1,0,0,0,0|1,0,1]=3 149 B4R0.2 ClCCCCl OR0973 [0,1,0,0,0,0|1,0,0]=2 150 B4R0.2 ClCCCI OR2939 [0,1,0,0,0,0|1,0,0]=2 151 B4R0.2 ICCCI OR4510 [0,1,0,0,0,0|1,0,0]=2 152 B4R0.2 N#CCCBr OR322150 [0,1,0,0,0,0|0,0,2]=3 153 B4R0.2 N#CCCO OR3049 [0,1,0,0,0,0|0,0,2]=3 154 B4R0.2 NCCCBr OR322151 [0,1,0,0,0,0|0,0,0]=1 155 B4R0.2 NNCCO OR9124 [0,1,0,0,0,0|1,0,0]=2 156 B4R0.2 OCCCBr OR0978 [0,1,0,0,0,0|1,0,0]=2 157 B4R0.2 OCCCCl OR0977 [0,1,0,0,0,0|1,0,0]=2 158 B4R1.1 C1CNC1 OR59419 [0,0,0,1,0,0|0,0,0]=1 159 B4R1.1 C1CNC1 OR59858 [0,0,0,1,0,0|0,0,0]=1 160 B4R1.2 BrC1CC1 OR18407 [0,0,0,1,0,0|1,0,0]=2 161 B4R1.2 NC1CC1 OR18344 [0,0,0,1,0,0|0,0,0]=1 162 B1R0.1 Br[Ag] OR7534 [2,0,0,0,0,0|2,0,0]=4 163 B1R0.1 C=C OR1710 [2,0,0,0,0,0|0,0,2]=4 164 B1R0.1 CC OR8295 [2,0,0,0,0,0|0,0,0]=2 165 B1R0.1 CCl OR40678 [2,0,0,0,0,0|1,0,0]=3 166 B1R0.1 C[S-] OR28823 [2,0,0,0,0,0|1,0,0]=3 167 B1R0.1 NO OR62004 [2,0,0,0,0,0|1,0,0]=3 168 B1R0.1 [C-]#[O+] OR1900 [2,0,0,0,0,0|1,0,1]=4 169 B1R0.1 [C-]#[O+] OR1901 [2,0,0,0,0,0|1,0,1]=4 170 B1R0.1 [C-]#[O+] OR1902 [2,0,0,0,0,0|1,0,1]=4 171 B3R0.2 C=C(C)Br OR55140 [1,1,0,0,0,0|0,0,2]=4 172 B3R0.2 C=C(C)C OR40492 [1,1,0,0,0,0|0,0,1]=3 173 B3R0.2 C=C(C)Cl OR1897 [1,1,0,0,0,0|0,0,2]=4 174 B3R0.2 CB(O)O OR3322 [1,1,0,0,0,0|2,0,0]=4 175 B3R0.2 CC(=N)N OR30204 [1,1,0,0,0,0|0,0,1]=3 176 B3R0.2 CC(=O)Br OR1943 [1,1,0,0,0,0|1,0,1]=4 177 B3R0.2 CC(=O)O OR28877 [1,1,0,0,0,0|1,0,1]=4 178 B3R0.2 CC(=O)O OR40340 [1,1,0,0,0,0|1,0,1]=4 179 B3R0.2 CC(=O)[O-] OR11032 [1,1,0,0,0,0|1,0,1]=4 180 B3R0.2 CC(=O)[S-] OR59966 [1,1,0,0,0,0|1,0,1]=4 181 B3R0.2 CC(C)I OR4540 [1,1,0,0,0,0|0,0,0]=2 182 B3R0.2 CC(C)N OR61315 [1,1,0,0,0,0|0,0,0]=2 183 B3R0.2 CC(Cl)Cl OR3712 [1,1,0,0,0,0|1,0,0]=3 184 B3R0.2 CC(N)=O OR16407 [1,1,0,0,0,0|0,0,1]=3 185 B3R0.2 CC(N)=S OR28604 [1,1,0,0,0,0|0,0,1]=3 186 B3R0.2 CN(C)C OR5415 [1,1,0,0,0,0|1,0,0]=3 187 B3R0.2 CS(=O)[O-] OR42101 [1,1,0,0,0,0|2,0,0]=4 188 B3R0.2 CS(C)=O OR61029 [1,1,0,0,0,0|1,0,0]=3 189 B3R0.2 C[13C](=O)O OR60238 [1,1,0,0,0,0|1,0,1]=4 190 B3R0.2 C[SiH](C)C OR17012 [1,1,0,0,0,0|0,1,0]=3 191 B3R0.2 N=C(N)Cl OR40351 [1,1,0,0,0,0|1,0,1]=4 192 B3R0.2 NC(N)=O OR59884 [1,1,0,0,0,0|1,0,1]=4 193 B5R0.1 C=CC[C@H](C)O OR304051 [0,2,0,0,0,0|1,0,0]=3 194 B5R0.1 CC(=O)NCO OR61255 [0,2,0,0,0,0|1,0,1]=4 195 B5R0.1 CC(C)=CCBr OR46013 [0,2,0,0,0,0|1,0,1]=4 196 B5R0.1 CC(C)=CCCl OR22167 [0,2,0,0,0,0|1,0,1]=4 197 B5R0.1 CC(C)CC#N OR52674 [0,2,0,0,0,0|0,0,1]=3 198 B5R0.1 CC(C)CCI OR8220 [0,2,0,0,0,0|1,0,0]=3 199 B5R0.1 CC(C)CCN OR12816 [0,2,0,0,0,0|0,0,0]=2 200 B5R0.1 CC(C)CCO OR460021 [0,2,0,0,0,0|1,0,0]=3 201 B5R0.1 CC(C)CNN OR0203 [0,2,0,0,0,0|0,0,0]=2 202 B5R0.1 CC(C)C[Mg]Br OR52618 [0,2,0,0,0,0|1,0,0]=3 203 B5R0.1 CC(C)N=C=S OR30306 [0,2,0,0,0,0|1,0,1]=4 204 B5R0.1 CC(O)CC#N OR2847 [0,2,0,0,0,0|0,0,1]=3 205 B5R0.1 CCCB(O)O OR8415 [0,2,0,0,0,0|1,0,0]=3 206 B5R0.1 CCCC(=O)O OR6005 [0,2,0,0,0,0|1,0,0]=3 207 B5R0.1 CCCC(=O)[O-] OR8783 [0,2,0,0,0,0|1,0,0]=3 208 B5R0.1 CCCC(C)N OR10075 [0,2,0,0,0,0|0,0,0]=2 209 B5R0.1 CCNC(N)=O OR42229 [0,2,0,0,0,0|0,0,1]=3 210 B5R0.1 CCOC(=S)[S-] OR59885 [0,2,0,0,0,0|1,0,1]=4 211 B5R0.1 CN(C)CCN OR6514 [0,2,0,0,0,0|0,0,0]=2 212 B5R0.1 COCC(=O)Cl OR40393 [0,2,0,0,0,0|1,0,1]=4 213 B5R0.1 CSCC(=O)O OR4573 [0,2,0,0,0,0|1,0,1]=4 214 B5R0.1 C[C@@H](O)CCO OR2223 [0,2,0,0,0,0|1,0,0]=3 215 B5R0.1 N#CCC(N)=S OR29773 [0,2,0,0,0,0|0,0,2]=4 216 B5R0.1 NC(=O)CCBr OR322315 [0,2,0,0,0,0|0,0,1]=3 217 B5R0.1 NC(=O)CCCl OR26786 [0,2,0,0,0,0|0,0,1]=3 218 B5R0.1 NCCC(=O)O OR5225 [0,2,0,0,0,0|0,0,1]=3 219 B5R0.1 O=C(Cl)CCCl OR11057 [0,2,0,0,0,0|1,0,1]=4 220 B5R0.1 O=C(O)CCBr OR8993 [0,2,0,0,0,0|1,0,1]=4 221 B5R0.1 O=C(O)CCO OR59874 [0,2,0,0,0,0|1,0,1]=4 222 B5R0.1 O=C(O)CCO OR70031 [0,2,0,0,0,0|1,0,1]=4 223 B5R0.3 C=C(CCl)CCl OR11145 [0,2,0,0,0,0|1,0,1]=4 224 B5R0.3 C=C(CO)CO OR54371 [0,2,0,0,0,0|1,0,1]=4 225 B5R0.3 C=CC(=O)CC OR70148 [0,2,0,0,0,0|1,0,1]=4 226 B5R0.3 CC(C=O)=CN OR2402 [0,2,0,0,0,0|0,0,2]=4 227 B5R0.3 CCC(=O)CBr OR1465 [0,2,0,0,0,0|1,0,0]=3 228 B5R0.3 CCC(Br)CBr OR70073 [0,2,0,0,0,0|1,0,0]=3 229 B5R0.3 CCC(C)CN OR28802 [0,2,0,0,0,0|0,0,0]=2 230 B5R0.3 CCC(C)NN OR318093 [0,2,0,0,0,0|0,0,0]=2 231 B5R0.3 CCC(C)OC OR14508 [0,2,0,0,0,0|1,0,0]=3 232 B5R0.3 CCC(N)CC OR10080 [0,2,0,0,0,0|0,0,0]=2 233 B5R0.3 CCC(N)CO OR16670 [0,2,0,0,0,0|0,0,0]=2 234 B5R0.3 CCC(O)CC OR10042 [0,2,0,0,0,0|1,0,0]=3 235 B5R0.3 CCC(O)CN OR1554 [0,2,0,0,0,0|0,0,0]=2 236 B5R0.3 CC[C@@H](N)CO OR5871 [0,2,0,0,0,0|0,0,0]=2 237 B5R0.3 CC[C@@H](O)CO OR52088 [0,2,0,0,0,0|1,0,0]=3 238 B5R0.3 CC[C@H](N)CO OR5854 [0,2,0,0,0,0|0,0,0]=2 239 B5R0.3 CNC(=N)NN OR26561 [0,2,0,0,0,0|1,0,1]=4 240 B5R0.3 CN[C@@H](C)CO OR55461 [0,2,0,0,0,0|1,0,0]=3 241 B5R0.3 CN[C@H](C)CO OR55460 [0,2,0,0,0,0|1,0,0]=3 242 B5R0.3 COC(=O)CN OR52169 [0,2,0,0,0,0|0,0,1]=3 243 B5R0.3 COC(=O)CO OR21875 [0,2,0,0,0,0|1,0,1]=4 244 B5R0.3 COC(=O)CS OR62074 [0,2,0,0,0,0|1,0,1]=4 245 B5R0.3 CSC(=N)NN OR10968 [0,2,0,0,0,0|1,0,1]=4 246 B5R0.3 ClCC(Br)CBr OR1177 [0,2,0,0,0,0|1,0,0]=3 247 B5R0.3 NC(CO)CO OR5368 [0,2,0,0,0,0|1,0,0]=3 248 B5R0.3 NCC(O)CN OR1859 [0,2,0,0,0,0|0,0,0]=2 249 B5R0.3 NCC(O)CO OR10134 [0,2,0,0,0,0|0,0,0]=2 250 B5R0.3 NC[C@H](O)CO OR42150 [0,2,0,0,0,0|0,0,0]=2 251 B5R0.3 O=C(CBr)CBr OR16995 [0,2,0,0,0,0|1,0,1]=4 252 B5R0.3 OC(CBr)CBr OR1061 [0,2,0,0,0,0|1,0,0]=3 253 B5R0.3 OC(CCl)CCl OR61346 [0,2,0,0,0,0|1,0,0]=3 254 B5R0.3 OCC(Br)CBr OR4897 [0,2,0,0,0,0|1,0,0]=3 255 B5R0.3 OCC(O)CBr OR3095 [0,2,0,0,0,0|1,0,0]=3 256 B5R0.3 OCC(O)CS OR61438 [0,2,0,0,0,0|1,0,0]=3 257 B5R0.4 C#CC(C)(C)C OR11141 [0,2,0,0,0,0|1,0,1]=4 258 B5R0.4 C#CC(C)(C)Cl OR13593 [0,2,0,0,0,0|1,0,1]=4 259 B5R0.4 C#CC(C)(C)N OR16455 [0,2,0,0,0,0|0,0,2]=4 260 B5R0.4 C=CC(C)(C)C OR28711 [0,2,0,0,0,0|1,0,1]=4 261 B5R0.4 CC(C)(Br)C=O OR52528 [0,2,0,0,0,0|1,0,1]=4 262 B5R0.4 CC(C)(C)C#N OR6535 [0,2,0,0,0,0|0,0,2]=4 263 B5R0.4 CC(C)(C)C=O OR28610 [0,2,0,0,0,0|1,0,1]=4 264 B5R0.4 CC(C)(C)CCl OR460072 [0,2,0,0,0,0|1,0,0]=3 265 B5R0.4 CC(C)(C)CN OR938214 [0,2,0,0,0,0|0,0,0]=2 266 B5R0.4 CC(C)(C)NN OR28606 [0,2,0,0,0,0|1,0,0]=3 267 B5R0.4 CC(C)(C)NO OR24575 [0,2,0,0,0,0|2,0,0]=4 268 B5R0.4 CC(C)(C)NO OR45111 [0,2,0,0,0,0|2,0,0]=4 269 B5R0.4 CC(C)(C)ON OR24583 [0,2,0,0,0,0|1,0,0]=3 270 B5R0.4 CC(C)(C)[Mg]Cl OR320126 [0,2,0,0,0,0|2,0,0]=4 271 B5R0.4 CC(C)(Cl)CCl OR16427 [0,2,0,0,0,0|1,0,0]=3 272 B5R0.4 CC(C)(N)C#N OR315172 [0,2,0,0,0,0|0,0,2]=4 273 B5R0.4 CC(C)(N)CN OR30693 [0,2,0,0,0,0|0,0,0]=2 274 B5R0.4 CC(C)(N)CO OR1740T [0,2,0,0,0,0|1,0,0]=3 275 B5R0.4 CC(C)(O)CCl OR4348 [0,2,0,0,0,0|1,0,0]=3 276 B5R0.4 CC(C)(O)CN OR301207 [0,2,0,0,0,0|0,0,0]=2 277 B5R0.4 CC(C)(O)CO OR310412 [0,2,0,0,0,0|1,0,0]=3 278 B5R0.4 CCS(N)(=O)=O OR51744 [0,2,0,0,0,0|1,0,0]=3 279 B5R0.4 CNC(C)(C)C OR10027 [0,2,0,0,0,0|2,0,0]=4 280 B5R0.4 COC(C)(C)C OR59936 [0,2,0,0,0,0|2,0,0]=4 281 B5R0.4 C[Si](C)(C)CCl OR3470 [0,2,0,0,0,0|1,1,0]=4 282 B5R0.4 C[Si](C)(C)ON OR42005 [0,2,0,0,0,0|1,1,0]=4 283 B5R0.4 OCC(Br)(Br)Br OR1882 [0,2,0,0,0,0|2,0,0]=4 284 B5R0.4 OCC(Cl)(Cl)Cl OR40732 [0,2,0,0,0,0|2,0,0]=4 285 B5R0.5 C=C(C)C(C)C OR46606 [0,2,0,0,0,0|1,0,1]=4 286 B5R0.5 CC(=O)C(C)Br OR1466 [0,2,0,0,0,0|1,0,1]=4 287 B5R0.5 CC(=O)C(C)C OR5350 [0,2,0,0,0,0|1,0,1]=4 288 B5R0.5 CC(Br)C(=O)Cl OR40726 [0,2,0,0,0,0|1,0,1]=4 289 B5R0.5 CC(Br)C(N)=O OR24705 [0,2,0,0,0,0|0,0,1]=3 290 B5R0.5 CC(C)B(O)O OR8880 [0,2,0,0,0,0|2,0,0]=4 291 B5R0.5 CC(C)C(=N)N OR27276 [0,2,0,0,0,0|0,0,1]=3 292 B5R0.5 CC(C)C(=O)Cl OR10005 [0,2,0,0,0,0|1,0,1]=4 293 B5R0.5 CC(C)C(C)C OR53144 [0,2,0,0,0,0|1,0,0]=3 294 B5R0.5 CC(C)C(C)O OR10026 [0,2,0,0,0,0|1,0,0]=3 295 B5R0.5 CN(C)C(N)=O OR48247 [0,2,0,0,0,0|1,0,1]=4 296 B5R0.5 C[C@@H](Cl)C(=O)O OR52411 [0,2,0,0,0,0|1,0,1]=4 297 B5R0.5 C[C@@H](O)C(=O)O OR960721 [0,2,0,0,0,0|1,0,1]=4 298 B5R0.5 C[C@@H](O)C(N)=O OR18079 [0,2,0,0,0,0|0,0,1]=3 299 B5R0.5 C[C@@H](O)[C@@H](C)O OR15918 [0,2,0,0,0,0|1,0,0]=3 300 B5R0.5 C[C@H](Cl)C(=O)O OR28944 [0,2,0,0,0,0|1,0,1]=4 301 B5R0.5 C[C@H](N)C(N)=O OR22615 [0,2,0,0,0,0|0,0,1]=3 302 B5R0.5 C[C@H](O)[C@H](C)O OR15919 [0,2,0,0,0,0|1,0,0]=3 303 B5R0.5 NC(=O)C(Cl)Cl OR14320 [0,2,0,0,0,0|1,0,1]=4 304 B5R0.5 [C@H](C)(N)C(N)=O OR22614 [0,2,0,0,0,0|0,0,1]=3 305 B5R0.2 BrC\C=C\CBr OR3193 [0,2,0,0,0,0|1,0,1]=4 306 B5R0.2 C#CCCC#N OR70029 [0,2,0,0,0,0|0,0,2]=4 307 B5R0.2 C#CCCCC OR0049 [0,2,0,0,0,0|1,0,0]=3 308 B5R0.2 C#CCCCCl OR14511 [0,2,0,0,0,0|1,0,0]=3 309 B5R0.2 C#CCCCO OR5518 [0,2,0,0,0,0|1,0,0]=3 310 B5R0.2 C=CCCCBr OR30608 [0,2,0,0,0,0|1,0,0]=3 311 B5R0.2 C=CCNC=O OR28268 [0,2,0,0,0,0|0,0,2]=4 312 B5R0.2 C=CCOCCl OR53036 [0,2,0,0,0,0|1,0,1]=4 313 B5R0.2 C=COCCO OR904259 [0,2,0,0,0,0|1,0,1]=4 314 B5R0.2 CCC#CCC OR5524 [0,2,0,0,0,0|1,0,0]=3 315 B5R0.2 CCC#CCO OR5519 [0,2,0,0,0,0|1,0,0]=3 316 B5R0.2 CCCCC=O OR5422 [0,2,0,0,0,0|1,0,0]=3 317 B5R0.2 CCCCCBr OR5396 [0,2,0,0,0,0|1,0,0]=3 318 B5R0.2 CCCCCI OR53033 [0,2,0,0,0,0|1,0,0]=3 319 B5R0.2 CCCCCN OR10079 [0,2,0,0,0,0|0,0,0]=2 320 B5R0.2 CCCCCO OR5324 [0,2,0,0,0,0|1,0,0]=3 321 B5R0.2 CCCC[Mg]Br OR320111 [0,2,0,0,0,0|1,0,0]=3 322 B5R0.2 CCCN=C=S OR30307 [0,2,0,0,0,0|0,0,1]=3 323 B5R0.2 CCNCCN OR6517 [0,2,0,0,0,0|0,0,0]=2 324 B5R0.2 CCO\C=C/Br OR10832 [0,2,0,0,0,0|1,0,1]=4 325 B5R0.2 CCSCCCl OR10841 [0,2,0,0,0,0|1,0,0]=3 326 B5R0.2 CCSCCN OR8640 [0,2,0,0,0,0|0,0,0]=2 327 B5R0.2 CNCCCO OR309167 [0,2,0,0,0,0|0,0,0]=2 328 B5R0.2 CNCCNC OR322130 [0,2,0,0,0,0|0,0,0]=2 329 B5R0.2 COCCCBr OR911631 [0,2,0,0,0,0|1,0,0]=3 330 B5R0.2 COCCCN OR54484 [0,2,0,0,0,0|0,0,0]=2 331 B5R0.2 COCCCO OR0976 [0,2,0,0,0,0|1,0,0]=3 332 B5R0.2 CSCCCN OR12831 [0,2,0,0,0,0|0,0,0]=2 333 B5R0.2 ClCC#CCCl OR5528 [0,2,0,0,0,0|1,0,1]=4 334 B5R0.2 ClCCCCBr OR919950 [0,2,0,0,0,0|1,0,0]=3 335 B5R0.2 ClCCCCI OR61420 [0,2,0,0,0,0|1,0,0]=3 336 B5R0.2 ICCCCI OR460062 [0,2,0,0,0,0|1,0,0]=3 337 B5R0.2 N#CCCCBr OR45083 [0,2,0,0,0,0|0,0,1]=3 338 B5R0.2 NCC#CCCl OR28056 [0,2,0,0,0,0|0,0,1]=3 339 B5R0.2 O=C=NCCCl OR6436 [0,2,0,0,0,0|1,0,1]=4 340 B5R0.2 OCCCCBr OR4233 [0,2,0,0,0,0|1,0,0]=3 341 B5R0.2 OCCCCCl OR13226 [0,2,0,0,0,0|1,0,0]=3 342 B5R0.2 S=C=NCCBr OR4186 [0,2,0,0,0,0|1,0,1]=4 343 B5R0.2 S=C=NCCCl OR322152 [0,2,0,0,0,0|1,0,1]=4 344 B3R1.1 C1CC1 OR55510 [1,0,0,1,0,0|0,0,0]=2 345 B5R1.2 BrC1CCC1 OR41168 [0,1,0,1,0,0|1,0,0]=3 346 B5R1.2 BrC1COC1 OR301081 [0,1,0,1,0,0|1,0,0]=3 347 B5R1.2 NC1CCC1 OR59991 [0,1,0,1,0,0|0,0,0]=2 348 B5R1.2 NC1COC1 OR308008 [0,1,0,1,0,0|0,0,0]=2 349 B5R1.2 O=C1CCC1 OR30488 [0,1,0,1,0,0|1,0,0]=3 350 B5R1.2 O=C1CCN1 OR24812 [0,1,0,1,0,0|0,0,1]=3 351 B5R1.2 O=C1CNC1 OR308018 [0,1,0,1,0,0|0,0,1]=3 352 B5R1.2 O=C1COC1 OR301011 [0,1,0,1,0,0|1,0,1]=4 353 B5R1.2 OC1CNC1 OR1873 [0,1,0,1,0,0|0,0,0]=2 354 B5R1.2 OC1CNC1 OR301160 [0,1,0,1,0,0|0,0,0]=2 355 B5R1.2 OC1COC1 OR60206 [0,1,0,1,0,0|1,0,0]=3 356 B5R1.3 BrCC1CC1 OR28323 [0,1,0,1,0,0|1,0,0]=3 357 B5R1.3 C#CC1CC1 OR11148 [0,1,0,1,0,0|1,0,0]=3 358 B5R1.3 C=CC1CO1 OR40458 [0,1,0,1,0,0|1,0,1]=4 359 B5R1.3 CCC1CO1 OR40339 [0,1,0,1,0,0|1,0,0]=3 360 B5R1.3 CC[C@@H]1CO1 OR42174 [0,1,0,1,0,0|1,0,0]=3 361 B5R1.3 CC[C@H]1CO1 OR42173 [0,1,0,1,0,0|1,0,0]=3 362 B5R1.3 ClCC1CC1 OR460074 [0,1,0,1,0,0|1,0,0]=3 363 B5R1.3 ClC[C@@H]1CO1 OR28971 [0,1,0,1,0,0|1,0,0]=3 364 B5R1.3 ClC[C@H]1CO1 OR28970 [0,1,0,1,0,0|1,0,0]=3 365 B5R1.3 N#CC1CC1 OR0999 [0,1,0,1,0,0|0,0,1]=3 366 B5R1.3 NCC1CC1 OR17033 [0,1,0,1,0,0|0,0,0]=2 367 B5R1.3 NCC1CC1 OR1937 [0,1,0,1,0,0|0,0,0]=2 368 B5R1.3 O=CC1CC1 OR52083 [0,1,0,1,0,0|1,0,0]=3 369 B5R1.3 OCC1CC1 OR6507 [0,1,0,1,0,0|1,0,0]=3 370 B5R1.3 OCC1CO1 OR3778 [0,1,0,1,0,0|1,0,0]=3 371 B5R1.3 OC[C@@H]1CO1 OR70065 [0,1,0,1,0,0|1,0,0]=3 372 B5R1.3 OC[C@H]1CO1 OR42180 [0,1,0,1,0,0|1,0,0]=3 373 B5R1.5 CC1(C)CN1 OR303021 [0,1,0,1,0,0|0,0,0]=2 374 B5R1.5 CC1(N)CC1 OR16691 [0,1,0,1,0,0|0,0,0]=2 375 B5R1.1 C1=CCCC1 OR10096 [0,1,0,1,0,0|1,0,0]=3 376 B5R1.1 C1=CCNC1 OR2396 [0,1,0,1,0,0|0,0,1]=3 377 B5R1.1 C1=CCOC1 OR5462 [0,1,0,1,0,0|1,0,1]=4 378 B5R1.1 C1=COCC1 OR2896 [0,1,0,1,0,0|1,0,1]=4 379 B5R1.1 C1=NCCO1 OR305316 [0,1,0,1,0,0|0,0,2]=4 380 B5R1.1 C1CCCC1 OR61603 [0,1,0,1,0,0|1,0,0]=3 381 B5R1.1 C1CCNC1 OR0971 [0,1,0,1,0,0|0,0,0]=2 382 B5R1.1 C1CCOC1 OR30761S [0,1,0,1,0,0|1,0,0]=3 383 B5R1.1 C1CNOC1 OR55263 [0,1,0,1,0,0|0,0,0]=2