0 B4R0.2 C#CCCBr H53367 [0,0,0,0,0,0|2,0,2]=4 1 B4R0.2 C#CCCO A11477 [0,0,0,0,0,0|2,0,2]=4 2 B4R0.2 C(CBr)C#N B23998 [0,0,0,0,0,0|3,0,1]=4 3 B4R0.2 C(CBr)CBr A14687 [0,0,0,0,0,0|3,0,0]=3 4 B4R0.2 C(CCl)C#N L05902 [0,0,0,0,0,0|3,0,1]=4 5 B4R0.2 C(CCl)CBr A11395 [0,0,0,0,0,0|3,0,0]=3 6 B4R0.2 C(CCl)CCl 36685 [0,0,0,0,0,0|3,0,0]=3 7 B4R0.2 C(CCl)CI A13489 [0,0,0,0,0,0|3,0,0]=3 8 B4R0.2 C(CF)CF L12351 [0,0,0,0,0,0|3,0,0]=3 9 B4R0.2 C(CI)CI A10616 [0,0,0,0,0,0|3,0,0]=3 10 B4R0.2 C(CN)C#N A13043 [0,0,0,0,0,0|3,0,1]=4 11 B4R0.2 C(CN)CBr B23254 [0,0,0,0,0,0|3,0,0]=3 12 B4R0.2 C(CN)CCl A15415 [0,0,0,0,0,0|3,0,0]=3 13 B4R0.2 C(CN)CN A11932 [0,0,0,0,0,0|3,0,0]=3 14 B4R0.2 C(CN)CO B23041 [0,0,0,0,0,0|3,0,0]=3 15 B4R0.2 C(CO)C#N L12570 [0,0,0,0,0,0|3,0,1]=4 16 B4R0.2 C(CO)CBr B22857 [0,0,0,0,0,0|3,0,0]=3 17 B4R0.2 C(CO)CCl A16871 [0,0,0,0,0,0|3,0,0]=3 18 B4R0.2 C(CO)CO A10829 [0,0,0,0,0,0|3,0,0]=3 19 B4R0.2 C(CO)NN 43793 [0,0,0,0,0,0|4,0,0]=4 20 B4R0.2 C(CS)CS A15261 [0,0,0,0,0,0|3,0,0]=3 21 B4R0.2 C(C[Zn+])C#N H58695 [0,0,0,0,0,0|3,0,1]=4 22 B4R0.2 C(SC#N)Cl A12108 [0,0,0,0,0,0|2,0,1]=3 23 B4R0.2 C(\C=C\Cl)Cl L10332 [0,0,0,0,0,0|3,0,1]=4 24 B4R0.2 C=CCCBr A10977 [0,0,0,0,0,0|2,0,2]=4 25 B4R0.2 C=CCCN L20157 [0,0,0,0,0,0|2,0,2]=4 26 B4R0.2 C=CCCO L00767 [0,0,0,0,0,0|2,0,2]=4 27 B4R0.2 C=CCC[Zn+] H58171 [0,0,0,0,0,0|2,0,2]=4 28 B4R0.2 CC#CCBr L20134 [0,0,0,0,0,0|2,0,1]=3 29 B4R0.2 CC#CCO A15709 [0,0,0,0,0,0|2,0,1]=3 30 B4R0.2 CCC#CC L02973 [0,0,0,0,0,0|1,0,1]=2 31 B4R0.2 CCCC#C L02479 [0,0,0,0,0,0|1,0,2]=3 32 B4R0.2 CCCC#N L02999 [0,0,0,0,0,0|2,0,1]=3 33 B4R0.2 CCCC=C A16723 [0,0,0,0,0,0|1,0,2]=3 34 B4R0.2 CCCC=O A18243 [0,0,0,0,0,0|2,0,1]=3 35 B4R0.2 CCCCBr A10696 [0,0,0,0,0,0|2,0,0]=2 36 B4R0.2 CCCCC 17381 [0,0,0,0,0,0|1,0,0]=1 37 B4R0.2 CCCCC 22907 [0,0,0,0,0,0|1,0,0]=1 38 B4R0.2 CCCCC 32449 [0,0,0,0,0,0|1,0,0]=1 39 B4R0.2 CCCCC 40981 [0,0,0,0,0,0|1,0,0]=1 40 B4R0.2 CCCCC 44255 [0,0,0,0,0,0|1,0,0]=1 41 B4R0.2 CCCCC 47115 [0,0,0,0,0,0|1,0,0]=1 42 B4R0.2 CCCCC H27427 [0,0,0,0,0,0|1,0,0]=1 43 B4R0.2 CCCCCl 39198 [0,0,0,0,0,0|2,0,0]=2 44 B4R0.2 CCCCCl A11494 [0,0,0,0,0,0|2,0,0]=2 45 B4R0.2 CCCCI A12340 [0,0,0,0,0,0|2,0,0]=2 46 B4R0.2 CCCCN L03575 [0,0,0,0,0,0|2,0,0]=2 47 B4R0.2 CCCCO 22925 [0,0,0,0,0,0|2,0,0]=2 48 B4R0.2 CCCCO 31068 [0,0,0,0,0,0|2,0,0]=2 49 B4R0.2 CCCCO 32443 [0,0,0,0,0,0|2,0,0]=2 50 B4R0.2 CCCCO 41867 [0,0,0,0,0,0|2,0,0]=2 51 B4R0.2 CCCCO L13171 [0,0,0,0,0,0|2,0,0]=2 52 B4R0.2 CCCCS 43421 [0,0,0,0,0,0|2,0,0]=2 53 B4R0.2 CCCC[Mg+] 41676 [0,0,0,0,0,0|2,0,0]=2 54 B4R0.2 CCCC[Mg+] 46117 [0,0,0,0,0,0|2,0,0]=2 55 B4R0.2 CCCC[O-] 33496 [0,0,0,0,0,0|2,0,0]=2 56 B4R0.2 CCCC[O-] 36570 [0,0,0,0,0,0|2,0,0]=2 57 B4R0.2 CCCC[O-] 40816 [0,0,0,0,0,0|2,0,0]=2 58 B4R0.2 CCCC[O-] 43295 [0,0,0,0,0,0|2,0,0]=2 59 B4R0.2 CCCC[O-] 44209 [0,0,0,0,0,0|2,0,0]=2 60 B4R0.2 CCCC[O-] 77124 [0,0,0,0,0,0|2,0,0]=2 61 B4R0.2 CCCC[O-] 87754 [0,0,0,0,0,0|2,0,0]=2 62 B4R0.2 CCCC[O-] B23317 [0,0,0,0,0,0|2,0,0]=2 63 B4R0.2 CCCC[Sn+3] 71125 [0,0,0,0,0,0|2,0,0]=2 64 B4R0.2 CCCC[Zn+] H58121 [0,0,0,0,0,0|2,0,0]=2 65 B4R0.2 CCCNC A16903 [0,0,0,0,0,0|2,0,0]=2 66 B4R0.2 CCCSC L09346 [0,0,0,0,0,0|2,0,0]=2 67 B4R0.2 CCN=C=O B25180 [0,0,0,0,0,0|2,0,1]=3 68 B4R0.2 CCN=C=S A19492 [0,0,0,0,0,0|2,0,1]=3 69 B4R0.2 CCNCC A10452 [0,0,0,0,0,0|1,0,0]=1 70 B4R0.2 CCNCC A11716 [0,0,0,0,0,0|1,0,0]=1 71 B4R0.2 CCNCC A13637 [0,0,0,0,0,0|1,0,0]=1 72 B4R0.2 CCOC#C A14245 [0,0,0,0,0,0|0,1,2]=3 73 B4R0.2 CCOC=C A15691 [0,0,0,0,0,0|0,1,2]=3 74 B4R0.2 CCOC=O A11113 [0,0,0,0,0,0|1,1,1]=3 75 B4R0.2 CCOCC 16767 [0,0,0,0,0,0|0,1,0]=1 76 B4R0.2 CCOCC 33224 [0,0,0,0,0,0|0,1,0]=1 77 B4R0.2 CCOCC 38990 [0,0,0,0,0,0|0,1,0]=1 78 B4R0.2 CCOCC 40976 [0,0,0,0,0,0|0,1,0]=1 79 B4R0.2 CCOCC 41796 [0,0,0,0,0,0|0,1,0]=1 80 B4R0.2 CCOCC A15275 [0,0,0,0,0,0|0,1,0]=1 81 B4R0.2 CCOCC H33678 [0,0,0,0,0,0|0,1,0]=1 82 B4R0.2 CCOCC L15481 [0,0,0,0,0,0|0,1,0]=1 83 B4R0.2 CCSCC 10482 [0,0,0,0,0,0|0,0,0]=0 84 B4R0.2 CCSCC 10484 [0,0,0,0,0,0|0,0,0]=0 85 B4R0.2 CCSCC L03493 [0,0,0,0,0,0|0,0,0]=0 86 B4R0.2 CC[Al+]CC 87625 [0,0,0,0,0,0|1,0,0]=1 87 B4R0.2 CC[Al+]CC 89035 [0,0,0,0,0,0|1,0,0]=1 88 B4R0.2 CC[N-]CC 40445 [0,0,0,0,0,0|1,0,0]=1 89 B4R0.2 CC[N-]CC 42759 [0,0,0,0,0,0|1,0,0]=1 90 B4R0.2 CC[N-]CC 42855 [0,0,0,0,0,0|1,0,0]=1 91 B4R0.2 CC[N-]CC 43419 [0,0,0,0,0,0|1,0,0]=1 92 B4R0.2 CC[SiH2]CC L16468 [0,0,0,0,0,0|1,0,0]=1 93 B4R0.2 CC[Sn+2]CC 71155 [0,0,0,0,0,0|1,0,0]=1 94 B4R0.2 CC[Zn]CC 39564 [0,0,0,0,0,0|1,0,0]=1 95 B4R0.2 CC[Zn]CC 44880 [0,0,0,0,0,0|1,0,0]=1 96 B4R0.2 CC[Zn]CC 89038 [0,0,0,0,0,0|1,0,0]=1 97 B4R0.2 CC\C=C\C A17736 [0,0,0,0,0,0|1,0,1]=2 98 B4R0.2 CC\C=C\C L09421 [0,0,0,0,0,0|1,0,1]=2 99 B4R0.2 CNCC#N H55215 [0,0,0,0,0,0|3,0,1]=4 100 B4R0.2 CNCC=C H27551 [0,0,0,0,0,0|2,0,2]=4 101 B4R0.2 CNCCN A12165 [0,0,0,0,0,0|3,0,0]=3 102 B4R0.2 CNCCO B23180 [0,0,0,0,0,0|3,0,0]=3 103 B4R0.2 COCC=C 18652 [0,0,0,0,0,0|2,0,2]=4 104 B4R0.2 COCCBr A15370 [0,0,0,0,0,0|3,0,0]=3 105 B4R0.2 COCCCl B24081 [0,0,0,0,0,0|3,0,0]=3 106 B4R0.2 COCCN B22924 [0,0,0,0,0,0|3,0,0]=3 107 B4R0.2 COCCO 31733 [0,0,0,0,0,0|3,0,0]=3 108 B4R0.2 COCCO 32444 [0,0,0,0,0,0|3,0,0]=3 109 B4R0.2 COCCO A17459 [0,0,0,0,0,0|3,0,0]=3 110 B4R0.2 COCC[O-] 40471 [0,0,0,0,0,0|3,0,0]=3 111 B4R0.2 COCC[O-] 41237 [0,0,0,0,0,0|3,0,0]=3 112 B4R0.2 COCC[O-] 41256 [0,0,0,0,0,0|3,0,0]=3 113 B4R0.2 COCC[O-] 41793 [0,0,0,0,0,0|3,0,0]=3 114 B4R0.2 COCC[O-] 42377 [0,0,0,0,0,0|3,0,0]=3 115 B4R0.2 COCC[O-] 42378 [0,0,0,0,0,0|3,0,0]=3 116 B4R0.2 COCC[O-] 42522 [0,0,0,0,0,0|3,0,0]=3 117 B4R0.2 COCC[O-] 42819 [0,0,0,0,0,0|3,0,0]=3 118 B4R0.2 COCC[O-] 43903 [0,0,0,0,0,0|3,0,0]=3 119 B4R0.2 COCC[O-] A13292 [0,0,0,0,0,0|3,0,0]=3 120 B4R0.2 COCOC A12055 [0,0,0,0,0,0|3,0,0]=3 121 B4R0.2 CSCC#N L03066 [0,0,0,0,0,0|3,0,1]=4 122 B4R0.2 CSCC=C B22514 [0,0,0,0,0,0|2,0,2]=4 123 B4R0.2 CSCCN B22941 [0,0,0,0,0,0|3,0,0]=3 124 B4R0.2 CSCCO L05442 [0,0,0,0,0,0|3,0,0]=3 125 B4R0.2 CSCSC A19706 [0,0,0,0,0,0|3,0,0]=3 126 B4R0.2 CSSSC H32913 [0,0,0,0,0,0|2,0,0]=2 127 B4R0.2 C\C=C\C=O L03362 [0,0,0,0,0,0|2,0,2]=4 128 B4R0.2 C\C=C\CO A10681 [0,0,0,0,0,0|2,0,1]=3 129 B4R0.2 C\C=C\C[Mg+] H51171 [0,0,0,0,0,0|2,0,1]=3 130 B4R0.2 [Li]CCCC 41248 [0,0,0,0,0,0|2,0,0]=2 131 B4R0.2 [Li]CCCC 43314 [0,0,0,0,0,0|2,0,0]=2 132 B4R0.2 [Li]CCCC 44109 [0,0,0,0,0,0|2,0,0]=2 133 B4R0.2 [Li]CCCC 47107 [0,0,0,0,0,0|2,0,0]=2 134 B4R0.2 [Li]CCCC H66688 [0,0,0,0,0,0|2,0,0]=2 135 B4R0.2 [Li]CCCC L13559 [0,0,0,0,0,0|2,0,0]=2 136 B4R0.2 [Li]CCCC L14775 [0,0,0,0,0,0|2,0,0]=2 137 B3R0.1 C#CCBr A16580 [1,0,0,0,0,0|1,0,2]=4 138 B3R0.1 C#CCBr L10595 [1,0,0,0,0,0|1,0,2]=4 139 B3R0.1 C#CCCl L20416 [1,0,0,0,0,0|1,0,2]=4 140 B3R0.1 C#CCN 43775 [1,0,0,0,0,0|1,0,2]=4 141 B3R0.1 C#CCN H53495 [1,0,0,0,0,0|1,0,2]=4 142 B3R0.1 C#CCO A10295 [1,0,0,0,0,0|1,0,2]=4 143 B3R0.1 C(C#N)Br A13933 [1,0,0,0,0,0|2,0,1]=4 144 B3R0.1 C(C#N)Cl A12825 [1,0,0,0,0,0|2,0,1]=4 145 B3R0.1 C(C#N)I L03634 [1,0,0,0,0,0|2,0,1]=4 146 B3R0.1 C(C#N)N 41984 [1,0,0,0,0,0|2,0,1]=4 147 B3R0.1 C(C=O)Cl A11037 [1,0,0,0,0,0|2,0,1]=4 148 B3R0.1 C(C=O)Cl L12701 [1,0,0,0,0,0|2,0,1]=4 149 B3R0.1 C(CBr)Br A12766 [1,0,0,0,0,0|2,0,0]=3 150 B3R0.1 C(CBr)Cl A12349 [1,0,0,0,0,0|2,0,0]=3 151 B3R0.1 C(CBr)N A17625 [1,0,0,0,0,0|2,0,0]=3 152 B3R0.1 C(CBr)O A10275 [1,0,0,0,0,0|2,0,0]=3 153 B3R0.1 C(CCl)Cl 22918 [1,0,0,0,0,0|2,0,0]=3 154 B3R0.1 C(CCl)Cl 32462 [1,0,0,0,0,0|2,0,0]=3 155 B3R0.1 C(CCl)Cl 39121 [1,0,0,0,0,0|2,0,0]=3 156 B3R0.1 C(CCl)Cl A12775 [1,0,0,0,0,0|2,0,0]=3 157 B3R0.1 C(CCl)Cl H37962 [1,0,0,0,0,0|2,0,0]=3 158 B3R0.1 C(CCl)N A14455 [1,0,0,0,0,0|2,0,0]=3 159 B3R0.1 C(CCl)O 36636 [1,0,0,0,0,0|2,0,0]=3 160 B3R0.1 C(CF)O L01735 [1,0,0,0,0,0|2,0,0]=3 161 B3R0.1 C(CI)Cl L10742 [1,0,0,0,0,0|2,0,0]=3 162 B3R0.1 C(CI)I L03019 [1,0,0,0,0,0|2,0,0]=3 163 B3R0.1 C(CI)O A14658 [1,0,0,0,0,0|2,0,0]=3 164 B3R0.1 C(CN)N 10496 [1,0,0,0,0,0|2,0,0]=3 165 B3R0.1 C(CN)N 10497 [1,0,0,0,0,0|2,0,0]=3 166 B3R0.1 C(CN)N 10553 [1,0,0,0,0,0|2,0,0]=3 167 B3R0.1 C(CN)N 24127 [1,0,0,0,0,0|2,0,0]=3 168 B3R0.1 C(CN)N 39280 [1,0,0,0,0,0|2,0,0]=3 169 B3R0.1 C(CN)N 39667 [1,0,0,0,0,0|2,0,0]=3 170 B3R0.1 C(CN)N A12132 [1,0,0,0,0,0|2,0,0]=3 171 B3R0.1 C(CN)N A13563 [1,0,0,0,0,0|2,0,0]=3 172 B3R0.1 C(CN)N A17211 [1,0,0,0,0,0|2,0,0]=3 173 B3R0.1 C(CN)N L12401 [1,0,0,0,0,0|2,0,0]=3 174 B3R0.1 C(CO)N 22793 [1,0,0,0,0,0|2,0,0]=3 175 B3R0.1 C(CO)N 36260 [1,0,0,0,0,0|2,0,0]=3 176 B3R0.1 C(CO)N A11697 [1,0,0,0,0,0|2,0,0]=3 177 B3R0.1 C(CO)N L14322 [1,0,0,0,0,0|2,0,0]=3 178 B3R0.1 C(CO)O 44529 [1,0,0,0,0,0|2,0,0]=3 179 B3R0.1 C(CO)O A11591 [1,0,0,0,0,0|2,0,0]=3 180 B3R0.1 C(CP)P 39279 [1,0,0,0,0,0|2,0,0]=3 181 B3R0.1 C(CS)N A14377 [1,0,0,0,0,0|2,0,0]=3 182 B3R0.1 C(CS)O A15890 [1,0,0,0,0,0|2,0,0]=3 183 B3R0.1 C(CS)S L12865 [1,0,0,0,0,0|2,0,0]=3 184 B3R0.1 C=CCBr A11766 [1,0,0,0,0,0|1,0,2]=4 185 B3R0.1 C=CCCl A14330 [1,0,0,0,0,0|1,0,2]=4 186 B3R0.1 C=CCI A11822 [1,0,0,0,0,0|1,0,2]=4 187 B3R0.1 C=CCN L07162 [1,0,0,0,0,0|1,0,2]=4 188 B3R0.1 C=CCO A15026 [1,0,0,0,0,0|1,0,2]=4 189 B3R0.1 C=CCS A13616 [1,0,0,0,0,0|1,0,2]=4 190 B3R0.1 C=CC[Mg+] H51170 [1,0,0,0,0,0|1,0,2]=4 191 B3R0.1 C=CC[Zn+] H58012 [1,0,0,0,0,0|1,0,2]=4 192 B3R0.1 CC#CC A13823 [1,0,0,0,0,0|0,0,2]=3 193 B3R0.1 CCC#N A13203 [1,0,0,0,0,0|1,0,1]=3 194 B3R0.1 CCC=O A16146 [1,0,0,0,0,0|1,0,1]=3 195 B3R0.1 CCCBr A10461 [1,0,0,0,0,0|1,0,0]=2 196 B3R0.1 CCCI A14388 [1,0,0,0,0,0|1,0,0]=2 197 B3R0.1 CCCN 36635 [1,0,0,0,0,0|1,0,0]=2 198 B3R0.1 CCCN A11606 [1,0,0,0,0,0|1,0,0]=2 199 B3R0.1 CCCO 22932 [1,0,0,0,0,0|1,0,0]=2 200 B3R0.1 CCCO 22933 [1,0,0,0,0,0|1,0,0]=2 201 B3R0.1 CCCO 41465 [1,0,0,0,0,0|1,0,0]=2 202 B3R0.1 CCCO 41842 [1,0,0,0,0,0|1,0,0]=2 203 B3R0.1 CCCO 43848 [1,0,0,0,0,0|1,0,0]=2 204 B3R0.1 CCCO A19902 [1,0,0,0,0,0|1,0,0]=2 205 B3R0.1 CCCS 43420 [1,0,0,0,0,0|1,0,0]=2 206 B3R0.1 CCC[Mg+] H51162 [1,0,0,0,0,0|1,0,0]=2 207 B3R0.1 CCC[O-] 22989 [1,0,0,0,0,0|1,0,0]=2 208 B3R0.1 CCC[O-] 36571 [1,0,0,0,0,0|1,0,0]=2 209 B3R0.1 CCC[O-] 44673 [1,0,0,0,0,0|1,0,0]=2 210 B3R0.1 CCC[O-] 44770 [1,0,0,0,0,0|1,0,0]=2 211 B3R0.1 CCC[S-] H66135 [1,0,0,0,0,0|1,0,0]=2 212 B3R0.1 CCC[Zn+] H58119 [1,0,0,0,0,0|1,0,0]=2 213 B3R0.1 CCNC L04372 [1,0,0,0,0,0|1,0,0]=2 214 B3R0.1 CCSC L02859 [1,0,0,0,0,0|0,0,0]=1 215 B3R0.1 CN=C=O L19476 [1,0,0,0,0,0|2,0,1]=4 216 B3R0.1 CN=C=S A11757 [1,0,0,0,0,0|2,0,1]=4 217 B3R0.1 CN=C=S L19464 [1,0,0,0,0,0|2,0,1]=4 218 B3R0.1 CNC=O L03908 [1,0,0,0,0,0|2,0,1]=4 219 B3R0.1 CNOC A17469 [1,0,0,0,0,0|1,1,0]=3 220 B3R0.1 COC=O A15850 [1,0,0,0,0,0|1,1,1]=4 221 B3R0.1 COCBr L09837 [1,0,0,0,0,0|1,1,0]=3 222 B3R0.1 CSC#N H27879 [1,0,0,0,0,0|1,0,1]=3 223 B3R0.1 CSCCl L10858 [1,0,0,0,0,0|1,0,0]=2 224 B3R0.1 CSSC L09679 [1,0,0,0,0,0|1,0,0]=2 225 B3R0.1 C[Se][Se]C 68119 [1,0,0,0,0,0|1,1,0]=3 226 B3R0.1 C\C=N\O A10640 [1,0,0,0,0,0|2,0,1]=4 227 B5R0.1 B(CCC)(O)O L19965 [0,1,0,0,0,0|3,0,0]=4 228 B5R0.1 CC#CC(C)C H53442 [0,1,0,0,0,0|1,0,1]=3 229 B5R0.1 CC(=C)CCO B23398 [0,1,0,0,0,0|2,0,1]=4 230 B5R0.1 CC(=CCBr)C A13388 [0,1,0,0,0,0|2,0,1]=4 231 B5R0.1 CC(=CCCl)C A16545 [0,1,0,0,0,0|2,0,1]=4 232 B5R0.1 CC(=CCO)C A16089 [0,1,0,0,0,0|2,0,1]=4 233 B5R0.1 CC(=CCO)C H36436 [0,1,0,0,0,0|2,0,1]=4 234 B5R0.1 CC(=O)CCO L11456 [0,1,0,0,0,0|2,0,1]=4 235 B5R0.1 CC(=O)CSC B24149 [0,1,0,0,0,0|2,0,1]=4 236 B5R0.1 CC(=O)NCO A13820 [0,1,0,0,0,0|2,0,1]=4 237 B5R0.1 CC(=O)OCBr H56755 [0,1,0,0,0,0|1,1,1]=4 238 B5R0.1 CC(C)CC#C L05537 [0,1,0,0,0,0|1,0,2]=4 239 B5R0.1 CC(C)CC=C 33029 [0,1,0,0,0,0|1,0,2]=4 240 B5R0.1 CC(C)CC=C L03372 [0,1,0,0,0,0|1,0,2]=4 241 B5R0.1 CC(C)CC=O A19640 [0,1,0,0,0,0|2,0,1]=4 242 B5R0.1 CC(C)CCBr A14492 [0,1,0,0,0,0|2,0,0]=3 243 B5R0.1 CC(C)CCCl L11371 [0,1,0,0,0,0|2,0,0]=3 244 B5R0.1 CC(C)CCI L05194 [0,1,0,0,0,0|2,0,0]=3 245 B5R0.1 CC(C)CCN L02260 [0,1,0,0,0,0|2,0,0]=3 246 B5R0.1 CC(C)CCO 36716 [0,1,0,0,0,0|2,0,0]=3 247 B5R0.1 CC(C)CCO L13660 [0,1,0,0,0,0|2,0,0]=3 248 B5R0.1 CC(C)CCS L09661 [0,1,0,0,0,0|2,0,0]=3 249 B5R0.1 CC(C)CC[Zn+] H58436 [0,1,0,0,0,0|2,0,0]=3 250 B5R0.1 CC(C)CNC 42947 [0,1,0,0,0,0|2,0,0]=3 251 B5R0.1 CC(C)CNN H64287 [0,1,0,0,0,0|3,0,0]=4 252 B5R0.1 CC(C)N=C=O L16105 [0,1,0,0,0,0|2,0,1]=4 253 B5R0.1 CC(C)N=C=S A11641 [0,1,0,0,0,0|2,0,1]=4 254 B5R0.1 CC(C)OC=O A17222 [0,1,0,0,0,0|1,1,1]=4 255 B5R0.1 CC(CC#C)O L02752 [0,1,0,0,0,0|1,0,2]=4 256 B5R0.1 CC(CC=C)O B20208 [0,1,0,0,0,0|1,0,2]=4 257 B5R0.1 CC(CCBr)Br B24123 [0,1,0,0,0,0|2,0,0]=3 258 B5R0.1 CC(CCO)O A11684 [0,1,0,0,0,0|2,0,0]=3 259 B5R0.1 CC(COC)O 41547 [0,1,0,0,0,0|2,0,0]=3 260 B5R0.1 CC(COC)O L12694 [0,1,0,0,0,0|2,0,0]=3 261 B5R0.1 CC(COC)[O-] 41257 [0,1,0,0,0,0|2,0,0]=3 262 B5R0.1 CCCC(=C)C H53373 [0,1,0,0,0,0|1,0,1]=3 263 B5R0.1 CCCC(=O)C L13262 [0,1,0,0,0,0|1,0,1]=3 264 B5R0.1 CCCC(=O)Cl A17575 [0,1,0,0,0,0|2,0,1]=4 265 B5R0.1 CCCC(=O)N A12494 [0,1,0,0,0,0|2,0,1]=4 266 B5R0.1 CCCC(=O)O L13189 [0,1,0,0,0,0|2,0,1]=4 267 B5R0.1 CCCC(=O)[O-] A11079 [0,1,0,0,0,0|2,0,1]=4 268 B5R0.1 CCCC(C)Br A17205 [0,1,0,0,0,0|1,0,0]=2 269 B5R0.1 CCCC(C)C L03001 [0,1,0,0,0,0|1,0,0]=2 270 B5R0.1 CCCC(C)O B21217 [0,1,0,0,0,0|1,0,0]=2 271 B5R0.1 CCCC(C)[Zn+] H58078 [0,1,0,0,0,0|1,0,0]=2 272 B5R0.1 CCCP(Cl)Cl 18329 [0,1,0,0,0,0|3,0,0]=4 273 B5R0.1 CCC[C@H](C)O L09314 [0,1,0,0,0,0|1,0,0]=2 274 B5R0.1 CCC[N+](=O)[O-] A11975 [0,1,0,0,0,0|3,0,0]=4 275 B5R0.1 CCNC(=N)N B21315 [0,1,0,0,0,0|2,0,1]=4 276 B5R0.1 CCNC(=O)C L10300 [0,1,0,0,0,0|1,0,1]=3 277 B5R0.1 CCNC(=O)N B24040 [0,1,0,0,0,0|2,0,1]=4 278 B5R0.1 CCNC(=S)N B24761 [0,1,0,0,0,0|2,0,1]=4 279 B5R0.1 CCNC(C)C L04089 [0,1,0,0,0,0|1,0,0]=2 280 B5R0.1 CCOC(=N)C A18618 [0,1,0,0,0,0|0,1,1]=3 281 B5R0.1 CCOC(=O)C 22912 [0,1,0,0,0,0|0,1,1]=3 282 B5R0.1 CCOC(=O)C 31344 [0,1,0,0,0,0|0,1,1]=3 283 B5R0.1 CCOC(=O)C 39177 [0,1,0,0,0,0|0,1,1]=3 284 B5R0.1 CCOC(=O)C 40977 [0,1,0,0,0,0|0,1,1]=3 285 B5R0.1 CCOC(=O)C L10925 [0,1,0,0,0,0|0,1,1]=3 286 B5R0.1 CCOC(=O)Cl L06311 [0,1,0,0,0,0|1,1,1]=4 287 B5R0.1 CCOC(=O)N 44804 [0,1,0,0,0,0|1,1,1]=4 288 B5R0.1 CCOC(=S)[S-] A11450 [0,1,0,0,0,0|1,1,1]=4 289 B5R0.1 CCOP(Cl)Cl B21179 [0,1,0,0,0,0|2,1,0]=4 290 B5R0.1 CCO[SiH](C)C L16475 [0,1,0,0,0,0|0,2,0]=3 291 B5R0.1 CCO[SiH](C)C L16476 [0,1,0,0,0,0|0,2,0]=3 292 B5R0.1 CCSC(=O)C A10680 [0,1,0,0,0,0|0,0,1]=2 293 B5R0.1 CN(C)CCCl A15134 [0,1,0,0,0,0|3,0,0]=4 294 B5R0.1 CN(C)CCN B20182 [0,1,0,0,0,0|3,0,0]=4 295 B5R0.1 CN(C)CCO B23616 [0,1,0,0,0,0|3,0,0]=4 296 B5R0.1 CSCS(=O)C L00510 [0,1,0,0,0,0|3,0,0]=4 297 B5R0.1 C[C@@H](CC=C)O B25728 [0,1,0,0,0,0|1,0,2]=4 298 B5R0.1 C[C@@H](COC)N L16325 [0,1,0,0,0,0|2,0,0]=3 299 B5R0.1 C[C@H](CC=C)O B25659 [0,1,0,0,0,0|1,0,2]=4 300 B5R0.1 C[C@H](CCO)O B25124 [0,1,0,0,0,0|2,0,0]=3 301 B5R0.1 C\C(=C\CCl)\Cl L20334 [0,1,0,0,0,0|2,0,1]=4 302 B5R0.1 C\C=C\C(=O)C L13031 [0,1,0,0,0,0|1,0,2]=4 303 B5R0.2 C#CCCCCl L02835 [0,1,0,0,0,0|1,0,2]=4 304 B5R0.2 C#CCCCO A10405 [0,1,0,0,0,0|1,0,2]=4 305 B5R0.2 C(C#CCCl)O L20159 [0,1,0,0,0,0|2,0,1]=4 306 B5R0.2 C(C#CCO)O A14539 [0,1,0,0,0,0|2,0,1]=4 307 B5R0.2 C(CBr)N=C=S L19246 [0,1,0,0,0,0|2,0,1]=4 308 B5R0.2 C(CC#N)CBr A10674 [0,1,0,0,0,0|2,0,1]=4 309 B5R0.2 C(CC#N)CCl A18942 [0,1,0,0,0,0|2,0,1]=4 310 B5R0.2 C(CC#N)C[Zn+] H58962 [0,1,0,0,0,0|2,0,1]=4 311 B5R0.2 C(CCBr)CBr A11669 [0,1,0,0,0,0|2,0,0]=3 312 B5R0.2 C(CCBr)CCl A11399 [0,1,0,0,0,0|2,0,0]=3 313 B5R0.2 C(CCBr)CF H64317 [0,1,0,0,0,0|2,0,0]=3 314 B5R0.2 C(CCBr)CO 16805 [0,1,0,0,0,0|2,0,0]=3 315 B5R0.2 C(CCCl)CCl B21337 [0,1,0,0,0,0|2,0,0]=3 316 B5R0.2 C(CCCl)CO L04042 [0,1,0,0,0,0|2,0,0]=3 317 B5R0.2 C(CCI)CCl L03302 [0,1,0,0,0,0|2,0,0]=3 318 B5R0.2 C(CCI)CI A16216 [0,1,0,0,0,0|2,0,0]=3 319 B5R0.2 C(CCN)CN A18312 [0,1,0,0,0,0|2,0,0]=3 320 B5R0.2 C(CCN)CN B21316 [0,1,0,0,0,0|2,0,0]=3 321 B5R0.2 C(CCO)CN A12680 [0,1,0,0,0,0|2,0,0]=3 322 B5R0.2 C(CCO)CO L03491 [0,1,0,0,0,0|2,0,0]=3 323 B5R0.2 C(CC[Zn+])CCl H58266 [0,1,0,0,0,0|2,0,0]=3 324 B5R0.2 C(CCl)N=C=O A17289 [0,1,0,0,0,0|2,0,1]=4 325 B5R0.2 C(CCl)N=C=S L11604 [0,1,0,0,0,0|2,0,1]=4 326 B5R0.2 C(CO)NC=O H52345 [0,1,0,0,0,0|2,0,1]=4 327 B5R0.2 C([Zn+2])[Zn]C[Zn-]Br H56963 [0,1,0,0,0,0|3,0,0]=4 328 B5R0.2 C(\C=C/CCl)Cl A18956 [0,1,0,0,0,0|2,0,1]=4 329 B5R0.2 C(\C=C/CO)O A19182 [0,1,0,0,0,0|2,0,1]=4 330 B5R0.2 C=CCCCBr A11219 [0,1,0,0,0,0|1,0,2]=4 331 B5R0.2 C=CCCCO A11178 [0,1,0,0,0,0|1,0,2]=4 332 B5R0.2 C=CCCC[Zn+] H58177 [0,1,0,0,0,0|1,0,2]=4 333 B5R0.2 CC#CC#CC L06377 [0,1,0,0,0,0|1,0,2]=4 334 B5R0.2 CC#CCCO L02951 [0,1,0,0,0,0|1,0,1]=3 335 B5R0.2 CCC#CCBr H53433 [0,1,0,0,0,0|1,0,1]=3 336 B5R0.2 CCC#CCC L02682 [0,1,0,0,0,0|1,0,0]=2 337 B5R0.2 CCC#CCO A12999 [0,1,0,0,0,0|1,0,1]=3 338 B5R0.2 CCCC#CC B22405 [0,1,0,0,0,0|1,0,1]=3 339 B5R0.2 CCCCC#C A13156 [0,1,0,0,0,0|1,0,1]=3 340 B5R0.2 CCCCC#N A10306 [0,1,0,0,0,0|1,0,1]=3 341 B5R0.2 CCCCC=C B20271 [0,1,0,0,0,0|1,0,1]=3 342 B5R0.2 CCCCC=O B21389 [0,1,0,0,0,0|1,0,1]=3 343 B5R0.2 CCCCCBr A10821 [0,1,0,0,0,0|1,0,0]=2 344 B5R0.2 CCCCCC 19353 [0,1,0,0,0,0|1,0,0]=2 345 B5R0.2 CCCCCC 32454 [0,1,0,0,0,0|1,0,0]=2 346 B5R0.2 CCCCCC 39199 [0,1,0,0,0,0|1,0,0]=2 347 B5R0.2 CCCCCC 41727 [0,1,0,0,0,0|1,0,0]=2 348 B5R0.2 CCCCCC 42100 [0,1,0,0,0,0|1,0,0]=2 349 B5R0.2 CCCCCC 43263 [0,1,0,0,0,0|1,0,0]=2 350 B5R0.2 CCCCCC 47104 [0,1,0,0,0,0|1,0,0]=2 351 B5R0.2 CCCCCC L09938 [0,1,0,0,0,0|1,0,0]=2 352 B5R0.2 CCCCCC L13233 [0,1,0,0,0,0|1,0,0]=2 353 B5R0.2 CCCCCCl B24733 [0,1,0,0,0,0|1,0,0]=2 354 B5R0.2 CCCCCI B20781 [0,1,0,0,0,0|1,0,0]=2 355 B5R0.2 CCCCCN A11674 [0,1,0,0,0,0|1,0,0]=2 356 B5R0.2 CCCCCO 30898 [0,1,0,0,0,0|1,0,0]=2 357 B5R0.2 CCCCCO A13093 [0,1,0,0,0,0|1,0,0]=2 358 B5R0.2 CCCCCO H33391 [0,1,0,0,0,0|1,0,0]=2 359 B5R0.2 CCCCCS L04330 [0,1,0,0,0,0|1,0,0]=2 360 B5R0.2 CCCCC[Mg+] 41278 [0,1,0,0,0,0|1,0,0]=2 361 B5R0.2 CCCCC[Mg+] H51175 [0,1,0,0,0,0|1,0,0]=2 362 B5R0.2 CCCCC[O-] 36569 [0,1,0,0,0,0|1,0,0]=2 363 B5R0.2 CCCCC[Zn+] H58633 [0,1,0,0,0,0|1,0,0]=2 364 B5R0.2 CCCCNC B23032 [0,1,0,0,0,0|1,0,0]=2 365 B5R0.2 CCCCSC L12039 [0,1,0,0,0,0|1,0,0]=2 366 B5R0.2 CCCN=C=S A14499 [0,1,0,0,0,0|2,0,1]=4 367 B5R0.2 CCCNCC 14846 [0,1,0,0,0,0|1,0,0]=2 368 B5R0.2 CCCOC=O A18090 [0,1,0,0,0,0|1,1,1]=4 369 B5R0.2 CCC\C=C/C H53506 [0,1,0,0,0,0|1,0,1]=3 370 B5R0.2 CCC\C=C\C B22289 [0,1,0,0,0,0|1,0,1]=3 371 B5R0.2 CCC\C=C\C H53472 [0,1,0,0,0,0|1,0,1]=3 372 B5R0.2 CCC\C=N\O A11420 [0,1,0,0,0,0|2,0,1]=4 373 B5R0.2 CCNCCN B23577 [0,1,0,0,0,0|1,0,0]=2 374 B5R0.2 CCNCCO A15744 [0,1,0,0,0,0|1,0,0]=2 375 B5R0.2 CCNNCC B22317 [0,1,0,0,0,0|1,0,0]=2 376 B5R0.2 CCOCC=C B22276 [0,1,0,0,0,0|0,1,1]=3 377 B5R0.2 CCOCCBr L04034 [0,1,0,0,0,0|0,1,0]=2 378 B5R0.2 CCOCCCl B24308 [0,1,0,0,0,0|0,1,0]=2 379 B5R0.2 CCOCCO A16100 [0,1,0,0,0,0|0,1,0]=2 380 B5R0.2 CCO\C=C\C H26319 [0,1,0,0,0,0|0,1,1]=3 381 B5R0.2 CCSCC=C L12847 [0,1,0,0,0,0|0,0,1]=2 382 B5R0.2 CCSCCN B22147 [0,1,0,0,0,0|0,0,0]=1 383 B5R0.2 CCSCCO L05040 [0,1,0,0,0,0|0,0,0]=1 384 B5R0.2 CCSSCC L10065 [0,1,0,0,0,0|0,0,0]=1 385 B5R0.2 CC\C=C/CC H53485 [0,1,0,0,0,0|1,0,0]=2 386 B5R0.2 CC\C=C/CO A14262 [0,1,0,0,0,0|1,0,1]=3 387 B5R0.2 CC\C=C\C=O L06108 [0,1,0,0,0,0|1,0,2]=4 388 B5R0.2 CC\C=C\CC L10311 [0,1,0,0,0,0|1,0,0]=2 389 B5R0.2 CNCCCN B23319 [0,1,0,0,0,0|2,0,0]=3 390 B5R0.2 CNCCCO H58818 [0,1,0,0,0,0|2,0,0]=3 391 B5R0.2 CNCCNC L02204 [0,1,0,0,0,0|2,0,0]=3 392 B5R0.2 COCCC#N L07055 [0,1,0,0,0,0|2,0,1]=4 393 B5R0.2 COCCCN B24095 [0,1,0,0,0,0|2,0,0]=3 394 B5R0.2 COCCOC 45659 [0,1,0,0,0,0|2,0,0]=3 395 B5R0.2 COCCOC A12986 [0,1,0,0,0,0|2,0,0]=3 396 B5R0.2 CSCCC=O A14774 [0,1,0,0,0,0|2,0,1]=4 397 B5R0.2 CSCCCN H25846 [0,1,0,0,0,0|2,0,0]=3 398 B5R0.2 CSCCCO A10403 [0,1,0,0,0,0|2,0,0]=3 399 B5R0.2 C\C=C\C=C\C H53404 [0,1,0,0,0,0|1,0,2]=4 400 B5R0.2 C\C=C\CC=C B20060 [0,1,0,0,0,0|1,0,2]=4 401 B5R0.3 C(C(=O)CBr)Br H37325 [0,1,0,0,0,0|3,0,0]=4 402 B5R0.3 C(C(=O)CCl)Cl 22302 [0,1,0,0,0,0|3,0,0]=4 403 B5R0.3 C(C(=O)CCl)Cl A14149 [0,1,0,0,0,0|3,0,0]=4 404 B5R0.3 C(C(=O)CF)F H51145 [0,1,0,0,0,0|3,0,0]=4 405 B5R0.3 C(C(CBr)Br)Br L03752 [0,1,0,0,0,0|3,0,0]=4 406 B5R0.3 C(C(CCl)Cl)Cl L04312 [0,1,0,0,0,0|3,0,0]=4 407 B5R0.3 C(C(CCl)Cl)O A18444 [0,1,0,0,0,0|3,0,0]=4 408 B5R0.3 C(C(CCl)O)Cl A16003 [0,1,0,0,0,0|3,0,0]=4 409 B5R0.3 C(C(CCl)O)F L17286 [0,1,0,0,0,0|3,0,0]=4 410 B5R0.3 C(C(CCl)O)O A16143 [0,1,0,0,0,0|3,0,0]=4 411 B5R0.3 C(C(CF)O)F L01646 [0,1,0,0,0,0|3,0,0]=4 412 B5R0.3 C(C(CN)O)N A19618 [0,1,0,0,0,0|3,0,0]=4 413 B5R0.3 C(C(CO)N)O B25419 [0,1,0,0,0,0|3,0,0]=4 414 B5R0.3 C(C(CO)N)O L08426 [0,1,0,0,0,0|3,0,0]=4 415 B5R0.3 C(C(CO)O)N B22672 [0,1,0,0,0,0|3,0,0]=4 416 B5R0.3 C(C(CO)O)O 32450 [0,1,0,0,0,0|3,0,0]=4 417 B5R0.3 C(C(CO)O)O 36646 [0,1,0,0,0,0|3,0,0]=4 418 B5R0.3 C(C(CO)O)O 38988 [0,1,0,0,0,0|3,0,0]=4 419 B5R0.3 C(C(CO)O)O A16205 [0,1,0,0,0,0|3,0,0]=4 420 B5R0.3 C(C(CO)O)O J61059 [0,1,0,0,0,0|3,0,0]=4 421 B5R0.3 C(C(CO)O)O J62399 [0,1,0,0,0,0|3,0,0]=4 422 B5R0.3 C(C(CO)O)O J64719 [0,1,0,0,0,0|3,0,0]=4 423 B5R0.3 C(C(CS)O)O A18948 [0,1,0,0,0,0|3,0,0]=4 424 B5R0.3 C(C(CS)S)O L03953 [0,1,0,0,0,0|3,0,0]=4 425 B5R0.3 C([C@@H](CCl)O)O L18556 [0,1,0,0,0,0|3,0,0]=4 426 B5R0.3 C([C@@H](CO)O)N H26743 [0,1,0,0,0,0|3,0,0]=4 427 B5R0.3 C([C@H](CCl)O)O L18555 [0,1,0,0,0,0|3,0,0]=4 428 B5R0.3 CC(OC)OC A10939 [0,1,0,0,0,0|3,0,0]=4 429 B5R0.3 CCC(=C)C=O B21839 [0,1,0,0,0,0|2,0,1]=4 430 B5R0.3 CCC(=C)CC L11553 [0,1,0,0,0,0|1,0,0]=2 431 B5R0.3 CCC(=O)C=C L06829 [0,1,0,0,0,0|1,0,2]=4 432 B5R0.3 CCC(=O)CBr L12081 [0,1,0,0,0,0|2,0,0]=3 433 B5R0.3 CCC(=O)CC A15297 [0,1,0,0,0,0|1,0,0]=2 434 B5R0.3 CCC(=O)OC A14944 [0,1,0,0,0,0|2,0,0]=3 435 B5R0.3 CCC(C#C)O B24853 [0,1,0,0,0,0|1,0,2]=4 436 B5R0.3 CCC(C)C=C L11525 [0,1,0,0,0,0|1,0,2]=4 437 B5R0.3 CCC(C)C=O A19650 [0,1,0,0,0,0|2,0,1]=4 438 B5R0.3 CCC(C)CBr H27078 [0,1,0,0,0,0|2,0,0]=3 439 B5R0.3 CCC(C)CC L03133 [0,1,0,0,0,0|1,0,0]=2 440 B5R0.3 CCC(C)CO B21825 [0,1,0,0,0,0|2,0,0]=3 441 B5R0.3 CCC(C)CS B21949 [0,1,0,0,0,0|2,0,0]=3 442 B5R0.3 CCC(C)NC H27547 [0,1,0,0,0,0|2,0,0]=3 443 B5R0.3 CCC(C)OC H53427 [0,1,0,0,0,0|2,0,0]=3 444 B5R0.3 CCC(C)SC B21942 [0,1,0,0,0,0|2,0,0]=3 445 B5R0.3 CCC(C=C)O B20155 [0,1,0,0,0,0|1,0,2]=4 446 B5R0.3 CCC(CBr)Br B20356 [0,1,0,0,0,0|2,0,0]=3 447 B5R0.3 CCC(CC)Br L13576 [0,1,0,0,0,0|1,0,0]=2 448 B5R0.3 CCC(CC)N L02250 [0,1,0,0,0,0|1,0,0]=2 449 B5R0.3 CCC(CC)O L06065 [0,1,0,0,0,0|1,0,0]=2 450 B5R0.3 CCC(CC)[Zn+] H58214 [0,1,0,0,0,0|1,0,0]=2 451 B5R0.3 CCC(CCl)Cl B21307 [0,1,0,0,0,0|2,0,0]=3 452 B5R0.3 CCC(CO)N B24398 [0,1,0,0,0,0|2,0,0]=3 453 B5R0.3 CCN(CC)O B23302 [0,1,0,0,0,0|1,0,0]=2 454 B5R0.3 CCP(=O)CC H27768 [0,1,0,0,0,0|1,0,0]=2 455 B5R0.3 CCP(CC)Cl 30204 [0,1,0,0,0,0|1,0,0]=2 456 B5R0.3 CC[C@@H](CO)N L11449 [0,1,0,0,0,0|2,0,0]=3 457 B5R0.3 CC[C@H](C)CN L14063 [0,1,0,0,0,0|2,0,0]=3 458 B5R0.3 CC[C@H](CO)N B25212 [0,1,0,0,0,0|2,0,0]=3 459 B5R0.3 CC\C(=N\O)\C L08196 [0,1,0,0,0,0|3,0,0]=4 460 B5R0.3 CC\C(=N\O)\N H50889 [0,1,0,0,0,0|3,0,0]=4 461 B5R0.3 CNC(=N)SC H27439 [0,1,0,0,0,0|3,0,0]=4 462 B5R0.3 CNC(=O)CCl H32362 [0,1,0,0,0,0|3,0,0]=4 463 B5R0.3 CNC(=O)CN H65367 [0,1,0,0,0,0|3,0,0]=4 464 B5R0.3 CNC(=O)NC B21329 [0,1,0,0,0,0|3,0,0]=4 465 B5R0.3 COC(=O)CBr A10605 [0,1,0,0,0,0|3,0,0]=4 466 B5R0.3 COC(=O)CCl A10325 [0,1,0,0,0,0|3,0,0]=4 467 B5R0.3 COC(=O)CN A14083 [0,1,0,0,0,0|3,0,0]=4 468 B5R0.3 COC(=O)CO A17870 [0,1,0,0,0,0|3,0,0]=4 469 B5R0.3 COC(=O)CS L03783 [0,1,0,0,0,0|3,0,0]=4 470 B5R0.3 COC(=O)OC A13104 [0,1,0,0,0,0|3,0,0]=4 471 B5R0.3 COP(O)OC L02670 [0,1,0,0,0,0|3,0,0]=4 472 B5R0.3 CO[SiH](C)OC L16197 [0,1,0,0,0,0|3,0,0]=4 473 B5R1.1 C1C=CCN1 H26072 [0,0,0,1,0,0|1,0,2]=4 474 B5R1.1 C1C=CCN1 L16349 [0,0,0,1,0,0|1,0,2]=4 475 B5R1.1 C1CC=CC1 41461 [0,0,0,1,0,0|1,0,1]=3 476 B5R1.1 C1CC=CC1 A11027 [0,0,0,1,0,0|1,0,1]=3 477 B5R1.1 C1CCCC1 44814 [0,0,0,1,0,0|1,0,0]=2 478 B5R1.1 C1CCCC1 A14697 [0,0,0,1,0,0|1,0,0]=2 479 B5R1.1 C1CCNC1 A14852 [0,0,0,1,0,0|1,0,0]=2 480 B5R1.1 C1CCOC1 22904 [0,0,0,1,0,0|0,1,0]=2 481 B5R1.1 C1CCOC1 30760 [0,0,0,1,0,0|0,1,0]=2 482 B5R1.1 C1CCOC1 32468 [0,0,0,1,0,0|0,1,0]=2 483 B5R1.1 C1CCOC1 38994 [0,0,0,1,0,0|0,1,0]=2 484 B5R1.1 C1CCOC1 39460 [0,0,0,1,0,0|0,1,0]=2 485 B5R1.1 C1CCOC1 39550 [0,0,0,1,0,0|0,1,0]=2 486 B5R1.1 C1CCOC1 39594 [0,0,0,1,0,0|0,1,0]=2 487 B5R1.1 C1CCOC1 41819 [0,0,0,1,0,0|0,1,0]=2 488 B5R1.1 C1CCOC1 41820 [0,0,0,1,0,0|0,1,0]=2 489 B5R1.1 C1CCOC1 42254 [0,0,0,1,0,0|0,1,0]=2 490 B5R1.1 C1CCOC1 43291 [0,0,0,1,0,0|0,1,0]=2 491 B5R1.1 C1CCOC1 44505 [0,0,0,1,0,0|0,1,0]=2 492 B5R1.1 C1CCOC1 44608 [0,0,0,1,0,0|0,1,0]=2 493 B5R1.1 C1CCOC1 47122 [0,0,0,1,0,0|0,1,0]=2 494 B5R1.1 C1CCOC1 L13304 [0,0,0,1,0,0|0,1,0]=2 495 B5R1.1 C1CCOC1 L13961 [0,0,0,1,0,0|0,1,0]=2 496 B5R1.1 C1CCOC1 L17593 [0,0,0,1,0,0|0,1,0]=2 497 B5R1.1 C1CCSC1 L13908 [0,0,0,1,0,0|0,0,0]=1 498 B5R1.1 C1COC=C1 B20575 [0,0,0,1,0,0|0,1,2]=4 499 B5R1.1 C1COCO1 42897 [0,0,0,1,0,0|1,1,0]=3 500 B5R1.1 C1CSCN1 H26427 [0,0,0,1,0,0|1,0,0]=2 501 B5R1.2 C1C(CN1)F H59454 [0,0,0,1,0,0|3,0,0]=4 502 B5R1.2 C1C(CN1)N H59318 [0,0,0,1,0,0|3,0,0]=4 503 B5R1.2 C1C(CN1)O H25842 [0,0,0,1,0,0|3,0,0]=4 504 B5R1.2 C1C(CO1)Br H57437 [0,0,0,1,0,0|3,0,0]=4 505 B5R1.2 C1C(CO1)I H57302 [0,0,0,1,0,0|3,0,0]=4 506 B5R1.2 C1C(CO1)N H57248 [0,0,0,1,0,0|3,0,0]=4 507 B5R1.2 C1C(CO1)O H57928 [0,0,0,1,0,0|3,0,0]=4 508 B5R1.2 C1CC(=O)C1 A13068 [0,0,0,1,0,0|2,0,1]=4 509 B5R1.2 C1CC(C1)Br A12817 [0,0,0,1,0,0|2,0,0]=3 510 B5R1.2 C1CC(C1)Cl A12561 [0,0,0,1,0,0|2,0,0]=3 511 B5R1.2 C1CC(C1)N A13423 [0,0,0,1,0,0|2,0,0]=3 512 B5R1.2 C1CC(C1)N B25400 [0,0,0,1,0,0|2,0,0]=3 513 B5R1.2 C1CC(C1)O A12430 [0,0,0,1,0,0|2,0,0]=3 514 B5R1.2 C1CC(C1)[Zn+] H58247 [0,0,0,1,0,0|2,0,0]=3 515 B5R1.2 C1COC1=O B23197 [0,0,0,1,0,0|1,1,1]=4 516 B5R1.3 C#CC1CC1 H53440 [0,0,0,1,0,0|1,0,2]=4 517 B5R1.3 C1C(O1)CCl A15823 [0,0,0,1,0,0|3,0,0]=4 518 B5R1.3 C1CC1C#N A11125 [0,0,0,1,0,0|2,0,1]=4 519 B5R1.3 C1CC1C=O L14931 [0,0,0,1,0,0|2,0,1]=4 520 B5R1.3 C1CC1CBr L01122 [0,0,0,1,0,0|2,0,0]=3 521 B5R1.3 C1CC1CCl L06986 [0,0,0,1,0,0|2,0,0]=3 522 B5R1.3 C1CC1CI H35309 [0,0,0,1,0,0|2,0,0]=3 523 B5R1.3 C1CC1CN A13946 [0,0,0,1,0,0|2,0,0]=3 524 B5R1.3 C1CC1CN L13353 [0,0,0,1,0,0|2,0,0]=3 525 B5R1.3 C1CC1CO A12567 [0,0,0,1,0,0|2,0,0]=3 526 B5R1.3 C1[C@@H](O1)CCl L14198 [0,0,0,1,0,0|3,0,0]=4 527 B5R1.3 C1[C@@H](O1)CO H63502 [0,0,0,1,0,0|3,0,0]=4 528 B5R1.3 C1[C@H](O1)CCl L14298 [0,0,0,1,0,0|3,0,0]=4 529 B5R1.3 CC[C@@H]1CO1 H58579 [0,0,0,1,0,0|2,0,0]=3 530 B5R1.3 CC[C@H]1CO1 H58104 [0,0,0,1,0,0|2,0,0]=3 531 B5R1.4 C[C@@H]1[C@@H](O1)C L10320 [0,0,0,1,0,0|0,1,0]=2 532 B5R1.4 C[C@H]1[C@@H](O1)C B22005 [0,0,0,1,0,0|0,1,0]=2 533 B2R0.1 C(Br)Br A10456 [2,0,0,0,0,0|2,0,0]=4 534 B2R0.1 C(Cl)Cl 22917 [2,0,0,0,0,0|2,0,0]=4 535 B2R0.1 C(Cl)Cl 32440 [2,0,0,0,0,0|2,0,0]=4 536 B2R0.1 C(Cl)Cl 39116 [2,0,0,0,0,0|2,0,0]=4 537 B2R0.1 C(Cl)Cl 41835 [2,0,0,0,0,0|2,0,0]=4 538 B2R0.1 C(Cl)Cl 42006 [2,0,0,0,0,0|2,0,0]=4 539 B2R0.1 C(Cl)Cl L13089 [2,0,0,0,0,0|2,0,0]=4 540 B2R0.1 C(Cl)I A11032 [2,0,0,0,0,0|2,0,0]=4 541 B2R0.1 C(I)I A15457 [2,0,0,0,0,0|2,0,0]=4 542 B2R0.1 CC#N 10002 [2,0,0,0,0,0|1,0,1]=4 543 B2R0.1 CC#N 22927 [2,0,0,0,0,0|1,0,1]=4 544 B2R0.1 CC#N 32470 [2,0,0,0,0,0|1,0,1]=4 545 B2R0.1 CC#N 36423 [2,0,0,0,0,0|1,0,1]=4 546 B2R0.1 CC#N 40972 [2,0,0,0,0,0|1,0,1]=4 547 B2R0.1 CC#N 42311 [2,0,0,0,0,0|1,0,1]=4 548 B2R0.1 CC#N 42879 [2,0,0,0,0,0|1,0,1]=4 549 B2R0.1 CC#N 42880 [2,0,0,0,0,0|1,0,1]=4 550 B2R0.1 CC#N 43166 [2,0,0,0,0,0|1,0,1]=4 551 B2R0.1 CC#N 43440 [2,0,0,0,0,0|1,0,1]=4 552 B2R0.1 CC#N 47138 [2,0,0,0,0,0|1,0,1]=4 553 B2R0.1 CC#N A19862 [2,0,0,0,0,0|1,0,1]=4 554 B2R0.1 CC#N H33387 [2,0,0,0,0,0|1,0,1]=4 555 B2R0.1 CC=O 33244 [2,0,0,0,0,0|0,1,1]=4 556 B2R0.1 CCBr A12804 [2,0,0,0,0,0|1,0,0]=3 557 B2R0.1 CCC A17702 [2,0,0,0,0,0|0,0,0]=2 558 B2R0.1 CCI A14444 [2,0,0,0,0,0|1,0,0]=3 559 B2R0.1 CCN A15022 [2,0,0,0,0,0|1,0,0]=3 560 B2R0.1 CCN H32306 [2,0,0,0,0,0|1,0,0]=3 561 B2R0.1 CCN L03624 [2,0,0,0,0,0|1,0,0]=3 562 B2R0.1 CCO 22930 [2,0,0,0,0,0|0,1,0]=3 563 B2R0.1 CCO 22931 [2,0,0,0,0,0|0,1,0]=3 564 B2R0.1 CCO 31337 [2,0,0,0,0,0|0,1,0]=3 565 B2R0.1 CCO 33361 [2,0,0,0,0,0|0,1,0]=3 566 B2R0.1 CCO 36642 [2,0,0,0,0,0|0,1,0]=3 567 B2R0.1 CCO 41603 [2,0,0,0,0,0|0,1,0]=3 568 B2R0.1 CCO 44014 [2,0,0,0,0,0|0,1,0]=3 569 B2R0.1 CCO 44134 [2,0,0,0,0,0|0,1,0]=3 570 B2R0.1 CCO 45844 [2,0,0,0,0,0|0,1,0]=3 571 B2R0.1 CCS 22585 [2,0,0,0,0,0|0,0,0]=2 572 B2R0.1 CC[Al+2] 41712 [2,0,0,0,0,0|1,0,0]=3 573 B2R0.1 CC[Hg+] 37114 [2,0,0,0,0,0|1,0,0]=3 574 B2R0.1 CC[Mg+] 41675 [2,0,0,0,0,0|1,0,0]=3 575 B2R0.1 CC[Mg+] 47279 [2,0,0,0,0,0|1,0,0]=3 576 B2R0.1 CC[Mg+] 87291 [2,0,0,0,0,0|1,0,0]=3 577 B2R0.1 CC[O-] 14263 [2,0,0,0,0,0|0,1,0]=3 578 B2R0.1 CC[O-] 14264 [2,0,0,0,0,0|0,1,0]=3 579 B2R0.1 CC[O-] 14643 [2,0,0,0,0,0|0,1,0]=3 580 B2R0.1 CC[O-] 14679 [2,0,0,0,0,0|0,1,0]=3 581 B2R0.1 CC[O-] 14689 [2,0,0,0,0,0|0,1,0]=3 582 B2R0.1 CC[O-] 18859 [2,0,0,0,0,0|0,1,0]=3 583 B2R0.1 CC[O-] 18862 [2,0,0,0,0,0|0,1,0]=3 584 B2R0.1 CC[O-] 20896 [2,0,0,0,0,0|0,1,0]=3 585 B2R0.1 CC[O-] 31498 [2,0,0,0,0,0|0,1,0]=3 586 B2R0.1 CC[O-] 35791 [2,0,0,0,0,0|0,1,0]=3 587 B2R0.1 CC[O-] 36588 [2,0,0,0,0,0|0,1,0]=3 588 B2R0.1 CC[O-] 39155 [2,0,0,0,0,0|0,1,0]=3 589 B2R0.1 CC[O-] 39161 [2,0,0,0,0,0|0,1,0]=3 590 B2R0.1 CC[O-] 39170 [2,0,0,0,0,0|0,1,0]=3 591 B2R0.1 CC[O-] 39171 [2,0,0,0,0,0|0,1,0]=3 592 B2R0.1 CC[O-] 41105 [2,0,0,0,0,0|0,1,0]=3 593 B2R0.1 CC[O-] 41336 [2,0,0,0,0,0|0,1,0]=3 594 B2R0.1 CC[O-] 41607 [2,0,0,0,0,0|0,1,0]=3 595 B2R0.1 CC[O-] 41794 [2,0,0,0,0,0|0,1,0]=3 596 B2R0.1 CC[O-] 41795 [2,0,0,0,0,0|0,1,0]=3 597 B2R0.1 CC[O-] 41863 [2,0,0,0,0,0|0,1,0]=3 598 B2R0.1 CC[O-] 42344 [2,0,0,0,0,0|0,1,0]=3 599 B2R0.1 CC[O-] 43052 [2,0,0,0,0,0|0,1,0]=3 600 B2R0.1 CC[O-] 43097 [2,0,0,0,0,0|0,1,0]=3 601 B2R0.1 CC[O-] 44670 [2,0,0,0,0,0|0,1,0]=3 602 B2R0.1 CC[O-] 44681 [2,0,0,0,0,0|0,1,0]=3 603 B2R0.1 CC[O-] 44769 [2,0,0,0,0,0|0,1,0]=3 604 B2R0.1 CC[O-] 44859 [2,0,0,0,0,0|0,1,0]=3 605 B2R0.1 CC[O-] 45590 [2,0,0,0,0,0|0,1,0]=3 606 B2R0.1 CC[O-] 45861 [2,0,0,0,0,0|0,1,0]=3 607 B2R0.1 CC[O-] 46316 [2,0,0,0,0,0|0,1,0]=3 608 B2R0.1 CC[O-] 77142 [2,0,0,0,0,0|0,1,0]=3 609 B2R0.1 CC[O-] 78131 [2,0,0,0,0,0|0,1,0]=3 610 B2R0.1 CC[O-] L06230 [2,0,0,0,0,0|0,1,0]=3 611 B2R0.1 CC[O-] L10288 [2,0,0,0,0,0|0,1,0]=3 612 B2R0.1 CC[O-] L13083 [2,0,0,0,0,0|0,1,0]=3 613 B2R0.1 CC[O-] L16031 [2,0,0,0,0,0|0,1,0]=3 614 B2R0.1 CC[O-] L16033 [2,0,0,0,0,0|0,1,0]=3 615 B2R0.1 CNC 31458 [2,0,0,0,0,0|1,0,0]=3 616 B2R0.1 CNC 43261 [2,0,0,0,0,0|1,0,0]=3 617 B2R0.1 CNC 89149 [2,0,0,0,0,0|1,0,0]=3 618 B2R0.1 CNC A12133 [2,0,0,0,0,0|1,0,0]=3 619 B2R0.1 CNC H27261 [2,0,0,0,0,0|1,0,0]=3 620 B2R0.1 CNC H27665 [2,0,0,0,0,0|1,0,0]=3 621 B2R0.1 CNO L02202 [2,0,0,0,0,0|1,1,0]=4 622 B2R0.1 CON A19188 [2,0,0,0,0,0|1,1,0]=4 623 B2R0.1 CON L08415 [2,0,0,0,0,0|1,1,0]=4 624 B2R0.1 CSC 19368 [2,0,0,0,0,0|0,0,0]=2 625 B2R0.1 CSC 22949 [2,0,0,0,0,0|0,0,0]=2 626 B2R0.1 CSC 42963 [2,0,0,0,0,0|0,0,0]=2 627 B2R0.1 CSC 42965 [2,0,0,0,0,0|0,0,0]=2 628 B2R0.1 CSC 42967 [2,0,0,0,0,0|0,0,0]=2 629 B2R0.1 CSC 43327 [2,0,0,0,0,0|0,0,0]=2 630 B2R0.1 CSC L07705 [2,0,0,0,0,0|0,0,0]=2 631 B2R0.1 C[N-]C 40443 [2,0,0,0,0,0|1,0,0]=3 632 B2R0.1 C[N-]C 42761 [2,0,0,0,0,0|1,0,0]=3 633 B2R0.1 C[N-]C 43237 [2,0,0,0,0,0|1,0,0]=3 634 B2R0.1 C[N-]C 44145 [2,0,0,0,0,0|1,0,0]=3 635 B2R0.1 C[N-]C 45491 [2,0,0,0,0,0|1,0,0]=3 636 B2R0.1 C[Se]C 68116 [2,0,0,0,0,0|0,1,0]=3 637 B2R0.1 C[Sn+2]C 71142 [2,0,0,0,0,0|1,0,0]=3 638 B2R0.1 C[Sn+2]C 71164 [2,0,0,0,0,0|1,0,0]=3 639 B2R0.1 C[Sn+2]C A17661 [2,0,0,0,0,0|1,0,0]=3 640 B2R0.1 C[Sn+2]C A18060 [2,0,0,0,0,0|1,0,0]=3 641 B2R0.1 [2H]OC 89571 [2,0,0,0,0,0|1,1,0]=4 642 B4R0.1 B(CC)(O)O L19959 [1,1,0,0,0,0|2,0,0]=4 643 B4R0.1 C(C(F)F)O B22201 [1,1,0,0,0,0|2,0,0]=4 644 B4R0.1 CC(=C)CCl B22674 [1,1,0,0,0,0|1,0,1]=4 645 B4R0.1 CC(=C)CO H60502 [1,1,0,0,0,0|1,0,1]=4 646 B4R0.1 CC(=C)OC B24083 [1,1,0,0,0,0|0,1,1]=4 647 B4R0.1 CC(=O)CCl A11922 [1,1,0,0,0,0|1,0,1]=4 648 B4R0.1 CC(=O)CO L15008 [1,1,0,0,0,0|1,0,1]=4 649 B4R0.1 CC(=O)NC A17928 [1,1,0,0,0,0|1,0,1]=4 650 B4R0.1 CC(=O)OC L14475 [1,1,0,0,0,0|0,1,1]=4 651 B4R0.1 CC(=O)SC A12400 [1,1,0,0,0,0|0,0,1]=3 652 B4R0.1 CC(C#C)O A11881 [1,1,0,0,0,0|0,0,2]=4 653 B4R0.1 CC(C)C#C H53439 [1,1,0,0,0,0|0,0,2]=4 654 B4R0.1 CC(C)C#N L14470 [1,1,0,0,0,0|1,0,1]=4 655 B4R0.1 CC(C)C=O A12106 [1,1,0,0,0,0|1,0,1]=4 656 B4R0.1 CC(C)CBr B23854 [1,1,0,0,0,0|1,0,0]=3 657 B4R0.1 CC(C)CCl L04181 [1,1,0,0,0,0|1,0,0]=3 658 B4R0.1 CC(C)CI A15883 [1,1,0,0,0,0|1,0,0]=3 659 B4R0.1 CC(C)CN A11017 [1,1,0,0,0,0|1,0,0]=3 660 B4R0.1 CC(C)CO 22908 [1,1,0,0,0,0|1,0,0]=3 661 B4R0.1 CC(C)CO 32433 [1,1,0,0,0,0|1,0,0]=3 662 B4R0.1 CC(C)CO 36643 [1,1,0,0,0,0|1,0,0]=3 663 B4R0.1 CC(C)CO B23091 [1,1,0,0,0,0|1,0,0]=3 664 B4R0.1 CC(C)C[O-] 89455 [1,1,0,0,0,0|1,0,0]=3 665 B4R0.1 CC(C)C[Zn+] H58145 [1,1,0,0,0,0|1,0,0]=3 666 B4R0.1 CC(C)NC H65892 [1,1,0,0,0,0|1,0,0]=3 667 B4R0.1 CC(C=C)O L14787 [1,1,0,0,0,0|0,0,2]=4 668 B4R0.1 CC(CBr)Br B22994 [1,1,0,0,0,0|1,0,0]=3 669 B4R0.1 CC(CCl)Cl L03083 [1,1,0,0,0,0|1,0,0]=3 670 B4R0.1 CC(CCl)O B22686 [1,1,0,0,0,0|1,0,0]=3 671 B4R0.1 CC(CN)N B24489 [1,1,0,0,0,0|1,0,0]=3 672 B4R0.1 CC(CN)O L15343 [1,1,0,0,0,0|1,0,0]=3 673 B4R0.1 CC(CO)N L03608 [1,1,0,0,0,0|1,0,0]=3 674 B4R0.1 CC(CO)O 30948 [1,1,0,0,0,0|1,0,0]=3 675 B4R0.1 CC(CO)O A18406 [1,1,0,0,0,0|1,0,0]=3 676 B4R0.1 CC=C(C)C 31853 [1,1,0,0,0,0|0,0,2]=4 677 B4R0.1 CCC(=C)Br B20067 [1,1,0,0,0,0|0,0,2]=4 678 B4R0.1 CCC(=C)C H27230 [1,1,0,0,0,0|0,0,1]=3 679 B4R0.1 CCC(=O)C 22924 [1,1,0,0,0,0|0,0,1]=3 680 B4R0.1 CCC(=O)C 31069 [1,1,0,0,0,0|0,0,1]=3 681 B4R0.1 CCC(=O)C 39119 [1,1,0,0,0,0|0,0,1]=3 682 B4R0.1 CCC(=O)C L13185 [1,1,0,0,0,0|0,0,1]=3 683 B4R0.1 CCC(=O)Cl A10940 [1,1,0,0,0,0|1,0,1]=4 684 B4R0.1 CCC(=O)N A10521 [1,1,0,0,0,0|1,0,1]=4 685 B4R0.1 CCC(=O)O L04210 [1,1,0,0,0,0|1,0,1]=4 686 B4R0.1 CCC(=O)[O-] 18865 [1,1,0,0,0,0|1,0,1]=4 687 B4R0.1 CCC(=O)[O-] A14994 [1,1,0,0,0,0|1,0,1]=4 688 B4R0.1 CCC(=O)[O-] A17440 [1,1,0,0,0,0|1,0,1]=4 689 B4R0.1 CCC(=O)[O-] B23636 [1,1,0,0,0,0|1,0,1]=4 690 B4R0.1 CCC(C)Br A15069 [1,1,0,0,0,0|0,0,0]=2 691 B4R0.1 CCC(C)C 19387 [1,1,0,0,0,0|0,0,0]=2 692 B4R0.1 CCC(C)Cl B21586 [1,1,0,0,0,0|0,0,0]=2 693 B4R0.1 CCC(C)I B20619 [1,1,0,0,0,0|0,0,0]=2 694 B4R0.1 CCC(C)N A13014 [1,1,0,0,0,0|0,0,0]=2 695 B4R0.1 CCC(C)O 41871 [1,1,0,0,0,0|0,0,0]=2 696 B4R0.1 CCC(C)O 43315 [1,1,0,0,0,0|0,0,0]=2 697 B4R0.1 CCC(C)O A18658 [1,1,0,0,0,0|0,0,0]=2 698 B4R0.1 CCC(C)[O-] 30721 [1,1,0,0,0,0|0,0,0]=2 699 B4R0.1 CCC(C)[O-] 43712 [1,1,0,0,0,0|0,0,0]=2 700 B4R0.1 CCC(C)[O-] A13044 [1,1,0,0,0,0|0,0,0]=2 701 B4R0.1 CCC(C)[Zn+] H58714 [1,1,0,0,0,0|0,0,0]=2 702 B4R0.1 CCN(C)C B23992 [1,1,0,0,0,0|1,0,0]=3 703 B4R0.1 CC[C@@H](C)N L03889 [1,1,0,0,0,0|0,0,0]=2 704 B4R0.1 CC[C@@H](C)O L13983 [1,1,0,0,0,0|0,0,0]=2 705 B4R0.1 CC[C@H](C)N L10069 [1,1,0,0,0,0|0,0,0]=2 706 B4R0.1 CC[C@H](C)O L14164 [1,1,0,0,0,0|0,0,0]=2 707 B4R0.1 CC[N+](=O)[O-] A10855 [1,1,0,0,0,0|2,0,0]=4 708 B4R0.1 CSC(=[NH2+])N A11044 [1,1,0,0,0,0|1,0,1]=4 709 B4R0.1 C[Al](C)C[Ti+] 44506 [1,1,0,0,0,0|2,0,0]=4 710 B4R0.1 C[C@@H](C#C)O L20345 [1,1,0,0,0,0|0,0,2]=4 711 B4R0.1 C[C@@H](CN)N H60753 [1,1,0,0,0,0|1,0,0]=3 712 B4R0.1 C[C@@H](CN)O L14102 [1,1,0,0,0,0|1,0,0]=3 713 B4R0.1 C[C@@H](CO)N B24916 [1,1,0,0,0,0|1,0,0]=3 714 B4R0.1 C[C@@H](CO)O B21773 [1,1,0,0,0,0|1,0,0]=3 715 B4R0.1 C[C@H](C#C)O L18880 [1,1,0,0,0,0|0,0,2]=4 716 B4R0.1 C[C@H](CN)O L14101 [1,1,0,0,0,0|1,0,0]=3 717 B4R0.1 C[C@H](CO)N L11030 [1,1,0,0,0,0|1,0,0]=3 718 B4R0.1 C[C@H](CO)O B21937 [1,1,0,0,0,0|1,0,0]=3 719 B4R0.1 C\C=C(\C)/Br A18058 [1,1,0,0,0,0|0,0,2]=4 720 B4R0.1 [Li]C(C)CC 43028 [1,1,0,0,0,0|0,0,0]=2 721 B6R0.1 C(CO)C(CO)O L05138 [0,2,0,0,0,0|2,0,0]=4 722 B6R0.1 C(CO)[C@@H](CO)O L20258 [0,2,0,0,0,0|2,0,0]=4 723 B6R0.1 CCC(=O)CC#N H50789 [0,2,0,0,0,0|1,0,1]=4 724 B6R0.1 CCC(=O)OCC 15498 [0,2,0,0,0,0|0,1,0]=3 725 B6R0.1 CCC(=O)OCC A16650 [0,2,0,0,0,0|0,1,0]=3 726 B6R0.1 CCC(=O)SCC B24918 [0,2,0,0,0,0|0,0,0]=2 727 B6R0.1 CCC(=O)\C=C\C H27445 [0,2,0,0,0,0|1,0,1]=4 728 B6R0.1 CCC(C#CC)O L09727 [0,2,0,0,0,0|1,0,1]=4 729 B6R0.1 CCC(C)CCO B22356 [0,2,0,0,0,0|1,0,0]=3 730 B6R0.1 CCC(CC#C)O L05437 [0,2,0,0,0,0|1,0,1]=4 731 B6R0.1 CCCC(=O)CC B20791 [0,2,0,0,0,0|1,0,0]=3 732 B6R0.1 CCCC(=O)OC L04250 [0,2,0,0,0,0|1,0,1]=4 733 B6R0.1 CCCC(=O)SC B22144 [0,2,0,0,0,0|1,0,1]=4 734 B6R0.1 CCCC(C#C)O L11549 [0,2,0,0,0,0|1,0,1]=4 735 B6R0.1 CCCC(C)C#C L09296 [0,2,0,0,0,0|1,0,0]=3 736 B6R0.1 CCCC(C)C=O B24199 [0,2,0,0,0,0|1,0,0]=3 737 B6R0.1 CCCC(C=C)O A19672 [0,2,0,0,0,0|1,0,1]=4 738 B6R0.1 CCCC(CC)Br L00818 [0,2,0,0,0,0|1,0,0]=3 739 B6R0.1 CCCC(CC)O B20210 [0,2,0,0,0,0|1,0,0]=3 740 B6R0.1 CCCC(CC)[Zn+] H58535 [0,2,0,0,0,0|1,0,0]=3 741 B6R0.1 CCOC(=O)CBr A10448 [0,2,0,0,0,0|0,1,1]=4 742 B6R0.1 CCOC(=O)CCl A15554 [0,2,0,0,0,0|0,1,1]=4 743 B6R0.1 CCOC(=O)CF H61340 [0,2,0,0,0,0|0,1,1]=4 744 B6R0.1 CCOC(=O)CI B24177 [0,2,0,0,0,0|0,1,1]=4 745 B6R0.1 CCOC(=O)CN A10315 [0,2,0,0,0,0|0,1,1]=4 746 B6R0.1 CCOC(=O)CO 41475 [0,2,0,0,0,0|0,1,1]=4 747 B6R0.1 CCOC(=O)CS A14321 [0,2,0,0,0,0|0,1,1]=4 748 B6R0.1 CCO\C(=N\O)\C A11006 [0,2,0,0,0,0|0,1,1]=4 749 B6R0.1 CC\C=C(/C)\C=O A15729 [0,2,0,0,0,0|1,0,1]=4 750 B6R0.1 CNCC(=O)OC L08572 [0,2,0,0,0,0|2,0,0]=4 751 B6R0.1 CNCC(CO)O L12653 [0,2,0,0,0,0|2,0,0]=4 752 B6R0.1 COC(=O)CCBr L14127 [0,2,0,0,0,0|2,0,0]=4 753 B6R0.1 COC(=O)CCN H27483 [0,2,0,0,0,0|2,0,0]=4 754 B6R0.1 COC(=O)CCS B20718 [0,2,0,0,0,0|2,0,0]=4 755 B6R0.1 COCC(=O)OC B22528 [0,2,0,0,0,0|2,0,0]=4 756 B6R0.1 COCC(CCl)O L16239 [0,2,0,0,0,0|2,0,0]=4 757 B6R0.1 COCC(CO)O L08011 [0,2,0,0,0,0|2,0,0]=4 758 B6R0.2 CC(C)CC(=C)C B20002 [0,2,0,0,0,0|1,0,1]=4 759 B6R0.2 CC(C)CC(=O)C 33346 [0,2,0,0,0,0|1,0,1]=4 760 B6R0.2 CC(C)CC(=O)C 43170 [0,2,0,0,0,0|1,0,1]=4 761 B6R0.2 CC(C)CC(=O)C A11618 [0,2,0,0,0,0|1,0,1]=4 762 B6R0.2 CC(C)CC(C)C L03570 [0,2,0,0,0,0|1,0,0]=3 763 B6R0.2 CC(C)CC(C)O A13435 [0,2,0,0,0,0|1,0,0]=3 764 B6R0.2 CC(C)NC(C)C A10280 [0,2,0,0,0,0|1,0,0]=3 765 B6R0.2 CC(C)NC(C)C H61341 [0,2,0,0,0,0|1,0,0]=3 766 B6R0.2 CC(C)OC(=O)C L09337 [0,2,0,0,0,0|0,1,1]=4 767 B6R0.2 CC(C)SC(C)C B21302 [0,2,0,0,0,0|0,0,0]=2 768 B6R0.2 CC(C)[N-]C(C)C 47284 [0,2,0,0,0,0|1,0,0]=3 769 B6R0.2 CC(CC(=O)C)[O-] 12542 [0,2,0,0,0,0|1,0,1]=4 770 B6R0.2 CC(CC(=O)C)[O-] 44538 [0,2,0,0,0,0|1,0,1]=4 771 B6R0.2 CC(CC(C)O)O L01779 [0,2,0,0,0,0|1,0,0]=3 772 B6R0.2 CC(CN(C)C)Cl B20882 [0,2,0,0,0,0|2,0,0]=4 773 B6R0.2 CC(CN(C)C)O B24234 [0,2,0,0,0,0|2,0,0]=4 774 B6R0.2 CC([O-])CC(=O)C 46727 [0,2,0,0,0,0|1,0,1]=4 775 B6R0.2 C[C@@H](CC(C)C)O L18882 [0,2,0,0,0,0|1,0,0]=3 776 B6R0.2 C[C@@H](C[C@H](C)O)O H36013 [0,2,0,0,0,0|1,0,0]=3 777 B6R0.2 C[C@H](CC(C)C)O L18881 [0,2,0,0,0,0|1,0,0]=3 778 B6R0.3 CC(C(=O)OC)Br A19558 [0,2,0,0,0,0|2,0,0]=4 779 B6R0.3 CC(C(=O)OC)Cl A18541 [0,2,0,0,0,0|2,0,0]=4 780 B6R0.3 CC(C(=O)OC)N A12599 [0,2,0,0,0,0|2,0,0]=4 781 B6R0.3 CC(C(=O)OC)O H60455 [0,2,0,0,0,0|2,0,0]=4 782 B6R0.3 CC(C)C(=N)OC H63386 [0,2,0,0,0,0|2,0,0]=4 783 B6R0.3 CC(C)C(=O)OC A14070 [0,2,0,0,0,0|2,0,0]=4 784 B6R0.3 CC(C)[C@@H](CO)N L11300 [0,2,0,0,0,0|2,0,0]=4 785 B6R0.3 CC(C)[C@H](CO)N L14166 [0,2,0,0,0,0|2,0,0]=4 786 B6R0.3 CCC(=O)C(=O)C A13116 [0,2,0,0,0,0|1,0,1]=4 787 B6R0.3 CCC(=O)N(C)C H64850 [0,2,0,0,0,0|2,0,0]=4 788 B6R0.3 CCC(C(=O)C)S B21797 [0,2,0,0,0,0|1,0,1]=4 789 B6R0.3 CCC(C(C)C)O L08015 [0,2,0,0,0,0|1,0,0]=3 790 B6R0.3 CCC(C)C(=O)C A19999 [0,2,0,0,0,0|1,0,1]=4 791 B6R0.3 CCC(C)C(C)C 43707 [0,2,0,0,0,0|1,0,0]=3 792 B6R0.3 C[C@@H](C(=O)OC)N A10178 [0,2,0,0,0,0|2,0,0]=4 793 B6R0.3 C[C@@H](C(=O)OC)O B24468 [0,2,0,0,0,0|2,0,0]=4 794 B6R0.3 C[C@H](C(=O)OC)N H62472 [0,2,0,0,0,0|2,0,0]=4 795 B6R0.4 B(CCCC)(O)O A13725 [0,2,0,0,0,0|2,0,0]=4 796 B6R0.4 C(CSC(=N)N)N L14232 [0,2,0,0,0,0|1,0,1]=4 797 B6R0.4 CC(=CCCBr)C L19406 [0,2,0,0,0,0|1,0,1]=4 798 B6R0.4 CC(=O)CCCCl A10269 [0,2,0,0,0,0|1,0,1]=4 799 B6R0.4 CC(=O)CCSC B22206 [0,2,0,0,0,0|1,0,1]=4 800 B6R0.4 CC(=O)NCCCl A11802 [0,2,0,0,0,0|1,0,1]=4 801 B6R0.4 CC(=O)NCCN L13398 [0,2,0,0,0,0|1,0,1]=4 802 B6R0.4 CC(=O)NCCO A18638 [0,2,0,0,0,0|1,0,1]=4 803 B6R0.4 CC(=O)OCSC H32310 [0,2,0,0,0,0|0,1,1]=4 804 B6R0.4 CC(C)CCC#C L06014 [0,2,0,0,0,0|1,0,1]=4 805 B6R0.4 CC(C)CCC=C B20719 [0,2,0,0,0,0|1,0,1]=4 806 B6R0.4 CC(C)NCCN B23391 [0,2,0,0,0,0|1,0,0]=3 807 B6R0.4 CC(C)OCCO L13241 [0,2,0,0,0,0|0,1,0]=3 808 B6R0.4 CC(C)SCCO L05312 [0,2,0,0,0,0|0,0,0]=2 809 B6R0.4 CC(CCCBr)Br L09842 [0,2,0,0,0,0|1,0,0]=3 810 B6R0.4 CCC#CC(=C)C B20560 [0,2,0,0,0,0|1,0,1]=4 811 B6R0.4 CCC#CC(=O)C L05315 [0,2,0,0,0,0|1,0,1]=4 812 B6R0.4 CCC#CC(C)O L11576 [0,2,0,0,0,0|1,0,0]=3 813 B6R0.4 CCCCC(=O)C A14867 [0,2,0,0,0,0|1,0,0]=3 814 B6R0.4 CCCCC(=O)Cl B22637 [0,2,0,0,0,0|1,0,1]=4 815 B6R0.4 CCCCC(=O)N L14601 [0,2,0,0,0,0|1,0,1]=4 816 B6R0.4 CCCCC(=O)O A16238 [0,2,0,0,0,0|1,0,1]=4 817 B6R0.4 CCCCC(C)Br L03364 [0,2,0,0,0,0|1,0,0]=3 818 B6R0.4 CCCCC(C)O L05993 [0,2,0,0,0,0|1,0,0]=3 819 B6R0.4 CCCCC(C)[Zn+] H58543 [0,2,0,0,0,0|1,0,0]=3 820 B6R0.4 CCCC[C@@H](C)N L19304 [0,2,0,0,0,0|1,0,0]=3 821 B6R0.4 CCCC[C@H](C)N L19305 [0,2,0,0,0,0|1,0,0]=3 822 B6R0.4 CCCC[C@H](C)O L10401 [0,2,0,0,0,0|1,0,0]=3 823 B6R0.4 CCCC[Sn](=O)O A18290 [0,2,0,0,0,0|2,0,0]=4 824 B6R0.4 CCCNC(C)C H50256 [0,2,0,0,0,0|1,0,0]=3 825 B6R0.4 CCCOC(=O)C L15355 [0,2,0,0,0,0|0,1,1]=4 826 B6R0.4 CCCSC(=O)C B21875 [0,2,0,0,0,0|0,0,1]=3 827 B6R0.4 CCOCC(=O)Cl H34443 [0,2,0,0,0,0|0,1,1]=4 828 B6R0.4 CCOCC(=O)O B24194 [0,2,0,0,0,0|0,1,1]=4 829 B6R0.4 CCOCC(C)O 43306 [0,2,0,0,0,0|0,1,0]=3 830 B6R0.4 CCSCC(=O)C L04142 [0,2,0,0,0,0|0,0,0]=2 831 B6R0.4 CCSCC(=O)O L04743 [0,2,0,0,0,0|0,0,1]=3 832 B6R0.4 CN(C)CCCCl A15459 [0,2,0,0,0,0|2,0,0]=4 833 B6R0.4 CN(C)CCCCl H65371 [0,2,0,0,0,0|2,0,0]=4 834 B6R0.4 CN(C)CCCN L03539 [0,2,0,0,0,0|2,0,0]=4 835 B6R0.4 CN(C)CCCO A12800 [0,2,0,0,0,0|2,0,0]=4 836 B6R0.4 CNCCN(C)C 31785 [0,2,0,0,0,0|2,0,0]=4 837 B6R0.5 CC#CC(C)(C)C L10210 [0,2,0,0,0,0|1,0,1]=4 838 B6R0.5 CC(C)(C)CCCl L11753 [0,2,0,0,0,0|2,0,0]=4 839 B6R0.5 CC(C)(C)CCO H30194 [0,2,0,0,0,0|2,0,0]=4 840 B6R0.5 CC(C)(CCBr)Br B20468 [0,2,0,0,0,0|2,0,0]=4 841 B6R0.5 CC(C)(COC)O L20351 [0,2,0,0,0,0|2,0,0]=4 842 B6R0.5 CC(C)(COC)[O-] 45488 [0,2,0,0,0,0|2,0,0]=4 843 B6R0.5 CCCC(C)(C)Cl B20705 [0,2,0,0,0,0|1,0,0]=3 844 B6R0.5 CCCC(C)(C)O A19090 [0,2,0,0,0,0|1,0,0]=3 845 B6R0.5 CCC[Si](C)(C)Cl L16621 [0,2,0,0,0,0|1,1,0]=4 846 B6R0.5 CCOC(C)(C)C B22945 [0,2,0,0,0,0|0,1,0]=3 847 B6R0.5 CCOS(=O)(=O)C A12938 [0,2,0,0,0,0|1,1,0]=4 848 B6R0.5 CCO[Si](C)(C)C L10151 [0,2,0,0,0,0|0,2,0]=4 849 B6R0.6 C#CCCCCCl H53476 [0,2,0,0,0,0|1,0,1]=4 850 B6R0.6 C#CCCCCO 43370 [0,2,0,0,0,0|1,0,1]=4 851 B6R0.6 C(CBr)OCCBr L11510 [0,2,0,0,0,0|0,1,0]=3 852 B6R0.6 C(CCBr)CC#N L03952 [0,2,0,0,0,0|1,0,1]=4 853 B6R0.6 C(CCBr)CCBr A18465 [0,2,0,0,0,0|1,0,0]=3 854 B6R0.6 C(CCCl)CC#N L01413 [0,2,0,0,0,0|1,0,1]=4 855 B6R0.6 C(CCCl)CCBr B20479 [0,2,0,0,0,0|1,0,0]=3 856 B6R0.6 C(CCCl)CCCl A12433 [0,2,0,0,0,0|1,0,0]=3 857 B6R0.6 C(CCCl)CCI L04469 [0,2,0,0,0,0|1,0,0]=3 858 B6R0.6 C(CCCl)CC[Zn+] H58957 [0,2,0,0,0,0|1,0,0]=3 859 B6R0.6 C(CCF)CCBr H64806 [0,2,0,0,0,0|1,0,0]=3 860 B6R0.6 C(CCI)CCI A17298 [0,2,0,0,0,0|1,0,0]=3 861 B6R0.6 C(CCN)CCN B23039 [0,2,0,0,0,0|1,0,0]=3 862 B6R0.6 C(CCN)CCO H33954 [0,2,0,0,0,0|1,0,0]=3 863 B6R0.6 C(CCN)CCO L01979 [0,2,0,0,0,0|1,0,0]=3 864 B6R0.6 C(CCO)CCCl L12088 [0,2,0,0,0,0|1,0,0]=3 865 B6R0.6 C(CCO)CCO A13998 [0,2,0,0,0,0|1,0,0]=3 866 B6R0.6 C(CCS)CCS B25665 [0,2,0,0,0,0|1,0,0]=3 867 B6R0.6 C(CC[Zn+])CC#N H58897 [0,2,0,0,0,0|1,0,1]=4 868 B6R0.6 C(CCl)NCCCl A13118 [0,2,0,0,0,0|1,0,0]=3 869 B6R0.6 C(CCl)OCCCl A14234 [0,2,0,0,0,0|0,1,0]=3 870 B6R0.6 C(CNCCN)N A11033 [0,2,0,0,0,0|1,0,0]=3 871 B6R0.6 C(CNCCO)N A10833 [0,2,0,0,0,0|1,0,0]=3 872 B6R0.6 C(CO)NCCO A13389 [0,2,0,0,0,0|1,0,0]=3 873 B6R0.6 C(COCCCl)O A13074 [0,2,0,0,0,0|0,1,0]=3 874 B6R0.6 C(COCCN)N 46833 [0,2,0,0,0,0|0,1,0]=3 875 B6R0.6 C(COCCN)N 46903 [0,2,0,0,0,0|0,1,0]=3 876 B6R0.6 C(COCCN)N 46973 [0,2,0,0,0,0|0,1,0]=3 877 B6R0.6 C(COCCO)N L18897 [0,2,0,0,0,0|0,1,0]=3 878 B6R0.6 C(COCCO)O A14728 [0,2,0,0,0,0|0,1,0]=3 879 B6R0.6 C(CSCCS)S B22304 [0,2,0,0,0,0|0,0,0]=2 880 B6R0.6 C=CCCCCBr L12909 [0,2,0,0,0,0|1,0,1]=4 881 B6R0.6 C=CCCCCCl H53396 [0,2,0,0,0,0|1,0,1]=4 882 B6R0.6 C=CCCCCO A15766 [0,2,0,0,0,0|1,0,1]=4 883 B6R0.6 C=CCCCC[Zn+] H58622 [0,2,0,0,0,0|1,0,1]=4 884 B6R0.6 C=CCSCC=C L10971 [0,2,0,0,0,0|0,0,2]=4 885 B6R0.6 CCCC#CCC H53504 [0,2,0,0,0,0|1,0,0]=3 886 B6R0.6 CCCC#CCO A13339 [0,2,0,0,0,0|1,0,1]=4 887 B6R0.6 CCCCC#CC B21528 [0,2,0,0,0,0|1,0,0]=3 888 B6R0.6 CCCCCC#C A11130 [0,2,0,0,0,0|1,0,0]=3 889 B6R0.6 CCCCCC=C L11487 [0,2,0,0,0,0|1,0,0]=3 890 B6R0.6 CCCCCC=O A16265 [0,2,0,0,0,0|1,0,0]=3 891 B6R0.6 CCCCCCBr A15166 [0,2,0,0,0,0|1,0,0]=3 892 B6R0.6 CCCCCCC 22911 [0,2,0,0,0,0|1,0,0]=3 893 B6R0.6 CCCCCCC 32441 [0,2,0,0,0,0|1,0,0]=3 894 B6R0.6 CCCCCCC 40978 [0,2,0,0,0,0|1,0,0]=3 895 B6R0.6 CCCCCCC 44457 [0,2,0,0,0,0|1,0,0]=3 896 B6R0.6 CCCCCCC 47191 [0,2,0,0,0,0|1,0,0]=3 897 B6R0.6 CCCCCCC A19894 [0,2,0,0,0,0|1,0,0]=3 898 B6R0.6 CCCCCCC H33987 [0,2,0,0,0,0|1,0,0]=3 899 B6R0.6 CCCCCCCl B22379 [0,2,0,0,0,0|1,0,0]=3 900 B6R0.6 CCCCCCI A13784 [0,2,0,0,0,0|1,0,0]=3 901 B6R0.6 CCCCCCN A15663 [0,2,0,0,0,0|1,0,0]=3 902 B6R0.6 CCCCCCO A18232 [0,2,0,0,0,0|1,0,0]=3 903 B6R0.6 CCCCCCS L09659 [0,2,0,0,0,0|1,0,0]=3 904 B6R0.6 CCCCCC[Mg+] H51167 [0,2,0,0,0,0|1,0,0]=3 905 B6R0.6 CCCCCC[Zn+] H58384 [0,2,0,0,0,0|1,0,0]=3 906 B6R0.6 CCCCCNC L04882 [0,2,0,0,0,0|1,0,0]=3 907 B6R0.6 CCCCN=C=O L05664 [0,2,0,0,0,0|1,0,1]=4 908 B6R0.6 CCCCN=C=S A10935 [0,2,0,0,0,0|1,0,1]=4 909 B6R0.6 CCCCNCC B22881 [0,2,0,0,0,0|1,0,0]=3 910 B6R0.6 CCCCOC=C B23673 [0,2,0,0,0,0|1,0,1]=4 911 B6R0.6 CCCCOC=O A13882 [0,2,0,0,0,0|1,0,1]=4 912 B6R0.6 CCCCOCC A17963 [0,2,0,0,0,0|0,1,0]=3 913 B6R0.6 CCCCON=O H56501 [0,2,0,0,0,0|2,0,0]=4 914 B6R0.6 CCCNCCC L15808 [0,2,0,0,0,0|1,0,0]=3 915 B6R0.6 CCCNCCN L03517 [0,2,0,0,0,0|1,0,0]=3 916 B6R0.6 CCCOCCC B21423 [0,2,0,0,0,0|0,1,0]=3 917 B6R0.6 CCCSCCC B23155 [0,2,0,0,0,0|0,0,0]=2 918 B6R0.6 CCCSCCO L12528 [0,2,0,0,0,0|0,0,0]=2 919 B6R0.6 CCC\C=C/CO A13734 [0,2,0,0,0,0|1,0,1]=4 920 B6R0.6 CCC\C=C\CC B25297 [0,2,0,0,0,0|1,0,0]=3 921 B6R0.6 CCC\C=C\CC H53482 [0,2,0,0,0,0|1,0,0]=3 922 B6R0.6 CCC\C=C\CO A13272 [0,2,0,0,0,0|1,0,1]=4 923 B6R0.6 CCOCCC#N A14243 [0,2,0,0,0,0|0,1,0]=3 924 B6R0.6 CCOCCCN B23694 [0,2,0,0,0,0|0,1,0]=3 925 B6R0.6 CCOCCOC B20819 [0,2,0,0,0,0|0,1,0]=3 926 B6R0.6 CCOCOCC B23134 [0,2,0,0,0,0|0,1,0]=3 927 B6R0.6 CCSCCCO B22710 [0,2,0,0,0,0|0,0,0]=2 928 B6R0.6 CC\C=C/CCO A10313 [0,2,0,0,0,0|1,0,0]=3 929 B6R0.6 CC\C=C\CCO L10541 [0,2,0,0,0,0|1,0,0]=3 930 B6R0.6 CC\C=C\OCC H26720 [0,2,0,0,0,0|0,1,0]=3 931 B6R0.6 CNCCCNC A16901 [0,2,0,0,0,0|1,0,0]=3 932 B6R0.6 COCCCCO H50339 [0,2,0,0,0,0|1,0,0]=3 933 B6R0.6 COCCOCCl L01050 [0,2,0,0,0,0|1,1,0]=4 934 B6R0.6 CSCCCCO B22673 [0,2,0,0,0,0|1,0,0]=3 935 B6R0.6 CSCCCSC B22397 [0,2,0,0,0,0|1,0,0]=3 936 B6R0.6 CSCSCSC H26435 [0,2,0,0,0,0|0,0,0]=2 937 B6R0.6 C\C=C/CCCO A19266 [0,2,0,0,0,0|1,0,1]=4 938 B6R0.6 C\C=C\CCCO H54459 [0,2,0,0,0,0|1,0,1]=4 939 B6R0.6 [Li]CCCCCC 47271 [0,2,0,0,0,0|1,0,0]=3 940 B6R0.6 [Li]CCCCCC L15102 [0,2,0,0,0,0|1,0,0]=3 941 B6R0.8 CCC(C)(C)CC 43706 [0,2,0,0,0,0|1,0,0]=3 942 B6R0.8 CCP(=O)(CC)Cl H27681 [0,2,0,0,0,0|1,0,0]=3 943 B6R0.8 CC[Ge](CC)(Cl)Cl 34108 [0,2,0,0,0,0|1,0,0]=3 944 B6R0.8 CC[Si](CC)(Cl)Cl L03239 [0,2,0,0,0,0|1,0,0]=3 945 B6R0.9 B(CC)(CC)CC L15109 [0,2,0,0,0,0|1,0,0]=3 946 B6R0.9 B(CC)(CC)OC L15107 [0,2,0,0,0,0|1,0,0]=3 947 B6R0.9 CCC(CC)C=O B23465 [0,2,0,0,0,0|1,0,0]=3 948 B6R0.9 CCC(CC)CBr H26445 [0,2,0,0,0,0|1,0,0]=3 949 B6R0.9 CCC(CC)CN B20855 [0,2,0,0,0,0|1,0,0]=3 950 B6R0.9 CCC(CC)CO B21026 [0,2,0,0,0,0|1,0,0]=3 951 B6R0.9 CCC(CC)C[Zn+] H58054 [0,2,0,0,0,0|1,0,0]=3 952 B6R0.9 CCN(CC)C=O L04503 [0,2,0,0,0,0|1,0,0]=3 953 B6R0.9 CCN(CC)CC 12391 [0,2,0,0,0,0|1,0,0]=3 954 B6R0.9 CCN(CC)CC 42962 [0,2,0,0,0,0|1,0,0]=3 955 B6R0.9 CCN(CC)CC A12646 [0,2,0,0,0,0|1,0,0]=3 956 B6R0.9 CCN(CC)CC A17318 [0,2,0,0,0,0|1,0,0]=3 957 B6R0.9 CCN(CC)CC A17926 [0,2,0,0,0,0|1,0,0]=3 958 B6R0.9 CCN(CC)CC L14417 [0,2,0,0,0,0|1,0,0]=3 959 B6R0.9 CCP(CC)CC 30177 [0,2,0,0,0,0|1,0,0]=3 960 B6R0.9 CCP(CC)CC 39284 [0,2,0,0,0,0|1,0,0]=3 961 B6R0.9 CCP(CC)CC 39823 [0,2,0,0,0,0|1,0,0]=3 962 B6R0.9 CC[Al](CC)CC 43243 [0,2,0,0,0,0|1,0,0]=3 963 B6R0.9 CC[Al](CC)CC 89054 [0,2,0,0,0,0|1,0,0]=3 964 B6R0.9 CC[GeH](CC)CC 43176 [0,2,0,0,0,0|1,0,0]=3 965 B6R0.9 CC[NH+](CC)CC H36155 [0,2,0,0,0,0|1,0,0]=3 966 B6R0.9 CC[O+](CC)CC 42934 [0,2,0,0,0,0|0,1,0]=3 967 B6R0.9 CC[O+](CC)CC A11678 [0,2,0,0,0,0|0,1,0]=3 968 B6R0.9 CC[O+](CC)CC A14420 [0,2,0,0,0,0|0,1,0]=3 969 B6R0.9 CC[S+](CC)CC L00667 [0,2,0,0,0,0|0,0,1]=3 970 B6R0.9 CC[SiH](CC)CC A10320 [0,2,0,0,0,0|1,0,0]=3 971 B6R0.9 CC[Sn+](CC)CC 39601 [0,2,0,0,0,0|1,0,0]=3 972 B6R0.9 CC[Sn+](CC)CC 39622 [0,2,0,0,0,0|1,0,0]=3 973 B6R0.9 CC[Sn+](CC)CC 71135 [0,2,0,0,0,0|1,0,0]=3 974 B6R0.9 [BH-](CC)(CC)CC 42491 [0,2,0,0,0,0|1,0,0]=3 975 B6R0.9 [BH-](CC)(CC)CC 89144 [0,2,0,0,0,0|1,0,0]=3 976 B4R1.1 C1CNC1 H56351 [1,0,0,1,0,0|1,0,0]=3 977 B4R1.1 C1CNC1 H59935 [1,0,0,1,0,0|1,0,0]=3 978 B4R1.1 C1COC1 A14452 [1,0,0,1,0,0|0,1,0]=3 979 B4R1.2 C1CC1Br A14996 [1,0,0,1,0,0|1,0,0]=3 980 B4R1.2 C1CC1N A13844 [1,0,0,1,0,0|1,0,0]=3 981 B4R1.2 C1CC1[Mg+] H26273 [1,0,0,1,0,0|1,0,0]=3 982 B4R1.2 C1CC1[Mg+] H51158 [1,0,0,1,0,0|1,0,0]=3 983 B4R1.2 C1CC1[Mg+] H66668 [1,0,0,1,0,0|1,0,0]=3 984 B4R1.2 C1CC1[Zn+] H58008 [1,0,0,1,0,0|1,0,0]=3 985 B4R1.2 CC1CO1 30765 [1,0,0,1,0,0|0,1,0]=3 986 B4R1.2 C[C@@H]1CO1 B21884 [1,0,0,1,0,0|0,1,0]=3 987 B4R1.2 C[C@H]1CO1 B22341 [1,0,0,1,0,0|0,1,0]=3 988 B6R1.2 C1CC(=O)NC1 A15332 [0,1,0,1,0,0|1,0,1]=4 989 B6R1.2 C1CC(=O)NC1 L00177 [0,1,0,1,0,0|1,0,1]=4 990 B6R1.2 C1CC(=O)OC1 A16314 [0,1,0,1,0,0|0,1,1]=4 991 B6R1.2 C1CC(=S)NC1 L09374 [0,1,0,1,0,0|1,0,1]=4 992 B6R1.2 C1CCC(=O)C1 A14222 [0,1,0,1,0,0|1,0,0]=3 993 B6R1.2 C1CCC(C1)Br A15455 [0,1,0,1,0,0|1,0,0]=3 994 B6R1.2 C1CCC(C1)Cl B25023 [0,1,0,1,0,0|1,0,0]=3 995 B6R1.2 C1CCC(C1)I L01522 [0,1,0,1,0,0|1,0,0]=3 996 B6R1.2 C1CCC(C1)N L01966 [0,1,0,1,0,0|1,0,0]=3 997 B6R1.2 C1CCC(C1)O A15249 [0,1,0,1,0,0|1,0,0]=3 998 B6R1.2 C1CCC(C1)S 39539 [0,1,0,1,0,0|1,0,0]=3 999 B6R1.2 C1CCC(C1)S L03577 [0,1,0,1,0,0|1,0,0]=3 1000 B6R1.2 C1CCC(C1)[Mg+] H51166 [0,1,0,1,0,0|1,0,0]=3 1001 B6R1.2 C1CCC(C1)[Zn+] H58764 [0,1,0,1,0,0|1,0,0]=3 1002 B6R1.2 C1CCS(=O)C1 A17502 [0,1,0,1,0,0|0,0,1]=3 1003 B6R1.2 C1CNCC1Br H66833 [0,1,0,1,0,0|1,0,0]=3 1004 B6R1.2 C1CNCC1O H64975 [0,1,0,1,0,0|1,0,0]=3 1005 B6R1.2 C1CNC[C@@H]1F H26947 [0,1,0,1,0,0|1,0,0]=3 1006 B6R1.2 C1CNC[C@@H]1N L11173 [0,1,0,1,0,0|1,0,0]=3 1007 B6R1.2 C1CNC[C@@H]1O H52743 [0,1,0,1,0,0|1,0,0]=3 1008 B6R1.2 C1CNC[C@@H]1O L19499 [0,1,0,1,0,0|1,0,0]=3 1009 B6R1.2 C1CNC[C@H]1F H27536 [0,1,0,1,0,0|1,0,0]=3 1010 B6R1.2 C1CNC[C@H]1N L12222 [0,1,0,1,0,0|1,0,0]=3 1011 B6R1.2 C1CNC[C@H]1N L19500 [0,1,0,1,0,0|1,0,0]=3 1012 B6R1.2 C1CNC[C@H]1O H52815 [0,1,0,1,0,0|1,0,0]=3 1013 B6R1.2 C1CNC[C@H]1O L19498 [0,1,0,1,0,0|1,0,0]=3 1014 B6R1.2 C1COCC1=O H66940 [0,1,0,1,0,0|0,1,1]=4 1015 B6R1.2 C1COC[C@@H]1O H56307 [0,1,0,1,0,0|0,1,0]=3 1016 B6R1.2 C1COC[C@H]1N H66034 [0,1,0,1,0,0|0,1,0]=3 1017 B6R1.2 C1COC[C@H]1O H56476 [0,1,0,1,0,0|0,1,0]=3 1018 B6R1.2 C1CSC(=N1)N L02018 [0,1,0,1,0,0|1,0,1]=4 1019 B6R1.2 C1CSC(=N1)S L04924 [0,1,0,1,0,0|1,0,1]=4 1020 B6R1.2 C1CSCC1=O A11002 [0,1,0,1,0,0|0,0,1]=3 1021 B6R1.2 CC1=CCCC1 A18816 [0,1,0,1,0,0|1,0,1]=4 1022 B6R1.2 CC1=NCCC1 44853 [0,1,0,1,0,0|1,0,1]=4 1023 B6R1.2 CC1=NCCN1 A15113 [0,1,0,1,0,0|1,0,1]=4 1024 B6R1.2 CC1=NCCO1 B24612 [0,1,0,1,0,0|0,1,1]=4 1025 B6R1.2 CC1=NCCS1 L01329 [0,1,0,1,0,0|0,0,1]=3 1026 B6R1.2 CC1CCCC1 L03988 [0,1,0,1,0,0|1,0,0]=3 1027 B6R1.2 CC1CCCN1 31902 [0,1,0,1,0,0|1,0,0]=3 1028 B6R1.2 CC1CCCO1 L07356 [0,1,0,1,0,0|0,1,0]=3 1029 B6R1.2 CC1CCCS1 43456 [0,1,0,1,0,0|0,0,0]=2 1030 B6R1.2 CC1NCCS1 B22537 [0,1,0,1,0,0|0,0,0]=2 1031 B6R1.2 CC1OCCO1 A12824 [0,1,0,1,0,0|0,1,0]=3 1032 B6R1.2 CC1SCCS1 B23372 [0,1,0,1,0,0|0,0,0]=2 1033 B6R1.2 CN1CCCC1 B23799 [0,1,0,1,0,0|1,0,0]=3 1034 B6R1.2 C[C@@H]1CCCN1 H57885 [0,1,0,1,0,0|1,0,0]=3 1035 B6R1.3 C1CC1CC#N L11950 [0,1,0,1,0,0|1,0,1]=4 1036 B6R1.3 C1CC1CCO L11080 [0,1,0,1,0,0|1,0,0]=3 1037 B6R1.8 CC1CC1CO H27337 [0,1,0,1,0,0|1,0,0]=3 1038 B6R1.10 CC1(COC1)C H27370 [0,1,0,1,0,0|2,0,0]=4 1039 B6R1.10 CC1(COC1)N H57588 [0,1,0,1,0,0|2,0,0]=4 1040 B6R1.11 CC(=O)C1CC1 A13540 [0,1,0,1,0,0|1,0,1]=4 1041 B6R1.11 CC(C)C1CO1 L19291 [0,1,0,1,0,0|2,0,0]=4 1042 B6R1.11 C[C@@H](C1CC1)N H27499 [0,1,0,1,0,0|1,0,0]=3 1043 B6R1.11 C[C@H](C1CC1)N H26902 [0,1,0,1,0,0|1,0,0]=3 1044 B6R1.1 C1CC=COC1 L02731 [0,1,0,1,0,0|0,1,1]=4 1045 B6R1.1 C1CCC=CC1 A11359 [0,1,0,1,0,0|1,0,0]=3 1046 B6R1.1 C1CCCCC1 22864 [0,1,0,1,0,0|1,0,0]=3 1047 B6R1.1 C1CCCCC1 22919 [0,1,0,1,0,0|1,0,0]=3 1048 B6R1.1 C1CCCCC1 40975 [0,1,0,1,0,0|1,0,0]=3 1049 B6R1.1 C1CCCCC1 A16070 [0,1,0,1,0,0|1,0,0]=3 1050 B6R1.1 C1CCCCC1 H26081 [0,1,0,1,0,0|1,0,0]=3 1051 B6R1.1 C1CCNCC1 A12442 [0,1,0,1,0,0|1,0,0]=3 1052 B6R1.1 C1CCNCC1 A13243 [0,1,0,1,0,0|1,0,0]=3 1053 B6R1.1 C1CCOCC1 A13392 [0,1,0,1,0,0|0,1,0]=3 1054 B6R1.1 C1CCSCC1 L03063 [0,1,0,1,0,0|0,0,0]=2 1055 B6R1.1 C1CNCCN1 A11487 [0,1,0,1,0,0|1,0,0]=3 1056 B6R1.1 C1CNCCN1 A15049 [0,1,0,1,0,0|1,0,0]=3 1057 B6R1.1 C1CNCCN1 A16050 [0,1,0,1,0,0|1,0,0]=3 1058 B6R1.1 C1CNCCN1 A18520 [0,1,0,1,0,0|1,0,0]=3 1059 B6R1.1 C1CNCCN1 H37069 [0,1,0,1,0,0|1,0,0]=3 1060 B6R1.1 C1CNCCN1 L19359 [0,1,0,1,0,0|1,0,0]=3 1061 B6R1.1 C1COCCN1 31984 [0,1,0,1,0,0|0,1,0]=3 1062 B6R1.1 C1COCCN1 A10355 [0,1,0,1,0,0|0,1,0]=3 1063 B6R1.1 C1COCCN1 L15110 [0,1,0,1,0,0|0,1,0]=3 1064 B6R1.1 C1COCCO1 22913 [0,1,0,1,0,0|0,1,0]=3 1065 B6R1.1 C1COCCO1 39118 [0,1,0,1,0,0|0,1,0]=3 1066 B6R1.1 C1COCCO1 43167 [0,1,0,1,0,0|0,1,0]=3 1067 B6R1.1 C1COCCO1 43821 [0,1,0,1,0,0|0,1,0]=3 1068 B6R1.1 C1COCCO1 A14188 [0,1,0,1,0,0|0,1,0]=3 1069 B6R1.1 C1COCOC1 H54107 [0,1,0,1,0,0|0,1,0]=3 1070 B6R1.1 C1CSCCN1 A15958 [0,1,0,1,0,0|0,0,0]=2 1071 B6R1.1 C1CSCCN1 L19470 [0,1,0,1,0,0|0,0,0]=2 1072 B6R1.1 C1CSCCO1 A18052 [0,1,0,1,0,0|0,0,0]=2 1073 B6R1.1 C1CSCSC1 A10505 [0,1,0,1,0,0|0,0,0]=2 1074 B6R1.1 C1OCOCO1 A15639 [0,1,0,1,0,0|1,1,0]=4 1075 B6R1.6 C1C(CN1)CO H57801 [0,1,0,1,0,0|2,0,0]=4 1076 B6R1.6 C1C(CO1)CN H66510 [0,1,0,1,0,0|2,0,0]=4 1077 B6R1.6 C1C(CO1)CO H66333 [0,1,0,1,0,0|2,0,0]=4 1078 B6R1.6 C1CC(C1)C#N A10309 [0,1,0,1,0,0|1,0,1]=4 1079 B6R1.6 C1CC(C1)CO B21480 [0,1,0,1,0,0|1,0,0]=3 1080 B6R1.6 C1COC1CBr H66276 [0,1,0,1,0,0|0,1,0]=3 1081 B6R1.6 C1COC1CI H66525 [0,1,0,1,0,0|0,1,0]=3 1082 B6R1.6 C1COC1CO H66218 [0,1,0,1,0,0|0,1,0]=3 1083 B6R1.6 CNC1COC1 H57425 [0,1,0,1,0,0|2,0,0]=4 1084 B6R1.6 COC1CNC1 H57769 [0,1,0,1,0,0|2,0,0]=4