0 B4R0.1 B(CC)(O)O L19959 [0,0,0,0,0,0|3,0,0]=3 1 B4R0.1 C#CC(=O)O A13245 [0,0,0,0,0,0|2,0,2]=4 2 B4R0.1 C(#N)C(Br)Br A16994 [0,0,0,0,0,0|3,0,1]=4 3 B4R0.1 C(#N)C(Cl)Cl A10612 [0,0,0,0,0,0|3,0,1]=4 4 B4R0.1 C(=O)(N)NO A10831 [0,0,0,0,0,0|2,0,2]=4 5 B4R0.1 C(=O)C(=O)O A16058 [0,0,0,0,0,0|1,0,3]=4 6 B4R0.1 C(=O)C(=O)O B25149 [0,0,0,0,0,0|1,0,3]=4 7 B4R0.1 C(C(=N)N)Cl A14835 [0,0,0,0,0,0|3,0,1]=4 8 B4R0.1 C(C(=O)Br)Br A19580 [0,0,0,0,0,0|2,0,2]=4 9 B4R0.1 C(C(=O)Cl)Cl A15846 [0,0,0,0,0,0|2,0,2]=4 10 B4R0.1 C(C(=O)Cl)I L04428 [0,0,0,0,0,0|2,0,2]=4 11 B4R0.1 C(C(=O)N)Br A11926 [0,0,0,0,0,0|2,0,2]=4 12 B4R0.1 C(C(=O)N)Cl A15238 [0,0,0,0,0,0|2,0,2]=4 13 B4R0.1 C(C(=O)N)I A14715 [0,0,0,0,0,0|2,0,2]=4 14 B4R0.1 C(C(=O)N)N A11128 [0,0,0,0,0,0|2,0,2]=4 15 B4R0.1 C(C(=O)O)Br A14403 [0,0,0,0,0,0|2,0,1]=3 16 B4R0.1 C(C(=O)O)Cl 41724 [0,0,0,0,0,0|2,0,1]=3 17 B4R0.1 C(C(=O)O)Cl A11482 [0,0,0,0,0,0|2,0,1]=3 18 B4R0.1 C(C(=O)O)I A12410 [0,0,0,0,0,0|2,0,1]=3 19 B4R0.1 C(C(=O)O)N 36435 [0,0,0,0,0,0|2,0,1]=3 20 B4R0.1 C(C(=O)O)N 43497 [0,0,0,0,0,0|2,0,1]=3 21 B4R0.1 C(C(=O)O)N A12162 [0,0,0,0,0,0|2,0,1]=3 22 B4R0.1 C(C(=O)O)N A13816 [0,0,0,0,0,0|2,0,1]=3 23 B4R0.1 C(C(=O)O)N J60154 [0,0,0,0,0,0|2,0,1]=3 24 B4R0.1 C(C(=O)O)N J61855 [0,0,0,0,0,0|2,0,1]=3 25 B4R0.1 C(C(=O)O)N J62407 [0,0,0,0,0,0|2,0,1]=3 26 B4R0.1 C(C(=O)O)N J62527 [0,0,0,0,0,0|2,0,1]=3 27 B4R0.1 C(C(=O)O)N J64365 [0,0,0,0,0,0|2,0,1]=3 28 B4R0.1 C(C(=O)O)N J67094 [0,0,0,0,0,0|2,0,1]=3 29 B4R0.1 C(C(=O)O)N J67147 [0,0,0,0,0,0|2,0,1]=3 30 B4R0.1 C(C(=O)O)N J67349 [0,0,0,0,0,0|2,0,1]=3 31 B4R0.1 C(C(=O)O)O A12511 [0,0,0,0,0,0|1,0,1]=2 32 B4R0.1 C(C(=O)O)O L14980 [0,0,0,0,0,0|1,0,1]=2 33 B4R0.1 C(C(=O)O)S B20391 [0,0,0,0,0,0|1,1,1]=3 34 B4R0.1 C(C(=O)[O-])Br L14983 [0,0,0,0,0,0|2,0,2]=4 35 B4R0.1 C(C(=O)[O-])Cl A12379 [0,0,0,0,0,0|2,0,2]=4 36 B4R0.1 C(C(=O)[O-])O 39456 [0,0,0,0,0,0|1,0,2]=3 37 B4R0.1 C(C(=O)[O-])O A12341 [0,0,0,0,0,0|1,0,2]=3 38 B4R0.1 C(C(=O)[O-])S 45557 [0,0,0,0,0,0|1,1,2]=4 39 B4R0.1 C(C(=O)[O-])S L14356 [0,0,0,0,0,0|1,1,2]=4 40 B4R0.1 C(C(F)F)O B22201 [0,0,0,0,0,0|2,0,0]=2 41 B4R0.1 C(O)S(=O)[O-] A15731 [0,0,0,0,0,0|2,0,1]=3 42 B4R0.1 C=C(CBr)Br A12099 [0,0,0,0,0,0|2,0,2]=4 43 B4R0.1 C=C(CCl)Cl L08943 [0,0,0,0,0,0|2,0,2]=4 44 B4R0.1 C=CC(=O)O 43359 [0,0,0,0,0,0|2,0,2]=4 45 B4R0.1 C=CC(=O)O 45779 [0,0,0,0,0,0|2,0,2]=4 46 B4R0.1 C=CC(=O)O L04280 [0,0,0,0,0,0|2,0,2]=4 47 B4R0.1 CC(=C)C#C L06111 [0,0,0,0,0,0|2,0,2]=4 48 B4R0.1 CC(=C)C=C L14619 [0,0,0,0,0,0|2,0,2]=4 49 B4R0.1 CC(=C)C=O 43124 [0,0,0,0,0,0|1,0,3]=4 50 B4R0.1 CC(=C)CCl B22674 [0,0,0,0,0,0|2,0,1]=3 51 B4R0.1 CC(=C)CO H60502 [0,0,0,0,0,0|1,0,1]=2 52 B4R0.1 CC(=C)OC B24083 [0,0,0,0,0,0|3,0,1]=4 53 B4R0.1 CC(=C=C)C L10159 [0,0,0,0,0,0|2,0,2]=4 54 B4R0.1 CC(=NO)C A10802 [0,0,0,0,0,0|2,0,1]=3 55 B4R0.1 CC(=O)C#C L05527 [0,0,0,0,0,0|1,0,3]=4 56 B4R0.1 CC(=O)C#N H66636 [0,0,0,0,0,0|1,0,3]=4 57 B4R0.1 CC(=O)C=C A11910 [0,0,0,0,0,0|1,0,3]=4 58 B4R0.1 CC(=O)C=O B24664 [0,0,0,0,0,0|0,0,4]=4 59 B4R0.1 CC(=O)CCl A11922 [0,0,0,0,0,0|1,0,2]=3 60 B4R0.1 CC(=O)CO L15008 [0,0,0,0,0,0|0,0,2]=2 61 B4R0.1 CC(=O)NBr L02953 [0,0,0,0,0,0|2,0,2]=4 62 B4R0.1 CC(=O)NC A17928 [0,0,0,0,0,0|2,0,2]=4 63 B4R0.1 CC(=O)NN A10969 [0,0,0,0,0,0|2,0,2]=4 64 B4R0.1 CC(=O)NO L01569 [0,0,0,0,0,0|1,0,2]=3 65 B4R0.1 CC(=O)OC L14475 [0,0,0,0,0,0|2,0,2]=4 66 B4R0.1 CC(=O)SC A12400 [0,0,0,0,0,0|2,0,2]=4 67 B4R0.1 CC(C#C)O A11881 [0,0,0,0,0,0|1,0,1]=2 68 B4R0.1 CC(C)C#C H53439 [0,0,0,0,0,0|2,0,1]=3 69 B4R0.1 CC(C)C#N L14470 [0,0,0,0,0,0|2,0,1]=3 70 B4R0.1 CC(C)C=O A12106 [0,0,0,0,0,0|1,0,2]=3 71 B4R0.1 CC(C)CBr B23854 [0,0,0,0,0,0|2,0,0]=2 72 B4R0.1 CC(C)CCl L04181 [0,0,0,0,0,0|2,0,0]=2 73 B4R0.1 CC(C)CI A15883 [0,0,0,0,0,0|2,0,0]=2 74 B4R0.1 CC(C)CN A11017 [0,0,0,0,0,0|2,0,0]=2 75 B4R0.1 CC(C)CO 22908 [0,0,0,0,0,0|1,0,0]=1 76 B4R0.1 CC(C)CO 32433 [0,0,0,0,0,0|1,0,0]=1 77 B4R0.1 CC(C)CO 36643 [0,0,0,0,0,0|1,0,0]=1 78 B4R0.1 CC(C)CO B23091 [0,0,0,0,0,0|1,0,0]=1 79 B4R0.1 CC(C)C[O-] 89455 [0,0,0,0,0,0|1,0,1]=2 80 B4R0.1 CC(C)C[Zn+] H58145 [0,0,0,0,0,0|2,0,0]=2 81 B4R0.1 CC(C)NC H65892 [0,0,0,0,0,0|3,0,0]=3 82 B4R0.1 CC(C=C)O L14787 [0,0,0,0,0,0|1,0,1]=2 83 B4R0.1 CC(CBr)Br B22994 [0,0,0,0,0,0|2,0,0]=2 84 B4R0.1 CC(CCl)Cl L03083 [0,0,0,0,0,0|2,0,0]=2 85 B4R0.1 CC(CCl)O B22686 [0,0,0,0,0,0|1,0,0]=1 86 B4R0.1 CC(CN)N B24489 [0,0,0,0,0,0|2,0,0]=2 87 B4R0.1 CC(CN)O L15343 [0,0,0,0,0,0|1,0,0]=1 88 B4R0.1 CC(CO)N L03608 [0,0,0,0,0,0|1,0,0]=1 89 B4R0.1 CC(CO)O 30948 [0,0,0,0,0,0|0,0,0]=0 90 B4R0.1 CC(CO)O A18406 [0,0,0,0,0,0|0,0,0]=0 91 B4R0.1 CC=C(C)C 31853 [0,0,0,0,0,0|2,0,2]=4 92 B4R0.1 CCC(=C)Br B20067 [0,0,0,0,0,0|2,0,2]=4 93 B4R0.1 CCC(=C)C H27230 [0,0,0,0,0,0|2,0,1]=3 94 B4R0.1 CCC(=O)C 22924 [0,0,0,0,0,0|1,0,2]=3 95 B4R0.1 CCC(=O)C 31069 [0,0,0,0,0,0|1,0,2]=3 96 B4R0.1 CCC(=O)C 39119 [0,0,0,0,0,0|1,0,2]=3 97 B4R0.1 CCC(=O)C L13185 [0,0,0,0,0,0|1,0,2]=3 98 B4R0.1 CCC(=O)Cl A10940 [0,0,0,0,0,0|2,0,2]=4 99 B4R0.1 CCC(=O)N A10521 [0,0,0,0,0,0|2,0,2]=4 100 B4R0.1 CCC(=O)O L04210 [0,0,0,0,0,0|2,0,1]=3 101 B4R0.1 CCC(=O)[O-] 18865 [0,0,0,0,0,0|2,0,2]=4 102 B4R0.1 CCC(=O)[O-] A14994 [0,0,0,0,0,0|2,0,2]=4 103 B4R0.1 CCC(=O)[O-] A17440 [0,0,0,0,0,0|2,0,2]=4 104 B4R0.1 CCC(=O)[O-] B23636 [0,0,0,0,0,0|2,0,2]=4 105 B4R0.1 CCC(C)Br A15069 [0,0,0,0,0,0|2,0,0]=2 106 B4R0.1 CCC(C)C 19387 [0,0,0,0,0,0|2,0,0]=2 107 B4R0.1 CCC(C)Cl B21586 [0,0,0,0,0,0|2,0,0]=2 108 B4R0.1 CCC(C)I B20619 [0,0,0,0,0,0|2,0,0]=2 109 B4R0.1 CCC(C)N A13014 [0,0,0,0,0,0|2,0,0]=2 110 B4R0.1 CCC(C)O 41871 [0,0,0,0,0,0|1,0,0]=1 111 B4R0.1 CCC(C)O 43315 [0,0,0,0,0,0|1,0,0]=1 112 B4R0.1 CCC(C)O A18658 [0,0,0,0,0,0|1,0,0]=1 113 B4R0.1 CCC(C)[O-] 30721 [0,0,0,0,0,0|1,0,1]=2 114 B4R0.1 CCC(C)[O-] 43712 [0,0,0,0,0,0|1,0,1]=2 115 B4R0.1 CCC(C)[O-] A13044 [0,0,0,0,0,0|1,0,1]=2 116 B4R0.1 CCC(C)[Zn+] H58714 [0,0,0,0,0,0|2,0,0]=2 117 B4R0.1 CCN(C)C B23992 [0,0,0,0,0,0|3,0,0]=3 118 B4R0.1 CC[C@@H](C)N L03889 [0,0,0,0,0,0|2,0,0]=2 119 B4R0.1 CC[C@@H](C)O L13983 [0,0,0,0,0,0|1,0,0]=1 120 B4R0.1 CC[C@H](C)N L10069 [0,0,0,0,0,0|2,0,0]=2 121 B4R0.1 CC[C@H](C)O L14164 [0,0,0,0,0,0|1,0,0]=1 122 B4R0.1 CC[N+](=O)[O-] A10855 [0,0,0,0,0,0|3,0,1]=4 123 B4R0.1 CN(C)C=O 13808 [0,0,0,0,0,0|2,0,2]=4 124 B4R0.1 CN(C)C=O 22915 [0,0,0,0,0,0|2,0,2]=4 125 B4R0.1 CN(C)C=O 39117 [0,0,0,0,0,0|2,0,2]=4 126 B4R0.1 CN(C)C=O 41859 [0,0,0,0,0,0|2,0,2]=4 127 B4R0.1 CN(C)C=O 43465 [0,0,0,0,0,0|2,0,2]=4 128 B4R0.1 CN(C)C=O 43997 [0,0,0,0,0,0|2,0,2]=4 129 B4R0.1 CN(C)C=O A13547 [0,0,0,0,0,0|2,0,2]=4 130 B4R0.1 CN(C)C=S B24529 [0,0,0,0,0,0|2,1,1]=4 131 B4R0.1 C[Al](C)C[Ti+] 44506 [0,0,0,0,0,0|3,0,0]=3 132 B4R0.1 C[C@@H](C#C)O L20345 [0,0,0,0,0,0|1,0,1]=2 133 B4R0.1 C[C@@H](CN)N H60753 [0,0,0,0,0,0|2,0,0]=2 134 B4R0.1 C[C@@H](CN)O L14102 [0,0,0,0,0,0|1,0,0]=1 135 B4R0.1 C[C@@H](CO)N B24916 [0,0,0,0,0,0|1,0,0]=1 136 B4R0.1 C[C@@H](CO)O B21773 [0,0,0,0,0,0|0,0,0]=0 137 B4R0.1 C[C@H](C#C)O L18880 [0,0,0,0,0,0|1,0,1]=2 138 B4R0.1 C[C@H](CN)O L14101 [0,0,0,0,0,0|1,0,0]=1 139 B4R0.1 C[C@H](CO)N L11030 [0,0,0,0,0,0|1,0,0]=1 140 B4R0.1 C[C@H](CO)O B21937 [0,0,0,0,0,0|0,0,0]=0 141 B4R0.1 C[N+](=CCl)C B24172 [0,0,0,0,0,0|3,0,1]=4 142 B4R0.1 C\C=C(\C)/Br A18058 [0,0,0,0,0,0|2,0,2]=4 143 B4R0.1 [Li]C(C)CC 43028 [0,0,0,0,0,0|2,0,0]=2 144 B3R0.1 C#CCBr A16580 [1,0,0,0,0,0|1,0,2]=4 145 B3R0.1 C#CCBr L10595 [1,0,0,0,0,0|1,0,2]=4 146 B3R0.1 C#CCCl L20416 [1,0,0,0,0,0|1,0,2]=4 147 B3R0.1 C#CCN 43775 [1,0,0,0,0,0|1,0,2]=4 148 B3R0.1 C#CCN H53495 [1,0,0,0,0,0|1,0,2]=4 149 B3R0.1 C#CCO A10295 [1,0,0,0,0,0|0,0,2]=3 150 B3R0.1 C(C#N)Br A13933 [1,0,0,0,0,0|2,0,1]=4 151 B3R0.1 C(C#N)Cl A12825 [1,0,0,0,0,0|2,0,1]=4 152 B3R0.1 C(C#N)I L03634 [1,0,0,0,0,0|2,0,1]=4 153 B3R0.1 C(C#N)N 41984 [1,0,0,0,0,0|2,0,1]=4 154 B3R0.1 C(C=O)Cl A11037 [1,0,0,0,0,0|1,0,2]=4 155 B3R0.1 C(C=O)Cl L12701 [1,0,0,0,0,0|1,0,2]=4 156 B3R0.1 C(CBr)Br A12766 [1,0,0,0,0,0|2,0,0]=3 157 B3R0.1 C(CBr)Cl A12349 [1,0,0,0,0,0|2,0,0]=3 158 B3R0.1 C(CBr)N A17625 [1,0,0,0,0,0|2,0,0]=3 159 B3R0.1 C(CBr)O A10275 [1,0,0,0,0,0|1,0,0]=2 160 B3R0.1 C(CCl)Cl 22918 [1,0,0,0,0,0|2,0,0]=3 161 B3R0.1 C(CCl)Cl 32462 [1,0,0,0,0,0|2,0,0]=3 162 B3R0.1 C(CCl)Cl 39121 [1,0,0,0,0,0|2,0,0]=3 163 B3R0.1 C(CCl)Cl A12775 [1,0,0,0,0,0|2,0,0]=3 164 B3R0.1 C(CCl)Cl H37962 [1,0,0,0,0,0|2,0,0]=3 165 B3R0.1 C(CCl)N A14455 [1,0,0,0,0,0|2,0,0]=3 166 B3R0.1 C(CCl)O 36636 [1,0,0,0,0,0|1,0,0]=2 167 B3R0.1 C(CF)O L01735 [1,0,0,0,0,0|1,0,0]=2 168 B3R0.1 C(CI)Cl L10742 [1,0,0,0,0,0|2,0,0]=3 169 B3R0.1 C(CI)I L03019 [1,0,0,0,0,0|2,0,0]=3 170 B3R0.1 C(CI)O A14658 [1,0,0,0,0,0|1,0,0]=2 171 B3R0.1 C(CN)N 10496 [1,0,0,0,0,0|2,0,0]=3 172 B3R0.1 C(CN)N 10497 [1,0,0,0,0,0|2,0,0]=3 173 B3R0.1 C(CN)N 10553 [1,0,0,0,0,0|2,0,0]=3 174 B3R0.1 C(CN)N 24127 [1,0,0,0,0,0|2,0,0]=3 175 B3R0.1 C(CN)N 39280 [1,0,0,0,0,0|2,0,0]=3 176 B3R0.1 C(CN)N 39667 [1,0,0,0,0,0|2,0,0]=3 177 B3R0.1 C(CN)N A12132 [1,0,0,0,0,0|2,0,0]=3 178 B3R0.1 C(CN)N A13563 [1,0,0,0,0,0|2,0,0]=3 179 B3R0.1 C(CN)N A17211 [1,0,0,0,0,0|2,0,0]=3 180 B3R0.1 C(CN)N L12401 [1,0,0,0,0,0|2,0,0]=3 181 B3R0.1 C(CO)N 22793 [1,0,0,0,0,0|1,0,0]=2 182 B3R0.1 C(CO)N 36260 [1,0,0,0,0,0|1,0,0]=2 183 B3R0.1 C(CO)N A11697 [1,0,0,0,0,0|1,0,0]=2 184 B3R0.1 C(CO)N L14322 [1,0,0,0,0,0|1,0,0]=2 185 B3R0.1 C(CO)O 44529 [1,0,0,0,0,0|0,0,0]=1 186 B3R0.1 C(CO)O A11591 [1,0,0,0,0,0|0,0,0]=1 187 B3R0.1 C(CP)P 39279 [1,0,0,0,0,0|2,0,0]=3 188 B3R0.1 C(CS)N A14377 [1,0,0,0,0,0|1,1,0]=3 189 B3R0.1 C(CS)O A15890 [1,0,0,0,0,0|0,1,0]=2 190 B3R0.1 C(CS)S L12865 [1,0,0,0,0,0|0,2,0]=3 191 B3R0.1 C=CCBr A11766 [1,0,0,0,0,0|1,0,2]=4 192 B3R0.1 C=CCCl A14330 [1,0,0,0,0,0|1,0,2]=4 193 B3R0.1 C=CCI A11822 [1,0,0,0,0,0|1,0,2]=4 194 B3R0.1 C=CCN L07162 [1,0,0,0,0,0|1,0,2]=4 195 B3R0.1 C=CCO A15026 [1,0,0,0,0,0|0,0,2]=3 196 B3R0.1 C=CCS A13616 [1,0,0,0,0,0|0,1,2]=4 197 B3R0.1 C=CC[Mg+] H51170 [1,0,0,0,0,0|1,0,2]=4 198 B3R0.1 C=CC[Zn+] H58012 [1,0,0,0,0,0|1,0,2]=4 199 B3R0.1 CC#CC A13823 [1,0,0,0,0,0|1,0,2]=4 200 B3R0.1 CCC#N A13203 [1,0,0,0,0,0|1,0,1]=3 201 B3R0.1 CCC=O A16146 [1,0,0,0,0,0|0,0,2]=3 202 B3R0.1 CCCBr A10461 [1,0,0,0,0,0|1,0,0]=2 203 B3R0.1 CCCI A14388 [1,0,0,0,0,0|1,0,0]=2 204 B3R0.1 CCCN 36635 [1,0,0,0,0,0|1,0,0]=2 205 B3R0.1 CCCN A11606 [1,0,0,0,0,0|1,0,0]=2 206 B3R0.1 CCCO 22932 [1,0,0,0,0,0|0,0,0]=1 207 B3R0.1 CCCO 22933 [1,0,0,0,0,0|0,0,0]=1 208 B3R0.1 CCCO 41465 [1,0,0,0,0,0|0,0,0]=1 209 B3R0.1 CCCO 41842 [1,0,0,0,0,0|0,0,0]=1 210 B3R0.1 CCCO 43848 [1,0,0,0,0,0|0,0,0]=1 211 B3R0.1 CCCO A19902 [1,0,0,0,0,0|0,0,0]=1 212 B3R0.1 CCCS 43420 [1,0,0,0,0,0|0,1,0]=2 213 B3R0.1 CCC[Mg+] H51162 [1,0,0,0,0,0|1,0,0]=2 214 B3R0.1 CCC[O-] 22989 [1,0,0,0,0,0|0,0,1]=2 215 B3R0.1 CCC[O-] 36571 [1,0,0,0,0,0|0,0,1]=2 216 B3R0.1 CCC[O-] 44673 [1,0,0,0,0,0|0,0,1]=2 217 B3R0.1 CCC[O-] 44770 [1,0,0,0,0,0|0,0,1]=2 218 B3R0.1 CCC[S-] H66135 [1,0,0,0,0,0|0,1,0]=2 219 B3R0.1 CCC[Zn+] H58119 [1,0,0,0,0,0|1,0,0]=2 220 B3R0.1 CCNC L04372 [1,0,0,0,0,0|2,0,0]=3 221 B3R0.1 CCSC L02859 [1,0,0,0,0,0|2,0,0]=3 222 B3R0.1 CN=C=O L19476 [1,0,0,0,0,0|1,0,2]=4 223 B3R0.1 CN=C=S A11757 [1,0,0,0,0,0|1,1,1]=4 224 B3R0.1 CN=C=S L19464 [1,0,0,0,0,0|1,1,1]=4 225 B3R0.1 CNC=O L03908 [1,0,0,0,0,0|1,0,2]=4 226 B3R0.1 CNOC A17469 [1,0,0,0,0,0|3,0,0]=4 227 B3R0.1 COC=O A15850 [1,0,0,0,0,0|1,0,2]=4 228 B3R0.1 COCBr L09837 [1,0,0,0,0,0|2,0,0]=3 229 B3R0.1 CSC#N H27879 [1,0,0,0,0,0|2,0,1]=4 230 B3R0.1 CSCCl L10858 [1,0,0,0,0,0|2,0,0]=3 231 B3R0.1 CSSC L09679 [1,0,0,0,0,0|3,0,0]=4 232 B3R0.1 C[Se][Se]C 68119 [1,0,0,0,0,0|3,0,0]=4 233 B3R0.1 C\C=N\O A10640 [1,0,0,0,0,0|1,0,1]=3 234 B3R0.2 B(C)(C)Br 33552 [1,0,0,0,0,0|2,0,0]=3 235 B3R0.2 B(C)(C)C L14994 [1,0,0,0,0,0|2,0,0]=3 236 B3R0.2 B(C)(O)O L15589 [1,0,0,0,0,0|1,0,0]=2 237 B3R0.2 B(O)(O)O A10896 [1,0,0,0,0,0|2,0,0]=3 238 B3R0.2 B(O)(O)O A16624 [1,0,0,0,0,0|2,0,0]=3 239 B3R0.2 C(=O)(O)[O-] 44042 [1,0,0,0,0,0|1,0,2]=4 240 B3R0.2 C(=O)(O)[O-] 45082 [1,0,0,0,0,0|1,0,2]=4 241 B3R0.2 C(=O)(O)[O-] A12429 [1,0,0,0,0,0|1,0,2]=4 242 B3R0.2 C(=O)(O)[O-] A12483 [1,0,0,0,0,0|1,0,2]=4 243 B3R0.2 C(=O)(O)[O-] A14590 [1,0,0,0,0,0|1,0,2]=4 244 B3R0.2 C(=O)(O)[O-] A17005 [1,0,0,0,0,0|1,0,2]=4 245 B3R0.2 C(=O)(O)[O-] A18566 [1,0,0,0,0,0|1,0,2]=4 246 B3R0.2 C(Br)(Br)Br A11904 [1,0,0,0,0,0|3,0,0]=4 247 B3R0.2 C(Cl)(Br)Br A16938 [1,0,0,0,0,0|3,0,0]=4 248 B3R0.2 C(Cl)(Cl)Br A11292 [1,0,0,0,0,0|3,0,0]=4 249 B3R0.2 C(Cl)(Cl)Cl 22920 [1,0,0,0,0,0|3,0,0]=4 250 B3R0.2 C(Cl)(Cl)Cl 32442 [1,0,0,0,0,0|3,0,0]=4 251 B3R0.2 C(Cl)(Cl)Cl 32614 [1,0,0,0,0,0|3,0,0]=4 252 B3R0.2 C(Cl)(Cl)Cl 40974 [1,0,0,0,0,0|3,0,0]=4 253 B3R0.2 C(Cl)(Cl)Cl 43685 [1,0,0,0,0,0|3,0,0]=4 254 B3R0.2 C(Cl)(Cl)Cl L13200 [1,0,0,0,0,0|3,0,0]=4 255 B3R0.2 C(Cl)(Cl)Cl L14759 [1,0,0,0,0,0|3,0,0]=4 256 B3R0.2 C(I)(I)I A13664 [1,0,0,0,0,0|3,0,0]=4 257 B3R0.2 CC(=C)Br L14229 [1,0,0,0,0,0|1,0,2]=4 258 B3R0.2 CC(=C)Cl L12374 [1,0,0,0,0,0|1,0,2]=4 259 B3R0.2 CC(=N)N A16091 [1,0,0,0,0,0|2,0,1]=4 260 B3R0.2 CC(=O)Br A12485 [1,0,0,0,0,0|1,0,2]=4 261 B3R0.2 CC(=O)C 19392 [1,0,0,0,0,0|0,0,2]=3 262 B3R0.2 CC(=O)C 22928 [1,0,0,0,0,0|0,0,2]=3 263 B3R0.2 CC(=O)C 30698 [1,0,0,0,0,0|0,0,2]=3 264 B3R0.2 CC(=O)C 32451 [1,0,0,0,0,0|0,0,2]=3 265 B3R0.2 CC(=O)C 43053 [1,0,0,0,0,0|0,0,2]=3 266 B3R0.2 CC(=O)C L10407 [1,0,0,0,0,0|0,0,2]=3 267 B3R0.2 CC(=O)Cl 43262 [1,0,0,0,0,0|1,0,2]=4 268 B3R0.2 CC(=O)Cl H32616 [1,0,0,0,0,0|1,0,2]=4 269 B3R0.2 CC(=O)Cl L14013 [1,0,0,0,0,0|1,0,2]=4 270 B3R0.2 CC(=O)N A12589 [1,0,0,0,0,0|1,0,2]=4 271 B3R0.2 CC(=O)O 10994 [1,0,0,0,0,0|0,0,2]=3 272 B3R0.2 CC(=O)O 33252 [1,0,0,0,0,0|0,0,2]=3 273 B3R0.2 CC(=O)O 35566 [1,0,0,0,0,0|0,0,2]=3 274 B3R0.2 CC(=O)O 35567 [1,0,0,0,0,0|0,0,2]=3 275 B3R0.2 CC(=O)O 35569 [1,0,0,0,0,0|0,0,2]=3 276 B3R0.2 CC(=O)O 35572 [1,0,0,0,0,0|0,0,2]=3 277 B3R0.2 CC(=O)O 36289 [1,0,0,0,0,0|0,0,2]=3 278 B3R0.2 CC(=O)O 39745 [1,0,0,0,0,0|0,0,2]=3 279 B3R0.2 CC(=O)O 88556 [1,0,0,0,0,0|0,0,2]=3 280 B3R0.2 CC(=O)O A11158 [1,0,0,0,0,0|0,0,2]=3 281 B3R0.2 CC(=O)[O-] 10516 [1,0,0,0,0,0|0,0,3]=4 282 B3R0.2 CC(=O)[O-] 11660 [1,0,0,0,0,0|0,0,3]=4 283 B3R0.2 CC(=O)[O-] 12223 [1,0,0,0,0,0|0,0,3]=4 284 B3R0.2 CC(=O)[O-] 12225 [1,0,0,0,0,0|0,0,3]=4 285 B3R0.2 CC(=O)[O-] 12273 [1,0,0,0,0,0|0,0,3]=4 286 B3R0.2 CC(=O)[O-] 12351 [1,0,0,0,0,0|0,0,3]=4 287 B3R0.2 CC(=O)[O-] 12890 [1,0,0,0,0,0|0,0,3]=4 288 B3R0.2 CC(=O)[O-] 14703 [1,0,0,0,0,0|0,0,3]=4 289 B3R0.2 CC(=O)[O-] 17574 [1,0,0,0,0,0|0,0,3]=4 290 B3R0.2 CC(=O)[O-] 18239 [1,0,0,0,0,0|0,0,3]=4 291 B3R0.2 CC(=O)[O-] 19417 [1,0,0,0,0,0|0,0,3]=4 292 B3R0.2 CC(=O)[O-] 22361 [1,0,0,0,0,0|0,0,3]=4 293 B3R0.2 CC(=O)[O-] 30519 [1,0,0,0,0,0|0,0,3]=4 294 B3R0.2 CC(=O)[O-] 39610 [1,0,0,0,0,0|0,0,3]=4 295 B3R0.2 CC(=O)[O-] 39742 [1,0,0,0,0,0|0,0,3]=4 296 B3R0.2 CC(=O)[O-] 41685 [1,0,0,0,0,0|0,0,3]=4 297 B3R0.2 CC(=O)[O-] 43004 [1,0,0,0,0,0|0,0,3]=4 298 B3R0.2 CC(=O)[O-] 43086 [1,0,0,0,0,0|0,0,3]=4 299 B3R0.2 CC(=O)[O-] 44056 [1,0,0,0,0,0|0,0,3]=4 300 B3R0.2 CC(=O)[O-] 44344 [1,0,0,0,0,0|0,0,3]=4 301 B3R0.2 CC(=O)[O-] 44345 [1,0,0,0,0,0|0,0,3]=4 302 B3R0.2 CC(=O)[O-] 44433 [1,0,0,0,0,0|0,0,3]=4 303 B3R0.2 CC(=O)[O-] 44434 [1,0,0,0,0,0|0,0,3]=4 304 B3R0.2 CC(=O)[O-] 47050 [1,0,0,0,0,0|0,0,3]=4 305 B3R0.2 CC(=O)[O-] 87657 [1,0,0,0,0,0|0,0,3]=4 306 B3R0.2 CC(=O)[O-] A10316 [1,0,0,0,0,0|0,0,3]=4 307 B3R0.2 CC(=O)[O-] A11620 [1,0,0,0,0,0|0,0,3]=4 308 B3R0.2 CC(=O)[O-] A11746 [1,0,0,0,0,0|0,0,3]=4 309 B3R0.2 CC(=O)[O-] A12478 [1,0,0,0,0,0|0,0,3]=4 310 B3R0.2 CC(=O)[O-] A12909 [1,0,0,0,0,0|0,0,3]=4 311 B3R0.2 CC(=O)[O-] A13026 [1,0,0,0,0,0|0,0,3]=4 312 B3R0.2 CC(=O)[O-] A13184 [1,0,0,0,0,0|0,0,3]=4 313 B3R0.2 CC(=O)[O-] A14947 [1,0,0,0,0,0|0,0,3]=4 314 B3R0.2 CC(=O)[O-] A15551 [1,0,0,0,0,0|0,0,3]=4 315 B3R0.2 CC(=O)[O-] A16149 [1,0,0,0,0,0|0,0,3]=4 316 B3R0.2 CC(=O)[O-] A16203 [1,0,0,0,0,0|0,0,3]=4 317 B3R0.2 CC(=O)[O-] A16230 [1,0,0,0,0,0|0,0,3]=4 318 B3R0.2 CC(=O)[O-] A16321 [1,0,0,0,0,0|0,0,3]=4 319 B3R0.2 CC(=O)[O-] A16343 [1,0,0,0,0,0|0,0,3]=4 320 B3R0.2 CC(=O)[O-] A16763 [1,0,0,0,0,0|0,0,3]=4 321 B3R0.2 CC(=O)[O-] A17388 [1,0,0,0,0,0|0,0,3]=4 322 B3R0.2 CC(=O)[O-] A17414 [1,0,0,0,0,0|0,0,3]=4 323 B3R0.2 CC(=O)[O-] A17921 [1,0,0,0,0,0|0,0,3]=4 324 B3R0.2 CC(=O)[O-] A18069 [1,0,0,0,0,0|0,0,3]=4 325 B3R0.2 CC(=O)[O-] A18271 [1,0,0,0,0,0|0,0,3]=4 326 B3R0.2 CC(=O)[O-] A18374 [1,0,0,0,0,0|0,0,3]=4 327 B3R0.2 CC(=O)[O-] B23218 [1,0,0,0,0,0|0,0,3]=4 328 B3R0.2 CC(=O)[O-] B23615 [1,0,0,0,0,0|0,0,3]=4 329 B3R0.2 CC(=O)[O-] B23708 [1,0,0,0,0,0|0,0,3]=4 330 B3R0.2 CC(=O)[O-] H33734 [1,0,0,0,0,0|0,0,3]=4 331 B3R0.2 CC(=O)[O-] H34028 [1,0,0,0,0,0|0,0,3]=4 332 B3R0.2 CC(=O)[O-] L15152 [1,0,0,0,0,0|0,0,3]=4 333 B3R0.2 CC(=S)N 30638 [1,0,0,0,0,0|1,1,1]=4 334 B3R0.2 CC(=S)N A12926 [1,0,0,0,0,0|1,1,1]=4 335 B3R0.2 CC(=S)O L03305 [1,0,0,0,0,0|0,1,1]=3 336 B3R0.2 CC(=S)[O-] L05405 [1,0,0,0,0,0|0,1,2]=4 337 B3R0.2 CC(C)Br A12944 [1,0,0,0,0,0|1,0,0]=2 338 B3R0.2 CC(C)Cl L04535 [1,0,0,0,0,0|1,0,0]=2 339 B3R0.2 CC(C)I A15066 [1,0,0,0,0,0|1,0,0]=2 340 B3R0.2 CC(C)N A15044 [1,0,0,0,0,0|1,0,0]=2 341 B3R0.2 CC(C)O 19397 [1,0,0,0,0,0|0,0,0]=1 342 B3R0.2 CC(C)O 22906 [1,0,0,0,0,0|0,0,0]=1 343 B3R0.2 CC(C)O 36644 [1,0,0,0,0,0|0,0,0]=1 344 B3R0.2 CC(C)O 39194 [1,0,0,0,0,0|0,0,0]=1 345 B3R0.2 CC(C)O 40983 [1,0,0,0,0,0|0,0,0]=1 346 B3R0.2 CC(C)O 41463 [1,0,0,0,0,0|0,0,0]=1 347 B3R0.2 CC(C)O 41840 [1,0,0,0,0,0|0,0,0]=1 348 B3R0.2 CC(C)O 45648 [1,0,0,0,0,0|0,0,0]=1 349 B3R0.2 CC(C)O 45657 [1,0,0,0,0,0|0,0,0]=1 350 B3R0.2 CC(C)O 86118 [1,0,0,0,0,0|0,0,0]=1 351 B3R0.2 CC(C)O L10181 [1,0,0,0,0,0|0,0,0]=1 352 B3R0.2 CC(C)S 43422 [1,0,0,0,0,0|0,1,0]=2 353 B3R0.2 CC(C)[Mg+] 47257 [1,0,0,0,0,0|1,0,0]=2 354 B3R0.2 CC(C)[Mg+] 47266 [1,0,0,0,0,0|1,0,0]=2 355 B3R0.2 CC(C)[Mg+] 47273 [1,0,0,0,0,0|1,0,0]=2 356 B3R0.2 CC(C)[Mg+] H51155 [1,0,0,0,0,0|1,0,0]=2 357 B3R0.2 CC(C)[Mg+] H54840 [1,0,0,0,0,0|1,0,0]=2 358 B3R0.2 CC(C)[O-] 14007 [1,0,0,0,0,0|0,0,1]=2 359 B3R0.2 CC(C)[O-] 14477 [1,0,0,0,0,0|0,0,1]=2 360 B3R0.2 CC(C)[O-] 14481 [1,0,0,0,0,0|0,0,1]=2 361 B3R0.2 CC(C)[O-] 14523 [1,0,0,0,0,0|0,0,1]=2 362 B3R0.2 CC(C)[O-] 14524 [1,0,0,0,0,0|0,0,1]=2 363 B3R0.2 CC(C)[O-] 14616 [1,0,0,0,0,0|0,0,1]=2 364 B3R0.2 CC(C)[O-] 16352 [1,0,0,0,0,0|0,0,1]=2 365 B3R0.2 CC(C)[O-] 22982 [1,0,0,0,0,0|0,0,1]=2 366 B3R0.2 CC(C)[O-] 35794 [1,0,0,0,0,0|0,0,1]=2 367 B3R0.2 CC(C)[O-] 35821 [1,0,0,0,0,0|0,0,1]=2 368 B3R0.2 CC(C)[O-] 36563 [1,0,0,0,0,0|0,0,1]=2 369 B3R0.2 CC(C)[O-] 36565 [1,0,0,0,0,0|0,0,1]=2 370 B3R0.2 CC(C)[O-] 36572 [1,0,0,0,0,0|0,0,1]=2 371 B3R0.2 CC(C)[O-] 36573 [1,0,0,0,0,0|0,0,1]=2 372 B3R0.2 CC(C)[O-] 36579 [1,0,0,0,0,0|0,0,1]=2 373 B3R0.2 CC(C)[O-] 36582 [1,0,0,0,0,0|0,0,1]=2 374 B3R0.2 CC(C)[O-] 36583 [1,0,0,0,0,0|0,0,1]=2 375 B3R0.2 CC(C)[O-] 36585 [1,0,0,0,0,0|0,0,1]=2 376 B3R0.2 CC(C)[O-] 36589 [1,0,0,0,0,0|0,0,1]=2 377 B3R0.2 CC(C)[O-] 36590 [1,0,0,0,0,0|0,0,1]=2 378 B3R0.2 CC(C)[O-] 36591 [1,0,0,0,0,0|0,0,1]=2 379 B3R0.2 CC(C)[O-] 36593 [1,0,0,0,0,0|0,0,1]=2 380 B3R0.2 CC(C)[O-] 36594 [1,0,0,0,0,0|0,0,1]=2 381 B3R0.2 CC(C)[O-] 36613 [1,0,0,0,0,0|0,0,1]=2 382 B3R0.2 CC(C)[O-] 39153 [1,0,0,0,0,0|0,0,1]=2 383 B3R0.2 CC(C)[O-] 39159 [1,0,0,0,0,0|0,0,1]=2 384 B3R0.2 CC(C)[O-] 39162 [1,0,0,0,0,0|0,0,1]=2 385 B3R0.2 CC(C)[O-] 39165 [1,0,0,0,0,0|0,0,1]=2 386 B3R0.2 CC(C)[O-] 39167 [1,0,0,0,0,0|0,0,1]=2 387 B3R0.2 CC(C)[O-] 39320 [1,0,0,0,0,0|0,0,1]=2 388 B3R0.2 CC(C)[O-] 39579 [1,0,0,0,0,0|0,0,1]=2 389 B3R0.2 CC(C)[O-] 40038 [1,0,0,0,0,0|0,0,1]=2 390 B3R0.2 CC(C)[O-] 40247 [1,0,0,0,0,0|0,0,1]=2 391 B3R0.2 CC(C)[O-] 40520 [1,0,0,0,0,0|0,0,1]=2 392 B3R0.2 CC(C)[O-] 41046 [1,0,0,0,0,0|0,0,1]=2 393 B3R0.2 CC(C)[O-] 41047 [1,0,0,0,0,0|0,0,1]=2 394 B3R0.2 CC(C)[O-] 41262 [1,0,0,0,0,0|0,0,1]=2 395 B3R0.2 CC(C)[O-] 41269 [1,0,0,0,0,0|0,0,1]=2 396 B3R0.2 CC(C)[O-] 41271 [1,0,0,0,0,0|0,0,1]=2 397 B3R0.2 CC(C)[O-] 41311 [1,0,0,0,0,0|0,0,1]=2 398 B3R0.2 CC(C)[O-] 41338 [1,0,0,0,0,0|0,0,1]=2 399 B3R0.2 CC(C)[O-] 41377 [1,0,0,0,0,0|0,0,1]=2 400 B3R0.2 CC(C)[O-] 41484 [1,0,0,0,0,0|0,0,1]=2 401 B3R0.2 CC(C)[O-] 41836 [1,0,0,0,0,0|0,0,1]=2 402 B3R0.2 CC(C)[O-] 41843 [1,0,0,0,0,0|0,0,1]=2 403 B3R0.2 CC(C)[O-] 41971 [1,0,0,0,0,0|0,0,1]=2 404 B3R0.2 CC(C)[O-] 42098 [1,0,0,0,0,0|0,0,1]=2 405 B3R0.2 CC(C)[O-] 42277 [1,0,0,0,0,0|0,0,1]=2 406 B3R0.2 CC(C)[O-] 42302 [1,0,0,0,0,0|0,0,1]=2 407 B3R0.2 CC(C)[O-] 42375 [1,0,0,0,0,0|0,0,1]=2 408 B3R0.2 CC(C)[O-] 42376 [1,0,0,0,0,0|0,0,1]=2 409 B3R0.2 CC(C)[O-] 42673 [1,0,0,0,0,0|0,0,1]=2 410 B3R0.2 CC(C)[O-] 42810 [1,0,0,0,0,0|0,0,1]=2 411 B3R0.2 CC(C)[O-] 42839 [1,0,0,0,0,0|0,0,1]=2 412 B3R0.2 CC(C)[O-] 42840 [1,0,0,0,0,0|0,0,1]=2 413 B3R0.2 CC(C)[O-] 42930 [1,0,0,0,0,0|0,0,1]=2 414 B3R0.2 CC(C)[O-] 43024 [1,0,0,0,0,0|0,0,1]=2 415 B3R0.2 CC(C)[O-] 43175 [1,0,0,0,0,0|0,0,1]=2 416 B3R0.2 CC(C)[O-] 43938 [1,0,0,0,0,0|0,0,1]=2 417 B3R0.2 CC(C)[O-] 44451 [1,0,0,0,0,0|0,0,1]=2 418 B3R0.2 CC(C)[O-] 44468 [1,0,0,0,0,0|0,0,1]=2 419 B3R0.2 CC(C)[O-] 44474 [1,0,0,0,0,0|0,0,1]=2 420 B3R0.2 CC(C)[O-] 44562 [1,0,0,0,0,0|0,0,1]=2 421 B3R0.2 CC(C)[O-] 44873 [1,0,0,0,0,0|0,0,1]=2 422 B3R0.2 CC(C)[O-] 45480 [1,0,0,0,0,0|0,0,1]=2 423 B3R0.2 CC(C)[O-] 45651 [1,0,0,0,0,0|0,0,1]=2 424 B3R0.2 CC(C)[O-] 77115 [1,0,0,0,0,0|0,0,1]=2 425 B3R0.2 CC(C)[O-] 89446 [1,0,0,0,0,0|0,0,1]=2 426 B3R0.2 CC(C)[O-] 89798 [1,0,0,0,0,0|0,0,1]=2 427 B3R0.2 CC(C)[O-] A13703 [1,0,0,0,0,0|0,0,1]=2 428 B3R0.2 CC(C)[Zn+] H58536 [1,0,0,0,0,0|1,0,0]=2 429 B3R0.2 CC(Cl)Br L01910 [1,0,0,0,0,0|2,0,0]=3 430 B3R0.2 CN(C)C 42964 [1,0,0,0,0,0|2,0,0]=3 431 B3R0.2 CN(C)C 43282 [1,0,0,0,0,0|2,0,0]=3 432 B3R0.2 CN(C)C H27324 [1,0,0,0,0,0|2,0,0]=3 433 B3R0.2 CN(C)C H32899 [1,0,0,0,0,0|2,0,0]=3 434 B3R0.2 CN(C)C L00302 [1,0,0,0,0,0|2,0,0]=3 435 B3R0.2 CN(C)C L04718 [1,0,0,0,0,0|2,0,0]=3 436 B3R0.2 CP(C)C 30143 [1,0,0,0,0,0|2,0,0]=3 437 B3R0.2 CP(C)Cl 30160 [1,0,0,0,0,0|2,0,0]=3 438 B3R0.2 CP(Cl)Cl 30211 [1,0,0,0,0,0|3,0,0]=4 439 B3R0.2 CS(=O)C 22914 [1,0,0,0,0,0|1,0,1]=3 440 B3R0.2 CS(=O)C 32434 [1,0,0,0,0,0|1,0,1]=3 441 B3R0.2 CS(=O)C 36480 [1,0,0,0,0,0|1,0,1]=3 442 B3R0.2 CS(=O)C 42780 [1,0,0,0,0,0|1,0,1]=3 443 B3R0.2 CS(=O)C 43998 [1,0,0,0,0,0|1,0,1]=3 444 B3R0.2 CS(=O)C A13280 [1,0,0,0,0,0|1,0,1]=3 445 B3R0.2 CS(=O)[O-] L11360 [1,0,0,0,0,0|1,0,2]=4 446 B3R0.2 C[Al](C)C 42836 [1,0,0,0,0,0|2,0,0]=3 447 B3R0.2 C[N+](=C)C A15146 [1,0,0,0,0,0|2,0,0]=3 448 B3R0.2 C[N+](=O)[O-] A11806 [1,0,0,0,0,0|1,0,2]=4 449 B3R0.2 C[Pt+](C)C 39286 [1,0,0,0,0,0|2,0,0]=3 450 B3R0.2 C[S+](C)C A12639 [1,0,0,0,0,0|2,0,0]=3 451 B3R0.2 C[S+](C)C B25098 [1,0,0,0,0,0|2,0,0]=3 452 B3R0.2 C[SiH](C)Cl A13113 [1,0,0,0,0,0|1,1,0]=3 453 B3R0.2 C[SiH](Cl)Cl 14079 [1,0,0,0,0,0|2,1,0]=4 454 B3R0.2 C[Sn+](C)C 71153 [1,0,0,0,0,0|2,0,0]=3 455 B3R0.2 C[Sn+](C)C 71166 [1,0,0,0,0,0|2,0,0]=3 456 B3R0.2 C[Sn+](C)C 71167 [1,0,0,0,0,0|2,0,0]=3 457 B3R0.2 C[Sn+](C)C H59406 [1,0,0,0,0,0|2,0,0]=3 458 B3R0.2 OI(=O)=O A11925 [1,0,0,0,0,0|2,0,1]=4 459 B3R0.2 OP(=O)=O B20932 [1,0,0,0,0,0|2,0,1]=4 460 B3R0.2 OP(O)O A11189 [1,0,0,0,0,0|2,0,0]=3 461 B3R0.2 OS(=O)[O-] A16194 [1,0,0,0,0,0|2,0,1]=4 462 B3R0.2 O[Se](=O)[O-] A12173 [1,0,0,0,0,0|2,0,1]=4 463 B5R0.1 B(CCC)(O)O L19965 [0,1,0,0,0,0|3,0,0]=4 464 B5R0.1 C(C#N)C(=O)O A11045 [0,1,0,0,0,0|2,0,1]=4 465 B5R0.1 C(CBr)C(=O)O A11573 [0,1,0,0,0,0|2,0,1]=4 466 B5R0.1 C(CCl)C(=O)O B21744 [0,1,0,0,0,0|2,0,1]=4 467 B5R0.1 C(CI)C(=O)O L02655 [0,1,0,0,0,0|2,0,1]=4 468 B5R0.1 C(CN)C(=O)O A16665 [0,1,0,0,0,0|2,0,1]=4 469 B5R0.1 C(CO)[N+](=O)[O-] A17681 [0,1,0,0,0,0|2,0,1]=4 470 B5R0.1 C(CS)C(=O)O A13261 [0,1,0,0,0,0|1,1,1]=4 471 B5R0.1 C=C(CCO)Br H34119 [0,1,0,0,0,0|1,0,2]=4 472 B5R0.1 C=CCC(=O)O L07557 [0,1,0,0,0,0|2,0,1]=4 473 B5R0.1 CC#CC(C)C H53442 [0,1,0,0,0,0|2,0,1]=4 474 B5R0.1 CC(=C)CCO B23398 [0,1,0,0,0,0|1,0,1]=3 475 B5R0.1 CC(=CCBr)C A13388 [0,1,0,0,0,0|2,0,1]=4 476 B5R0.1 CC(=CCCl)C A16545 [0,1,0,0,0,0|2,0,1]=4 477 B5R0.1 CC(=CCO)C A16089 [0,1,0,0,0,0|1,0,1]=3 478 B5R0.1 CC(=CCO)C H36436 [0,1,0,0,0,0|1,0,1]=3 479 B5R0.1 CC(=O)CC#N H64536 [0,1,0,0,0,0|1,0,2]=4 480 B5R0.1 CC(=O)CCO L11456 [0,1,0,0,0,0|0,0,2]=3 481 B5R0.1 CC(=O)CSC B24149 [0,1,0,0,0,0|0,1,2]=4 482 B5R0.1 CC(=O)NCO A13820 [0,1,0,0,0,0|0,0,2]=3 483 B5R0.1 CC(=O)OCBr H56755 [0,1,0,0,0,0|1,0,2]=4 484 B5R0.1 CC(C)CC#C L05537 [0,1,0,0,0,0|2,0,0]=3 485 B5R0.1 CC(C)CC=C 33029 [0,1,0,0,0,0|2,0,0]=3 486 B5R0.1 CC(C)CC=C L03372 [0,1,0,0,0,0|2,0,0]=3 487 B5R0.1 CC(C)CC=O A19640 [0,1,0,0,0,0|1,0,1]=3 488 B5R0.1 CC(C)CCBr A14492 [0,1,0,0,0,0|2,0,0]=3 489 B5R0.1 CC(C)CCCl L11371 [0,1,0,0,0,0|2,0,0]=3 490 B5R0.1 CC(C)CCI L05194 [0,1,0,0,0,0|2,0,0]=3 491 B5R0.1 CC(C)CCN L02260 [0,1,0,0,0,0|2,0,0]=3 492 B5R0.1 CC(C)CCO 36716 [0,1,0,0,0,0|1,0,0]=2 493 B5R0.1 CC(C)CCO L13660 [0,1,0,0,0,0|1,0,0]=2 494 B5R0.1 CC(C)CCS L09661 [0,1,0,0,0,0|1,1,0]=3 495 B5R0.1 CC(C)CC[Zn+] H58436 [0,1,0,0,0,0|2,0,0]=3 496 B5R0.1 CC(C)CNC 42947 [0,1,0,0,0,0|2,0,0]=3 497 B5R0.1 CC(C)CNN H64287 [0,1,0,0,0,0|2,0,0]=3 498 B5R0.1 CC(C)N=C=O L16105 [0,1,0,0,0,0|1,0,2]=4 499 B5R0.1 CC(C)N=C=S A11641 [0,1,0,0,0,0|1,1,1]=4 500 B5R0.1 CC(C)OC=O A17222 [0,1,0,0,0,0|1,0,2]=4 501 B5R0.1 CC(CC#C)O L02752 [0,1,0,0,0,0|1,0,0]=2 502 B5R0.1 CC(CC=C)O B20208 [0,1,0,0,0,0|1,0,0]=2 503 B5R0.1 CC(CCBr)Br B24123 [0,1,0,0,0,0|2,0,0]=3 504 B5R0.1 CC(CCO)O A11684 [0,1,0,0,0,0|0,0,0]=1 505 B5R0.1 CC(COC)O 41547 [0,1,0,0,0,0|0,0,0]=1 506 B5R0.1 CC(COC)O L12694 [0,1,0,0,0,0|0,0,0]=1 507 B5R0.1 CC(COC)[O-] 41257 [0,1,0,0,0,0|0,0,1]=2 508 B5R0.1 CCCC(=C)C H53373 [0,1,0,0,0,0|2,0,1]=4 509 B5R0.1 CCCC(=O)C L13262 [0,1,0,0,0,0|1,0,2]=4 510 B5R0.1 CCCC(=O)O L13189 [0,1,0,0,0,0|2,0,1]=4 511 B5R0.1 CCCC(C)Br A17205 [0,1,0,0,0,0|2,0,0]=3 512 B5R0.1 CCCC(C)C L03001 [0,1,0,0,0,0|2,0,0]=3 513 B5R0.1 CCCC(C)O B21217 [0,1,0,0,0,0|1,0,0]=2 514 B5R0.1 CCCC(C)[Zn+] H58078 [0,1,0,0,0,0|2,0,0]=3 515 B5R0.1 CCC[C@H](C)O L09314 [0,1,0,0,0,0|1,0,0]=2 516 B5R0.1 CCNC(=O)C L10300 [0,1,0,0,0,0|1,0,2]=4 517 B5R0.1 CCNC(C)C L04089 [0,1,0,0,0,0|2,0,0]=3 518 B5R0.1 CCOC(=N)C A18618 [0,1,0,0,0,0|2,0,1]=4 519 B5R0.1 CCOC(=O)C 22912 [0,1,0,0,0,0|1,0,2]=4 520 B5R0.1 CCOC(=O)C 31344 [0,1,0,0,0,0|1,0,2]=4 521 B5R0.1 CCOC(=O)C 39177 [0,1,0,0,0,0|1,0,2]=4 522 B5R0.1 CCOC(=O)C 40977 [0,1,0,0,0,0|1,0,2]=4 523 B5R0.1 CCOC(=O)C L10925 [0,1,0,0,0,0|1,0,2]=4 524 B5R0.1 CCO[SiH](C)C L16475 [0,1,0,0,0,0|2,1,0]=4 525 B5R0.1 CCO[SiH](C)C L16476 [0,1,0,0,0,0|2,1,0]=4 526 B5R0.1 CCSC(=O)C A10680 [0,1,0,0,0,0|1,0,2]=4 527 B5R0.1 CN(C)CC#C L12336 [0,1,0,0,0,0|3,0,0]=4 528 B5R0.1 CN(C)CC#N B25085 [0,1,0,0,0,0|3,0,0]=4 529 B5R0.1 CN(C)CCCl A15134 [0,1,0,0,0,0|3,0,0]=4 530 B5R0.1 CN(C)CCN B20182 [0,1,0,0,0,0|3,0,0]=4 531 B5R0.1 CN(C)CCO B23616 [0,1,0,0,0,0|2,0,0]=3 532 B5R0.1 CNCC(=O)O A14594 [0,1,0,0,0,0|2,0,1]=4 533 B5R0.1 CNCC(=O)O B25536 [0,1,0,0,0,0|2,0,1]=4 534 B5R0.1 COCC(=O)Cl L03210 [0,1,0,0,0,0|1,0,2]=4 535 B5R0.1 COCC(=O)O B22917 [0,1,0,0,0,0|1,0,1]=3 536 B5R0.1 CSCC(=O)O B22531 [0,1,0,0,0,0|1,1,1]=4 537 B5R0.1 CSCS(=O)C L00510 [0,1,0,0,0,0|1,1,1]=4 538 B5R0.1 C[C@@H](CC=C)O B25728 [0,1,0,0,0,0|1,0,0]=2 539 B5R0.1 C[C@@H](COC)N L16325 [0,1,0,0,0,0|1,0,0]=2 540 B5R0.1 C[C@H](CC=C)O B25659 [0,1,0,0,0,0|1,0,0]=2 541 B5R0.1 C[C@H](CCO)O B25124 [0,1,0,0,0,0|0,0,0]=1 542 B5R0.1 C\C(=C\CCl)\Cl L20334 [0,1,0,0,0,0|2,0,1]=4 543 B5R0.3 C(C(=O)CBr)Br H37325 [0,1,0,0,0,0|1,0,2]=4 544 B5R0.3 C(C(=O)CCl)Cl 22302 [0,1,0,0,0,0|1,0,2]=4 545 B5R0.3 C(C(=O)CCl)Cl A14149 [0,1,0,0,0,0|1,0,2]=4 546 B5R0.3 C(C(=O)CF)F H51145 [0,1,0,0,0,0|1,0,2]=4 547 B5R0.3 C(C(C#N)Cl)Cl A17438 [0,1,0,0,0,0|2,0,1]=4 548 B5R0.3 C(C(CBr)Br)Br L03752 [0,1,0,0,0,0|2,0,0]=3 549 B5R0.3 C(C(CCl)Cl)Cl L04312 [0,1,0,0,0,0|2,0,0]=3 550 B5R0.3 C(C(CCl)Cl)O A18444 [0,1,0,0,0,0|1,0,0]=2 551 B5R0.3 C(C(CCl)O)Cl A16003 [0,1,0,0,0,0|1,0,0]=2 552 B5R0.3 C(C(CCl)O)F L17286 [0,1,0,0,0,0|1,0,0]=2 553 B5R0.3 C(C(CCl)O)O A16143 [0,1,0,0,0,0|0,0,0]=1 554 B5R0.3 C(C(CF)O)F L01646 [0,1,0,0,0,0|1,0,0]=2 555 B5R0.3 C(C(CN)O)N A19618 [0,1,0,0,0,0|1,0,0]=2 556 B5R0.3 C(C(CO)N)O B25419 [0,1,0,0,0,0|1,0,0]=2 557 B5R0.3 C(C(CO)N)O L08426 [0,1,0,0,0,0|1,0,0]=2 558 B5R0.3 C(C(CO)O)N B22672 [0,1,0,0,0,0|0,0,0]=1 559 B5R0.3 C(C(CO)O)O 32450 [0,1,0,0,0,0|0,0,0]=1 560 B5R0.3 C(C(CO)O)O 36646 [0,1,0,0,0,0|0,0,0]=1 561 B5R0.3 C(C(CO)O)O 38988 [0,1,0,0,0,0|0,0,0]=1 562 B5R0.3 C(C(CO)O)O A16205 [0,1,0,0,0,0|0,0,0]=1 563 B5R0.3 C(C(CO)O)O J61059 [0,1,0,0,0,0|0,0,0]=1 564 B5R0.3 C(C(CO)O)O J62399 [0,1,0,0,0,0|0,0,0]=1 565 B5R0.3 C(C(CO)O)O J64719 [0,1,0,0,0,0|0,0,0]=1 566 B5R0.3 C(C(CS)O)O A18948 [0,1,0,0,0,0|0,0,0]=1 567 B5R0.3 C(C(CS)S)O L03953 [0,1,0,0,0,0|0,1,0]=2 568 B5R0.3 C([C@@H](CCl)O)O L18556 [0,1,0,0,0,0|0,0,0]=1 569 B5R0.3 C([C@@H](CO)O)N H26743 [0,1,0,0,0,0|0,0,0]=1 570 B5R0.3 C([C@H](CCl)O)O L18555 [0,1,0,0,0,0|0,0,0]=1 571 B5R0.3 CC(OC)OC A10939 [0,1,0,0,0,0|2,0,0]=3 572 B5R0.3 CCC(=C)CC L11553 [0,1,0,0,0,0|2,0,1]=4 573 B5R0.3 CCC(=O)CBr L12081 [0,1,0,0,0,0|1,0,2]=4 574 B5R0.3 CCC(=O)CC A15297 [0,1,0,0,0,0|1,0,2]=4 575 B5R0.3 CCC(=O)OC A14944 [0,1,0,0,0,0|1,0,2]=4 576 B5R0.3 CCC(C#C)O B24853 [0,1,0,0,0,0|1,0,1]=3 577 B5R0.3 CCC(C)C=C L11525 [0,1,0,0,0,0|2,0,0]=3 578 B5R0.3 CCC(C)C=O A19650 [0,1,0,0,0,0|1,0,1]=3 579 B5R0.3 CCC(C)CBr H27078 [0,1,0,0,0,0|2,0,0]=3 580 B5R0.3 CCC(C)CC L03133 [0,1,0,0,0,0|2,0,0]=3 581 B5R0.3 CCC(C)CO B21825 [0,1,0,0,0,0|1,0,0]=2 582 B5R0.3 CCC(C)CS B21949 [0,1,0,0,0,0|1,1,0]=3 583 B5R0.3 CCC(C)NC H27547 [0,1,0,0,0,0|2,0,0]=3 584 B5R0.3 CCC(C)OC H53427 [0,1,0,0,0,0|1,0,0]=2 585 B5R0.3 CCC(C)SC B21942 [0,1,0,0,0,0|1,1,0]=3 586 B5R0.3 CCC(C=C)O B20155 [0,1,0,0,0,0|1,0,1]=3 587 B5R0.3 CCC(CBr)Br B20356 [0,1,0,0,0,0|2,0,0]=3 588 B5R0.3 CCC(CC)Br L13576 [0,1,0,0,0,0|2,0,0]=3 589 B5R0.3 CCC(CC)N L02250 [0,1,0,0,0,0|2,0,0]=3 590 B5R0.3 CCC(CC)O L06065 [0,1,0,0,0,0|1,0,0]=2 591 B5R0.3 CCC(CC)[Zn+] H58214 [0,1,0,0,0,0|2,0,0]=3 592 B5R0.3 CCC(CCl)Cl B21307 [0,1,0,0,0,0|2,0,0]=3 593 B5R0.3 CCC(CO)N B24398 [0,1,0,0,0,0|1,0,0]=2 594 B5R0.3 CCN(CC)O B23302 [0,1,0,0,0,0|2,0,0]=3 595 B5R0.3 CCP(=O)CC H27768 [0,1,0,0,0,0|2,0,1]=4 596 B5R0.3 CCP(CC)Cl 30204 [0,1,0,0,0,0|3,0,0]=4 597 B5R0.3 CC[C@@H](CO)N L11449 [0,1,0,0,0,0|1,0,0]=2 598 B5R0.3 CC[C@H](C)CN L14063 [0,1,0,0,0,0|2,0,0]=3 599 B5R0.3 CC[C@H](CO)N B25212 [0,1,0,0,0,0|1,0,0]=2 600 B5R0.3 CC\C(=N\O)\C L08196 [0,1,0,0,0,0|1,0,1]=3 601 B5R0.3 CC\C(=N\O)\N H50889 [0,1,0,0,0,0|2,0,1]=4 602 B5R0.3 CNC(=O)CCl H32362 [0,1,0,0,0,0|1,0,2]=4 603 B5R0.3 CNC(=O)CN H65367 [0,1,0,0,0,0|1,0,2]=4 604 B5R0.3 COC(=O)CBr A10605 [0,1,0,0,0,0|1,0,2]=4 605 B5R0.3 COC(=O)CCl A10325 [0,1,0,0,0,0|1,0,2]=4 606 B5R0.3 COC(=O)CN A14083 [0,1,0,0,0,0|1,0,2]=4 607 B5R0.3 COC(=O)CO A17870 [0,1,0,0,0,0|0,0,2]=3 608 B5R0.3 COC(=O)CS L03783 [0,1,0,0,0,0|0,1,2]=4 609 B5R0.3 COP(O)OC L02670 [0,1,0,0,0,0|3,0,0]=4 610 B5R0.3 CO[SiH](C)OC L16197 [0,1,0,0,0,0|2,1,0]=4 611 B5R0.4 C(C(Br)(Br)Br)O A18706 [0,1,0,0,0,0|2,0,0]=3 612 B5R0.4 C(C(Cl)(Cl)Br)Br A18768 [0,1,0,0,0,0|3,0,0]=4 613 B5R0.4 C(C(Cl)(Cl)Cl)O L08163 [0,1,0,0,0,0|2,0,0]=3 614 B5R0.4 C(C(F)(F)F)I A17804 [0,1,0,0,0,0|3,0,0]=4 615 B5R0.4 C(C(F)(F)F)N A14904 [0,1,0,0,0,0|3,0,0]=4 616 B5R0.4 C(C(F)(F)F)N B20789 [0,1,0,0,0,0|3,0,0]=4 617 B5R0.4 C(C(F)(F)F)O A10788 [0,1,0,0,0,0|2,0,0]=3 618 B5R0.4 C(C(F)(F)F)O L16898 [0,1,0,0,0,0|2,0,0]=3 619 B5R0.4 C(C(F)(F)F)[O-] 39629 [0,1,0,0,0,0|2,0,1]=4 620 B5R0.4 C(N)P(=O)(O)O L09833 [0,1,0,0,0,0|3,0,0]=4 621 B5R0.4 C(N)S(=O)(=O)O B23441 [0,1,0,0,0,0|3,0,0]=4 622 B5R0.4 CC(C)(C#C)Cl B25252 [0,1,0,0,0,0|2,0,1]=4 623 B5R0.4 CC(C)(C#C)N H53448 [0,1,0,0,0,0|2,0,1]=4 624 B5R0.4 CC(C)(C#C)O L07593 [0,1,0,0,0,0|1,0,1]=3 625 B5R0.4 CC(C)(C)C#C A14013 [0,1,0,0,0,0|2,0,1]=4 626 B5R0.4 CC(C)(C)C#N A12011 [0,1,0,0,0,0|2,0,1]=4 627 B5R0.4 CC(C)(C)C=C L08693 [0,1,0,0,0,0|2,0,1]=4 628 B5R0.4 CC(C)(C)C=O A15013 [0,1,0,0,0,0|1,0,2]=4 629 B5R0.4 CC(C)(C)C=O B21393 [0,1,0,0,0,0|1,0,2]=4 630 B5R0.4 CC(C)(C)CBr L03579 [0,1,0,0,0,0|2,0,0]=3 631 B5R0.4 CC(C)(C)CCl L02365 [0,1,0,0,0,0|2,0,0]=3 632 B5R0.4 CC(C)(C)CO A14390 [0,1,0,0,0,0|1,0,0]=2 633 B5R0.4 CC(C)(C)C[Mg+] H54879 [0,1,0,0,0,0|2,0,0]=3 634 B5R0.4 CC(C)(C)NC H27242 [0,1,0,0,0,0|3,0,0]=4 635 B5R0.4 CC(C)(C)NN B23876 [0,1,0,0,0,0|3,0,0]=4 636 B5R0.4 CC(C)(C)OC 40477 [0,1,0,0,0,0|3,0,0]=4 637 B5R0.4 CC(C)(C)OC 41839 [0,1,0,0,0,0|3,0,0]=4 638 B5R0.4 CC(C)(C)OC L14030 [0,1,0,0,0,0|3,0,0]=4 639 B5R0.4 CC(C)(C)OO A13926 [0,1,0,0,0,0|2,0,0]=3 640 B5R0.4 CC(C)(C)SC B22390 [0,1,0,0,0,0|3,0,0]=4 641 B5R0.4 CC(C)(C)[N+]#[C-] L19747 [0,1,0,0,0,0|3,0,0]=4 642 B5R0.4 CC(C)(C=C)O B20790 [0,1,0,0,0,0|1,0,1]=3 643 B5R0.4 CC(C)(CCl)Br A19974 [0,1,0,0,0,0|2,0,0]=3 644 B5R0.4 CC(C)(CCl)O A18978 [0,1,0,0,0,0|1,0,0]=2 645 B5R0.4 CC(C)(CO)N A17814 [0,1,0,0,0,0|1,0,0]=2 646 B5R0.4 CCC(C)(C)C L03295 [0,1,0,0,0,0|2,0,0]=3 647 B5R0.4 CCC(C)(C)Cl A11703 [0,1,0,0,0,0|2,0,0]=3 648 B5R0.4 CCC(C)(C)N B24639 [0,1,0,0,0,0|2,0,0]=3 649 B5R0.4 CCC(C)(C)O A18304 [0,1,0,0,0,0|1,0,0]=2 650 B5R0.4 CCC(C)(C)[Mg+] H54824 [0,1,0,0,0,0|2,0,0]=3 651 B5R0.4 CCC(C)(C)[O-] 36562 [0,1,0,0,0,0|1,0,1]=3 652 B5R0.4 CCC(C)(C)[O-] 41203 [0,1,0,0,0,0|1,0,1]=3 653 B5R0.4 CCC(C)(C)[O-] 41394 [0,1,0,0,0,0|1,0,1]=3 654 B5R0.4 CCC(C)(C)[O-] L15111 [0,1,0,0,0,0|1,0,1]=3 655 B5R0.4 CCC(C)(C)[O-] L15112 [0,1,0,0,0,0|1,0,1]=3 656 B5R0.4 CCC(C)(C)[Zn+] H58312 [0,1,0,0,0,0|2,0,0]=3 657 B5R0.4 CCP(=O)(O)O B22559 [0,1,0,0,0,0|3,0,0]=4 658 B5R0.4 CCS(=O)(=O)O 14891 [0,1,0,0,0,0|3,0,0]=4 659 B5R0.4 CCS(=O)(=O)O L02270 [0,1,0,0,0,0|3,0,0]=4 660 B5R0.4 CC[Si](C)(C)Cl A13222 [0,1,0,0,0,0|2,1,0]=4 661 B5R0.4 CC[Si](C)(Cl)Cl L16493 [0,1,0,0,0,0|2,1,0]=4 662 B5R0.4 C[N+](C)(C)CI A18424 [0,1,0,0,0,0|3,0,0]=4 663 B5R0.4 C[Si](C)(C)CCl A14303 [0,1,0,0,0,0|2,1,0]=4 664 B5R0.4 C[Si](C)(C)CI A15120 [0,1,0,0,0,0|2,1,0]=4 665 B5R0.4 C[Si](C)(C)CO L04251 [0,1,0,0,0,0|1,1,0]=3 666 B5R0.4 C[Si](C)(C)C[Mg+] H54635 [0,1,0,0,0,0|2,1,0]=4 667 B5R0.4 C[Si](C)(CCl)Cl A14899 [0,1,0,0,0,0|2,1,0]=4 668 B5R0.5 B(C(C)C)(O)O L19962 [0,1,0,0,0,0|2,0,0]=3 669 B5R0.5 C(=O)(C(=O)O)O 33262 [0,1,0,0,0,0|1,0,2]=4 670 B5R0.5 C(=O)(C(=O)O)O 35617 [0,1,0,0,0,0|1,0,2]=4 671 B5R0.5 C(=O)(C(=O)O)O 35619 [0,1,0,0,0,0|1,0,2]=4 672 B5R0.5 C(=O)(C(=O)O)O 35622 [0,1,0,0,0,0|1,0,2]=4 673 B5R0.5 C(=O)(C(=O)O)O 44410 [0,1,0,0,0,0|1,0,2]=4 674 B5R0.5 C(=O)(C(=O)O)O A13866 [0,1,0,0,0,0|1,0,2]=4 675 B5R0.5 C(C(=O)O)(Cl)Cl 31249 [0,1,0,0,0,0|2,0,1]=4 676 B5R0.5 C(C(=O)O)(Cl)Cl A14740 [0,1,0,0,0,0|2,0,1]=4 677 B5R0.5 C(C(=O)O)(F)F A12787 [0,1,0,0,0,0|2,0,1]=4 678 B5R0.5 C(C(Br)Br)(Br)Br A12943 [0,1,0,0,0,0|3,0,0]=4 679 B5R0.5 C(C(Cl)Cl)(Cl)Cl L04489 [0,1,0,0,0,0|3,0,0]=4 680 B5R0.5 CC(=C)C(=O)O 15546 [0,1,0,0,0,0|1,0,2]=4 681 B5R0.5 CC(=C)C(=O)O A11543 [0,1,0,0,0,0|1,0,2]=4 682 B5R0.5 CC(=O)C(=O)O A13875 [0,1,0,0,0,0|0,0,3]=4 683 B5R0.5 CC(=O)C(Cl)Cl L10367 [0,1,0,0,0,0|1,0,2]=4 684 B5R0.5 CC(C(=O)Br)Br B22504 [0,1,0,0,0,0|1,0,2]=4 685 B5R0.5 CC(C(=O)C)Br A10186 [0,1,0,0,0,0|1,0,2]=4 686 B5R0.5 CC(C(=O)C)Cl L14158 [0,1,0,0,0,0|1,0,2]=4 687 B5R0.5 CC(C(=O)C)O A13752 [0,1,0,0,0,0|0,0,2]=3 688 B5R0.5 CC(C(=O)C)S B22494 [0,1,0,0,0,0|0,1,2]=4 689 B5R0.5 CC(C(=O)Cl)Br B23662 [0,1,0,0,0,0|1,0,2]=4 690 B5R0.5 CC(C(=O)Cl)Cl B24503 [0,1,0,0,0,0|1,0,2]=4 691 B5R0.5 CC(C(=O)O)Br A17569 [0,1,0,0,0,0|1,0,1]=3 692 B5R0.5 CC(C(=O)O)Cl A12860 [0,1,0,0,0,0|1,0,1]=3 693 B5R0.5 CC(C(=O)O)F H25841 [0,1,0,0,0,0|1,0,1]=3 694 B5R0.5 CC(C(=O)O)N A12230 [0,1,0,0,0,0|1,0,1]=3 695 B5R0.5 CC(C(=O)O)O 36415 [0,1,0,0,0,0|0,0,1]=2 696 B5R0.5 CC(C(=O)O)O L14259 [0,1,0,0,0,0|0,0,1]=2 697 B5R0.5 CC(C(=O)O)S L10257 [0,1,0,0,0,0|0,1,1]=3 698 B5R0.5 CC(C(=O)[O-])O 20835 [0,1,0,0,0,0|0,0,2]=3 699 B5R0.5 CC(C(=O)[O-])O 39122 [0,1,0,0,0,0|0,0,2]=3 700 B5R0.5 CC(C(=O)[O-])O 39369 [0,1,0,0,0,0|0,0,2]=3 701 B5R0.5 CC(C(=O)[O-])O 41529 [0,1,0,0,0,0|0,0,2]=3 702 B5R0.5 CC(C(=O)[O-])O 44858 [0,1,0,0,0,0|0,0,2]=3 703 B5R0.5 CC(C(=O)[O-])O B23643 [0,1,0,0,0,0|0,0,2]=3 704 B5R0.5 CC(C(=O)[O-])[O-] 42676 [0,1,0,0,0,0|0,0,3]=4 705 B5R0.5 CC(C(C)Br)Br A10219 [0,1,0,0,0,0|2,0,0]=3 706 B5R0.5 CC(C(C)Cl)Cl B21386 [0,1,0,0,0,0|2,0,0]=3 707 B5R0.5 CC(C(C)O)O H66369 [0,1,0,0,0,0|0,0,0]=1 708 B5R0.5 CC(C)C(=C)C L05675 [0,1,0,0,0,0|2,0,1]=4 709 B5R0.5 CC(C)C(=O)C B24527 [0,1,0,0,0,0|1,0,2]=4 710 B5R0.5 CC(C)C(=O)Cl B24472 [0,1,0,0,0,0|1,0,2]=4 711 B5R0.5 CC(C)C(=O)N B21641 [0,1,0,0,0,0|1,0,2]=4 712 B5R0.5 CC(C)C(=O)O L04038 [0,1,0,0,0,0|1,0,1]=3 713 B5R0.5 CC(C)C(=O)[O-] 39372 [0,1,0,0,0,0|1,0,2]=4 714 B5R0.5 CC(C)C(=O)[O-] 46786 [0,1,0,0,0,0|1,0,2]=4 715 B5R0.5 CC(C)C(=S)N H64663 [0,1,0,0,0,0|1,1,1]=4 716 B5R0.5 CC(C)C(C)C 43142 [0,1,0,0,0,0|2,0,0]=3 717 B5R0.5 CC(C)C(C)C B22223 [0,1,0,0,0,0|2,0,0]=3 718 B5R0.5 CC(C)C(C)N L02948 [0,1,0,0,0,0|2,0,0]=3 719 B5R0.5 CC(C)C(C)O L05347 [0,1,0,0,0,0|1,0,0]=2 720 B5R0.5 CC(C)C(C)S B22330 [0,1,0,0,0,0|1,1,0]=3 721 B5R0.5 C[C@@H](C(=O)N)N H63019 [0,1,0,0,0,0|1,0,2]=4 722 B5R0.5 C[C@@H](C(=O)O)Cl L09427 [0,1,0,0,0,0|1,0,1]=3 723 B5R0.5 C[C@@H](C(=O)O)N A15804 [0,1,0,0,0,0|1,0,1]=3 724 B5R0.5 C[C@@H](C(=O)O)O A17268 [0,1,0,0,0,0|0,0,1]=2 725 B5R0.5 C[C@@H](C(=O)O)O L13242 [0,1,0,0,0,0|0,0,1]=2 726 B5R0.5 C[C@@H](C(=O)[O-])O A11818 [0,1,0,0,0,0|0,0,2]=3 727 B5R0.5 C[C@@H](C(=O)[O-])O L14500 [0,1,0,0,0,0|0,0,2]=3 728 B5R0.5 C[C@@H](C(C)C)N L16332 [0,1,0,0,0,0|2,0,0]=3 729 B5R0.5 C[C@@H](C(C)C)O L09431 [0,1,0,0,0,0|1,0,0]=2 730 B5R0.5 C[C@H](C(=O)N)N H63535 [0,1,0,0,0,0|1,0,2]=4 731 B5R0.5 C[C@H](C(=O)O)N A10231 [0,1,0,0,0,0|1,0,1]=3 732 B5R0.5 C[C@H](C(C)C)N L16330 [0,1,0,0,0,0|2,0,0]=3 733 B5R0.5 C[C@H](C(C)C)O L11008 [0,1,0,0,0,0|1,0,0]=2 734 B5R0.5 C[C@H]([C@@H](C)O)O L06586 [0,1,0,0,0,0|0,0,0]=1 735 B5R1.2 C1C(=O)CO1 H57870 [0,0,0,1,0,0|0,0,2]=3 736 B5R1.2 C1C(CN1)F H59454 [0,0,0,1,0,0|2,0,0]=3 737 B5R1.2 C1C(CN1)N H59318 [0,0,0,1,0,0|2,0,0]=3 738 B5R1.2 C1C(CN1)O H25842 [0,0,0,1,0,0|1,0,0]=2 739 B5R1.2 C1C(CO1)Br H57437 [0,0,0,1,0,0|1,0,0]=2 740 B5R1.2 C1C(CO1)I H57302 [0,0,0,1,0,0|1,0,0]=2 741 B5R1.2 C1C(CO1)N H57248 [0,0,0,1,0,0|1,0,0]=2 742 B5R1.2 C1C(CO1)O H57928 [0,0,0,1,0,0|0,0,0]=1 743 B5R1.2 C1CC(=O)C1 A13068 [0,0,0,1,0,0|1,0,2]=4 744 B5R1.2 C1CC(C1)Br A12817 [0,0,0,1,0,0|2,0,0]=3 745 B5R1.2 C1CC(C1)Cl A12561 [0,0,0,1,0,0|2,0,0]=3 746 B5R1.2 C1CC(C1)N A13423 [0,0,0,1,0,0|2,0,0]=3 747 B5R1.2 C1CC(C1)N B25400 [0,0,0,1,0,0|2,0,0]=3 748 B5R1.2 C1CC(C1)O A12430 [0,0,0,1,0,0|1,0,0]=2 749 B5R1.2 C1CC(C1)[Zn+] H58247 [0,0,0,1,0,0|2,0,0]=3 750 B5R1.2 C1COC1=O B23197 [0,0,0,1,0,0|2,0,1]=4 751 B5R1.3 C#CC1CC1 H53440 [0,0,0,1,0,0|2,0,1]=4 752 B5R1.3 C1C(N1)C#N A17162 [0,0,0,1,0,0|2,0,1]=4 753 B5R1.3 C1C(O1)CCl A15823 [0,0,0,1,0,0|1,0,0]=2 754 B5R1.3 C1CC1C#N A11125 [0,0,0,1,0,0|2,0,1]=4 755 B5R1.3 C1CC1C=O L14931 [0,0,0,1,0,0|1,0,2]=4 756 B5R1.3 C1CC1CBr L01122 [0,0,0,1,0,0|2,0,0]=3 757 B5R1.3 C1CC1CCl L06986 [0,0,0,1,0,0|2,0,0]=3 758 B5R1.3 C1CC1CI H35309 [0,0,0,1,0,0|2,0,0]=3 759 B5R1.3 C1CC1CN A13946 [0,0,0,1,0,0|2,0,0]=3 760 B5R1.3 C1CC1CN L13353 [0,0,0,1,0,0|2,0,0]=3 761 B5R1.3 C1CC1CO A12567 [0,0,0,1,0,0|1,0,0]=2 762 B5R1.3 C1[C@@H](O1)CCl L14198 [0,0,0,1,0,0|1,0,0]=2 763 B5R1.3 C1[C@@H](O1)CO H63502 [0,0,0,1,0,0|0,0,0]=1 764 B5R1.3 C1[C@H](O1)CCl L14298 [0,0,0,1,0,0|1,0,0]=2 765 B5R1.3 C=CC1CO1 L00238 [0,0,0,1,0,0|1,0,1]=3 766 B5R1.3 CC[C@@H]1CO1 H58579 [0,0,0,1,0,0|1,0,0]=2 767 B5R1.3 CC[C@H]1CO1 H58104 [0,0,0,1,0,0|1,0,0]=2 768 B5R1.4 C[C@@H]1[C@@H](O1)C L10320 [0,0,0,1,0,0|1,0,0]=2 769 B5R1.4 C[C@H]1[C@@H](O1)C B22005 [0,0,0,1,0,0|1,0,0]=2 770 B5R1.5 CC1(CO1)C L09773 [0,0,0,1,0,0|1,0,0]=2 771 B2R0.1 C(=O)O 36504 [2,0,0,0,0,0|0,0,2]=4 772 B2R0.1 C(=O)O 36617 [2,0,0,0,0,0|0,0,2]=4 773 B2R0.1 C(=O)O A13285 [2,0,0,0,0,0|0,0,2]=4 774 B2R0.1 C(=O)O L17434 [2,0,0,0,0,0|0,0,2]=4 775 B2R0.1 C(Br)Br A10456 [2,0,0,0,0,0|2,0,0]=4 776 B2R0.1 C(Cl)Cl 22917 [2,0,0,0,0,0|2,0,0]=4 777 B2R0.1 C(Cl)Cl 32440 [2,0,0,0,0,0|2,0,0]=4 778 B2R0.1 C(Cl)Cl 39116 [2,0,0,0,0,0|2,0,0]=4 779 B2R0.1 C(Cl)Cl 41835 [2,0,0,0,0,0|2,0,0]=4 780 B2R0.1 C(Cl)Cl 42006 [2,0,0,0,0,0|2,0,0]=4 781 B2R0.1 C(Cl)Cl L13089 [2,0,0,0,0,0|2,0,0]=4 782 B2R0.1 C(Cl)I A11032 [2,0,0,0,0,0|2,0,0]=4 783 B2R0.1 C(I)I A15457 [2,0,0,0,0,0|2,0,0]=4 784 B2R0.1 CC#N 10002 [2,0,0,0,0,0|1,0,1]=4 785 B2R0.1 CC#N 22927 [2,0,0,0,0,0|1,0,1]=4 786 B2R0.1 CC#N 32470 [2,0,0,0,0,0|1,0,1]=4 787 B2R0.1 CC#N 36423 [2,0,0,0,0,0|1,0,1]=4 788 B2R0.1 CC#N 40972 [2,0,0,0,0,0|1,0,1]=4 789 B2R0.1 CC#N 42311 [2,0,0,0,0,0|1,0,1]=4 790 B2R0.1 CC#N 42879 [2,0,0,0,0,0|1,0,1]=4 791 B2R0.1 CC#N 42880 [2,0,0,0,0,0|1,0,1]=4 792 B2R0.1 CC#N 43166 [2,0,0,0,0,0|1,0,1]=4 793 B2R0.1 CC#N 43440 [2,0,0,0,0,0|1,0,1]=4 794 B2R0.1 CC#N 47138 [2,0,0,0,0,0|1,0,1]=4 795 B2R0.1 CC#N A19862 [2,0,0,0,0,0|1,0,1]=4 796 B2R0.1 CC#N H33387 [2,0,0,0,0,0|1,0,1]=4 797 B2R0.1 CC=O 33244 [2,0,0,0,0,0|0,0,2]=4 798 B2R0.1 CCBr A12804 [2,0,0,0,0,0|1,0,0]=3 799 B2R0.1 CCC A17702 [2,0,0,0,0,0|0,0,0]=2 800 B2R0.1 CCI A14444 [2,0,0,0,0,0|1,0,0]=3 801 B2R0.1 CCN A15022 [2,0,0,0,0,0|1,0,0]=3 802 B2R0.1 CCN H32306 [2,0,0,0,0,0|1,0,0]=3 803 B2R0.1 CCN L03624 [2,0,0,0,0,0|1,0,0]=3 804 B2R0.1 CCO 22930 [2,0,0,0,0,0|0,0,0]=2 805 B2R0.1 CCO 22931 [2,0,0,0,0,0|0,0,0]=2 806 B2R0.1 CCO 31337 [2,0,0,0,0,0|0,0,0]=2 807 B2R0.1 CCO 33361 [2,0,0,0,0,0|0,0,0]=2 808 B2R0.1 CCO 36642 [2,0,0,0,0,0|0,0,0]=2 809 B2R0.1 CCO 41603 [2,0,0,0,0,0|0,0,0]=2 810 B2R0.1 CCO 44014 [2,0,0,0,0,0|0,0,0]=2 811 B2R0.1 CCO 44134 [2,0,0,0,0,0|0,0,0]=2 812 B2R0.1 CCO 45844 [2,0,0,0,0,0|0,0,0]=2 813 B2R0.1 CCS 22585 [2,0,0,0,0,0|0,1,0]=3 814 B2R0.1 CC[Al+2] 41712 [2,0,0,0,0,0|1,0,0]=3 815 B2R0.1 CC[Hg+] 37114 [2,0,0,0,0,0|1,0,0]=3 816 B2R0.1 CC[Mg+] 41675 [2,0,0,0,0,0|1,0,0]=3 817 B2R0.1 CC[Mg+] 47279 [2,0,0,0,0,0|1,0,0]=3 818 B2R0.1 CC[Mg+] 87291 [2,0,0,0,0,0|1,0,0]=3 819 B2R0.1 CC[O-] 14263 [2,0,0,0,0,0|0,0,1]=3 820 B2R0.1 CC[O-] 14264 [2,0,0,0,0,0|0,0,1]=3 821 B2R0.1 CC[O-] 14643 [2,0,0,0,0,0|0,0,1]=3 822 B2R0.1 CC[O-] 14679 [2,0,0,0,0,0|0,0,1]=3 823 B2R0.1 CC[O-] 14689 [2,0,0,0,0,0|0,0,1]=3 824 B2R0.1 CC[O-] 18859 [2,0,0,0,0,0|0,0,1]=3 825 B2R0.1 CC[O-] 18862 [2,0,0,0,0,0|0,0,1]=3 826 B2R0.1 CC[O-] 20896 [2,0,0,0,0,0|0,0,1]=3 827 B2R0.1 CC[O-] 31498 [2,0,0,0,0,0|0,0,1]=3 828 B2R0.1 CC[O-] 35791 [2,0,0,0,0,0|0,0,1]=3 829 B2R0.1 CC[O-] 36588 [2,0,0,0,0,0|0,0,1]=3 830 B2R0.1 CC[O-] 39155 [2,0,0,0,0,0|0,0,1]=3 831 B2R0.1 CC[O-] 39161 [2,0,0,0,0,0|0,0,1]=3 832 B2R0.1 CC[O-] 39170 [2,0,0,0,0,0|0,0,1]=3 833 B2R0.1 CC[O-] 39171 [2,0,0,0,0,0|0,0,1]=3 834 B2R0.1 CC[O-] 41105 [2,0,0,0,0,0|0,0,1]=3 835 B2R0.1 CC[O-] 41336 [2,0,0,0,0,0|0,0,1]=3 836 B2R0.1 CC[O-] 41607 [2,0,0,0,0,0|0,0,1]=3 837 B2R0.1 CC[O-] 41794 [2,0,0,0,0,0|0,0,1]=3 838 B2R0.1 CC[O-] 41795 [2,0,0,0,0,0|0,0,1]=3 839 B2R0.1 CC[O-] 41863 [2,0,0,0,0,0|0,0,1]=3 840 B2R0.1 CC[O-] 42344 [2,0,0,0,0,0|0,0,1]=3 841 B2R0.1 CC[O-] 43052 [2,0,0,0,0,0|0,0,1]=3 842 B2R0.1 CC[O-] 43097 [2,0,0,0,0,0|0,0,1]=3 843 B2R0.1 CC[O-] 44670 [2,0,0,0,0,0|0,0,1]=3 844 B2R0.1 CC[O-] 44681 [2,0,0,0,0,0|0,0,1]=3 845 B2R0.1 CC[O-] 44769 [2,0,0,0,0,0|0,0,1]=3 846 B2R0.1 CC[O-] 44859 [2,0,0,0,0,0|0,0,1]=3 847 B2R0.1 CC[O-] 45590 [2,0,0,0,0,0|0,0,1]=3 848 B2R0.1 CC[O-] 45861 [2,0,0,0,0,0|0,0,1]=3 849 B2R0.1 CC[O-] 46316 [2,0,0,0,0,0|0,0,1]=3 850 B2R0.1 CC[O-] 77142 [2,0,0,0,0,0|0,0,1]=3 851 B2R0.1 CC[O-] 78131 [2,0,0,0,0,0|0,0,1]=3 852 B2R0.1 CC[O-] L06230 [2,0,0,0,0,0|0,0,1]=3 853 B2R0.1 CC[O-] L10288 [2,0,0,0,0,0|0,0,1]=3 854 B2R0.1 CC[O-] L13083 [2,0,0,0,0,0|0,0,1]=3 855 B2R0.1 CC[O-] L16031 [2,0,0,0,0,0|0,0,1]=3 856 B2R0.1 CC[O-] L16033 [2,0,0,0,0,0|0,0,1]=3 857 B2R0.1 CNC 31458 [2,0,0,0,0,0|1,0,0]=3 858 B2R0.1 CNC 43261 [2,0,0,0,0,0|1,0,0]=3 859 B2R0.1 CNC 89149 [2,0,0,0,0,0|1,0,0]=3 860 B2R0.1 CNC A12133 [2,0,0,0,0,0|1,0,0]=3 861 B2R0.1 CNC H27261 [2,0,0,0,0,0|1,0,0]=3 862 B2R0.1 CNC H27665 [2,0,0,0,0,0|1,0,0]=3 863 B2R0.1 CNO L02202 [2,0,0,0,0,0|1,0,0]=3 864 B2R0.1 CON A19188 [2,0,0,0,0,0|2,0,0]=4 865 B2R0.1 CON L08415 [2,0,0,0,0,0|2,0,0]=4 866 B2R0.1 CSC 19368 [2,0,0,0,0,0|1,0,0]=3 867 B2R0.1 CSC 22949 [2,0,0,0,0,0|1,0,0]=3 868 B2R0.1 CSC 42963 [2,0,0,0,0,0|1,0,0]=3 869 B2R0.1 CSC 42965 [2,0,0,0,0,0|1,0,0]=3 870 B2R0.1 CSC 42967 [2,0,0,0,0,0|1,0,0]=3 871 B2R0.1 CSC 43327 [2,0,0,0,0,0|1,0,0]=3 872 B2R0.1 CSC L07705 [2,0,0,0,0,0|1,0,0]=3 873 B2R0.1 C[N-]C 40443 [2,0,0,0,0,0|1,0,0]=3 874 B2R0.1 C[N-]C 42761 [2,0,0,0,0,0|1,0,0]=3 875 B2R0.1 C[N-]C 43237 [2,0,0,0,0,0|1,0,0]=3 876 B2R0.1 C[N-]C 44145 [2,0,0,0,0,0|1,0,0]=3 877 B2R0.1 C[N-]C 45491 [2,0,0,0,0,0|1,0,0]=3 878 B2R0.1 C[Se]C 68116 [2,0,0,0,0,0|1,0,0]=3 879 B2R0.1 C[Sn+2]C 71142 [2,0,0,0,0,0|1,0,0]=3 880 B2R0.1 C[Sn+2]C 71164 [2,0,0,0,0,0|1,0,0]=3 881 B2R0.1 C[Sn+2]C A17661 [2,0,0,0,0,0|1,0,0]=3 882 B2R0.1 C[Sn+2]C A18060 [2,0,0,0,0,0|1,0,0]=3 883 B2R0.1 [2H]OC 89571 [2,0,0,0,0,0|2,0,0]=4 884 B4R0.2 C#CCCBr H53367 [1,1,0,0,0,0|1,0,1]=4 885 B4R0.2 C#CCCO A11477 [1,1,0,0,0,0|0,0,1]=3 886 B4R0.2 C(CBr)C#N B23998 [1,1,0,0,0,0|1,0,1]=4 887 B4R0.2 C(CBr)CBr A14687 [1,1,0,0,0,0|1,0,0]=3 888 B4R0.2 C(CCl)C#N L05902 [1,1,0,0,0,0|1,0,1]=4 889 B4R0.2 C(CCl)CBr A11395 [1,1,0,0,0,0|1,0,0]=3 890 B4R0.2 C(CCl)CCl 36685 [1,1,0,0,0,0|1,0,0]=3 891 B4R0.2 C(CCl)CI A13489 [1,1,0,0,0,0|1,0,0]=3 892 B4R0.2 C(CF)CF L12351 [1,1,0,0,0,0|1,0,0]=3 893 B4R0.2 C(CI)CI A10616 [1,1,0,0,0,0|1,0,0]=3 894 B4R0.2 C(CN)C#N A13043 [1,1,0,0,0,0|1,0,1]=4 895 B4R0.2 C(CN)CBr B23254 [1,1,0,0,0,0|1,0,0]=3 896 B4R0.2 C(CN)CCl A15415 [1,1,0,0,0,0|1,0,0]=3 897 B4R0.2 C(CN)CN A11932 [1,1,0,0,0,0|1,0,0]=3 898 B4R0.2 C(CN)CO B23041 [1,1,0,0,0,0|0,0,0]=2 899 B4R0.2 C(CO)C#N L12570 [1,1,0,0,0,0|0,0,1]=3 900 B4R0.2 C(CO)CBr B22857 [1,1,0,0,0,0|0,0,0]=2 901 B4R0.2 C(CO)CCl A16871 [1,1,0,0,0,0|0,0,0]=2 902 B4R0.2 C(CO)CO A10829 [1,1,0,0,0,0|0,0,0]=2 903 B4R0.2 C(CO)NN 43793 [1,1,0,0,0,0|1,0,0]=3 904 B4R0.2 C(CS)CS A15261 [1,1,0,0,0,0|0,1,0]=3 905 B4R0.2 C(C[Zn+])C#N H58695 [1,1,0,0,0,0|1,0,1]=4 906 B4R0.2 C=CCCBr A10977 [1,1,0,0,0,0|1,0,1]=4 907 B4R0.2 C=CCCN L20157 [1,1,0,0,0,0|1,0,1]=4 908 B4R0.2 C=CCCO L00767 [1,1,0,0,0,0|0,0,1]=3 909 B4R0.2 C=CCC[Zn+] H58171 [1,1,0,0,0,0|1,0,1]=4 910 B4R0.2 CC#CCBr L20134 [1,1,0,0,0,0|1,0,1]=4 911 B4R0.2 CC#CCO A15709 [1,1,0,0,0,0|0,0,1]=3 912 B4R0.2 CCC#CC L02973 [1,1,0,0,0,0|1,0,1]=4 913 B4R0.2 CCCC#C L02479 [1,1,0,0,0,0|1,0,0]=3 914 B4R0.2 CCCC#N L02999 [1,1,0,0,0,0|1,0,0]=3 915 B4R0.2 CCCC=C A16723 [1,1,0,0,0,0|1,0,0]=3 916 B4R0.2 CCCC=O A18243 [1,1,0,0,0,0|0,0,1]=3 917 B4R0.2 CCCCBr A10696 [1,1,0,0,0,0|1,0,0]=3 918 B4R0.2 CCCCC 17381 [1,1,0,0,0,0|1,0,0]=3 919 B4R0.2 CCCCC 22907 [1,1,0,0,0,0|1,0,0]=3 920 B4R0.2 CCCCC 32449 [1,1,0,0,0,0|1,0,0]=3 921 B4R0.2 CCCCC 40981 [1,1,0,0,0,0|1,0,0]=3 922 B4R0.2 CCCCC 44255 [1,1,0,0,0,0|1,0,0]=3 923 B4R0.2 CCCCC 47115 [1,1,0,0,0,0|1,0,0]=3 924 B4R0.2 CCCCC H27427 [1,1,0,0,0,0|1,0,0]=3 925 B4R0.2 CCCCCl 39198 [1,1,0,0,0,0|1,0,0]=3 926 B4R0.2 CCCCCl A11494 [1,1,0,0,0,0|1,0,0]=3 927 B4R0.2 CCCCI A12340 [1,1,0,0,0,0|1,0,0]=3 928 B4R0.2 CCCCN L03575 [1,1,0,0,0,0|1,0,0]=3 929 B4R0.2 CCCCO 22925 [1,1,0,0,0,0|0,0,0]=2 930 B4R0.2 CCCCO 31068 [1,1,0,0,0,0|0,0,0]=2 931 B4R0.2 CCCCO 32443 [1,1,0,0,0,0|0,0,0]=2 932 B4R0.2 CCCCO 41867 [1,1,0,0,0,0|0,0,0]=2 933 B4R0.2 CCCCO L13171 [1,1,0,0,0,0|0,0,0]=2 934 B4R0.2 CCCCS 43421 [1,1,0,0,0,0|0,1,0]=3 935 B4R0.2 CCCC[Mg+] 41676 [1,1,0,0,0,0|1,0,0]=3 936 B4R0.2 CCCC[Mg+] 46117 [1,1,0,0,0,0|1,0,0]=3 937 B4R0.2 CCCC[O-] 33496 [1,1,0,0,0,0|0,0,1]=3 938 B4R0.2 CCCC[O-] 36570 [1,1,0,0,0,0|0,0,1]=3 939 B4R0.2 CCCC[O-] 40816 [1,1,0,0,0,0|0,0,1]=3 940 B4R0.2 CCCC[O-] 43295 [1,1,0,0,0,0|0,0,1]=3 941 B4R0.2 CCCC[O-] 44209 [1,1,0,0,0,0|0,0,1]=3 942 B4R0.2 CCCC[O-] 77124 [1,1,0,0,0,0|0,0,1]=3 943 B4R0.2 CCCC[O-] 87754 [1,1,0,0,0,0|0,0,1]=3 944 B4R0.2 CCCC[O-] B23317 [1,1,0,0,0,0|0,0,1]=3 945 B4R0.2 CCCC[Sn+3] 71125 [1,1,0,0,0,0|1,0,0]=3 946 B4R0.2 CCCC[Zn+] H58121 [1,1,0,0,0,0|1,0,0]=3 947 B4R0.2 CCCNC A16903 [1,1,0,0,0,0|1,0,0]=3 948 B4R0.2 CCCSC L09346 [1,1,0,0,0,0|0,1,0]=3 949 B4R0.2 CCN=C=O B25180 [1,1,0,0,0,0|0,0,2]=4 950 B4R0.2 CCN=C=S A19492 [1,1,0,0,0,0|0,1,1]=4 951 B4R0.2 CCNCC A10452 [1,1,0,0,0,0|1,0,0]=3 952 B4R0.2 CCNCC A11716 [1,1,0,0,0,0|1,0,0]=3 953 B4R0.2 CCNCC A13637 [1,1,0,0,0,0|1,0,0]=3 954 B4R0.2 CCOC#C A14245 [1,1,0,0,0,0|1,0,1]=4 955 B4R0.2 CCOC=C A15691 [1,1,0,0,0,0|1,0,1]=4 956 B4R0.2 CCOC=O A11113 [1,1,0,0,0,0|0,0,2]=4 957 B4R0.2 CCOCC 16767 [1,1,0,0,0,0|1,0,0]=3 958 B4R0.2 CCOCC 33224 [1,1,0,0,0,0|1,0,0]=3 959 B4R0.2 CCOCC 38990 [1,1,0,0,0,0|1,0,0]=3 960 B4R0.2 CCOCC 40976 [1,1,0,0,0,0|1,0,0]=3 961 B4R0.2 CCOCC 41796 [1,1,0,0,0,0|1,0,0]=3 962 B4R0.2 CCOCC A15275 [1,1,0,0,0,0|1,0,0]=3 963 B4R0.2 CCOCC H33678 [1,1,0,0,0,0|1,0,0]=3 964 B4R0.2 CCOCC L15481 [1,1,0,0,0,0|1,0,0]=3 965 B4R0.2 CCSCC 10482 [1,1,0,0,0,0|1,0,0]=3 966 B4R0.2 CCSCC 10484 [1,1,0,0,0,0|1,0,0]=3 967 B4R0.2 CCSCC L03493 [1,1,0,0,0,0|1,0,0]=3 968 B4R0.2 CC[Al+]CC 87625 [1,1,0,0,0,0|1,0,0]=3 969 B4R0.2 CC[Al+]CC 89035 [1,1,0,0,0,0|1,0,0]=3 970 B4R0.2 CC[N-]CC 40445 [1,1,0,0,0,0|1,0,0]=3 971 B4R0.2 CC[N-]CC 42759 [1,1,0,0,0,0|1,0,0]=3 972 B4R0.2 CC[N-]CC 42855 [1,1,0,0,0,0|1,0,0]=3 973 B4R0.2 CC[N-]CC 43419 [1,1,0,0,0,0|1,0,0]=3 974 B4R0.2 CC[SiH2]CC L16468 [1,1,0,0,0,0|1,0,0]=3 975 B4R0.2 CC[Sn+2]CC 71155 [1,1,0,0,0,0|1,0,0]=3 976 B4R0.2 CC[Zn]CC 39564 [1,1,0,0,0,0|1,0,0]=3 977 B4R0.2 CC[Zn]CC 44880 [1,1,0,0,0,0|1,0,0]=3 978 B4R0.2 CC[Zn]CC 89038 [1,1,0,0,0,0|1,0,0]=3 979 B4R0.2 CC\C=C\C A17736 [1,1,0,0,0,0|1,0,1]=4 980 B4R0.2 CC\C=C\C L09421 [1,1,0,0,0,0|1,0,1]=4 981 B4R0.2 CNCC#N H55215 [1,1,0,0,0,0|1,0,1]=4 982 B4R0.2 CNCC=C H27551 [1,1,0,0,0,0|1,0,1]=4 983 B4R0.2 CNCCN A12165 [1,1,0,0,0,0|1,0,0]=3 984 B4R0.2 CNCCO B23180 [1,1,0,0,0,0|0,0,0]=2 985 B4R0.2 COCC=C 18652 [1,1,0,0,0,0|0,0,2]=4 986 B4R0.2 COCCBr A15370 [1,1,0,0,0,0|1,0,0]=3 987 B4R0.2 COCCCl B24081 [1,1,0,0,0,0|1,0,0]=3 988 B4R0.2 COCCN B22924 [1,1,0,0,0,0|1,0,0]=3 989 B4R0.2 COCCO 31733 [1,1,0,0,0,0|0,0,0]=2 990 B4R0.2 COCCO 32444 [1,1,0,0,0,0|0,0,0]=2 991 B4R0.2 COCCO A17459 [1,1,0,0,0,0|0,0,0]=2 992 B4R0.2 COCC[O-] 40471 [1,1,0,0,0,0|0,0,1]=3 993 B4R0.2 COCC[O-] 41237 [1,1,0,0,0,0|0,0,1]=3 994 B4R0.2 COCC[O-] 41256 [1,1,0,0,0,0|0,0,1]=3 995 B4R0.2 COCC[O-] 41793 [1,1,0,0,0,0|0,0,1]=3 996 B4R0.2 COCC[O-] 42377 [1,1,0,0,0,0|0,0,1]=3 997 B4R0.2 COCC[O-] 42378 [1,1,0,0,0,0|0,0,1]=3 998 B4R0.2 COCC[O-] 42522 [1,1,0,0,0,0|0,0,1]=3 999 B4R0.2 COCC[O-] 42819 [1,1,0,0,0,0|0,0,1]=3 1000 B4R0.2 COCC[O-] 43903 [1,1,0,0,0,0|0,0,1]=3 1001 B4R0.2 COCC[O-] A13292 [1,1,0,0,0,0|0,0,1]=3 1002 B4R0.2 COCOC A12055 [1,1,0,0,0,0|1,0,0]=3 1003 B4R0.2 CSCC#N L03066 [1,1,0,0,0,0|1,0,1]=4 1004 B4R0.2 CSCC=C B22514 [1,1,0,0,0,0|1,0,1]=4 1005 B4R0.2 CSCCN B22941 [1,1,0,0,0,0|1,0,0]=3 1006 B4R0.2 CSCCO L05442 [1,1,0,0,0,0|0,0,0]=2 1007 B4R0.2 CSCSC A19706 [1,1,0,0,0,0|1,1,0]=4 1008 B4R0.2 C\C=C\CO A10681 [1,1,0,0,0,0|0,0,1]=3 1009 B4R0.2 C\C=C\C[Mg+] H51171 [1,1,0,0,0,0|1,0,1]=4 1010 B4R0.2 [Li]CCCC 41248 [1,1,0,0,0,0|1,0,0]=3 1011 B4R0.2 [Li]CCCC 43314 [1,1,0,0,0,0|1,0,0]=3 1012 B4R0.2 [Li]CCCC 44109 [1,1,0,0,0,0|1,0,0]=3 1013 B4R0.2 [Li]CCCC 47107 [1,1,0,0,0,0|1,0,0]=3 1014 B4R0.2 [Li]CCCC H66688 [1,1,0,0,0,0|1,0,0]=3 1015 B4R0.2 [Li]CCCC L13559 [1,1,0,0,0,0|1,0,0]=3 1016 B4R0.2 [Li]CCCC L14775 [1,1,0,0,0,0|1,0,0]=3 1017 B4R0.3 CC(C)(Br)Br H65014 [1,1,0,0,0,0|1,0,0]=3 1018 B4R0.3 CC(C)(C)Br A13727 [1,1,0,0,0,0|1,0,0]=3 1019 B4R0.3 CC(C)(C)Cl A13004 [1,1,0,0,0,0|1,0,0]=3 1020 B4R0.3 CC(C)(C)I L02786 [1,1,0,0,0,0|1,0,0]=3 1021 B4R0.3 CC(C)(C)N A11135 [1,1,0,0,0,0|1,0,0]=3 1022 B4R0.3 CC(C)(C)N L13177 [1,1,0,0,0,0|1,0,0]=3 1023 B4R0.3 CC(C)(C)O 33278 [1,1,0,0,0,0|0,0,0]=2 1024 B4R0.3 CC(C)(C)O 41470 [1,1,0,0,0,0|0,0,0]=2 1025 B4R0.3 CC(C)(C)O 41857 [1,1,0,0,0,0|0,0,0]=2 1026 B4R0.3 CC(C)(C)O L12338 [1,1,0,0,0,0|0,0,0]=2 1027 B4R0.3 CC(C)(C)[Mg+] H51164 [1,1,0,0,0,0|1,0,0]=3 1028 B4R0.3 CC(C)(C)[Mg+] H66081 [1,1,0,0,0,0|1,0,0]=3 1029 B4R0.3 CC(C)(C)[O-] 30716 [1,1,0,0,0,0|0,0,1]=3 1030 B4R0.3 CC(C)(C)[O-] 36574 [1,1,0,0,0,0|0,0,1]=3 1031 B4R0.3 CC(C)(C)[O-] 39157 [1,1,0,0,0,0|0,0,1]=3 1032 B4R0.3 CC(C)(C)[O-] 39546 [1,1,0,0,0,0|0,0,1]=3 1033 B4R0.3 CC(C)(C)[O-] 39547 [1,1,0,0,0,0|0,0,1]=3 1034 B4R0.3 CC(C)(C)[O-] 40718 [1,1,0,0,0,0|0,0,1]=3 1035 B4R0.3 CC(C)(C)[O-] 41908 [1,1,0,0,0,0|0,0,1]=3 1036 B4R0.3 CC(C)(C)[O-] 42583 [1,1,0,0,0,0|0,0,1]=3 1037 B4R0.3 CC(C)(C)[O-] 43324 [1,1,0,0,0,0|0,0,1]=3 1038 B4R0.3 CC(C)(C)[O-] 44133 [1,1,0,0,0,0|0,0,1]=3 1039 B4R0.3 CC(C)(C)[O-] 46366 [1,1,0,0,0,0|0,0,1]=3 1040 B4R0.3 CC(C)(C)[O-] 89891 [1,1,0,0,0,0|0,0,1]=3 1041 B4R0.3 CC(C)(C)[O-] A13947 [1,1,0,0,0,0|0,0,1]=3 1042 B4R0.3 CC(C)(C)[O-] A19942 [1,1,0,0,0,0|0,0,1]=3 1043 B4R0.3 CC(C)(C)[O-] L16034 [1,1,0,0,0,0|0,0,1]=3 1044 B4R0.3 CC(C)(C)[O-] L19745 [1,1,0,0,0,0|0,0,1]=3 1045 B4R0.3 CC(C)(C)[Zn+] H58351 [1,1,0,0,0,0|1,0,0]=3 1046 B4R0.3 CP(=O)(C)C 30394 [1,1,0,0,0,0|1,0,1]=4 1047 B4R0.3 CP(=O)(C)Cl 30292 [1,1,0,0,0,0|1,0,1]=4 1048 B4R0.3 CP(=O)(O)O A12619 [1,1,0,0,0,0|1,0,0]=3 1049 B4R0.3 CP(=S)(C)C A16762 [1,1,0,0,0,0|1,1,0]=4 1050 B4R0.3 CS(=O)(=O)C B21747 [1,1,0,0,0,0|1,0,1]=4 1051 B4R0.3 CS(=O)(=O)O A13565 [1,1,0,0,0,0|1,0,1]=4 1052 B4R0.3 CS(=O)(=O)O A17803 [1,1,0,0,0,0|1,0,1]=4 1053 B4R0.3 C[As](=O)(C)O A12075 [1,1,0,0,0,0|1,0,0]=3 1054 B4R0.3 C[As](=O)(C)[O-] A18139 [1,1,0,0,0,0|1,0,1]=4 1055 B4R0.3 C[Ge](C)(C)C A16931 [1,1,0,0,0,0|1,1,0]=4 1056 B4R0.3 C[Ge](C)(C)Cl 34129 [1,1,0,0,0,0|1,1,0]=4 1057 B4R0.3 C[Ge](C)(Cl)Cl 34107 [1,1,0,0,0,0|1,1,0]=4 1058 B4R0.3 C[Hf@](C)(C)C H26962 [1,1,0,0,0,0|2,0,0]=4 1059 B4R0.3 C[N+](C)(C)C 20932 [1,1,0,0,0,0|2,0,0]=4 1060 B4R0.3 C[N+](C)(C)C 30833 [1,1,0,0,0,0|2,0,0]=4 1061 B4R0.3 C[N+](C)(C)C 30834 [1,1,0,0,0,0|2,0,0]=4 1062 B4R0.3 C[N+](C)(C)C 41790 [1,1,0,0,0,0|2,0,0]=4 1063 B4R0.3 C[N+](C)(C)C 42710 [1,1,0,0,0,0|2,0,0]=4 1064 B4R0.3 C[N+](C)(C)C 44938 [1,1,0,0,0,0|2,0,0]=4 1065 B4R0.3 C[N+](C)(C)C 44940 [1,1,0,0,0,0|2,0,0]=4 1066 B4R0.3 C[N+](C)(C)C A12811 [1,1,0,0,0,0|2,0,0]=4 1067 B4R0.3 C[N+](C)(C)C A13288 [1,1,0,0,0,0|2,0,0]=4 1068 B4R0.3 C[N+](C)(C)C A13368 [1,1,0,0,0,0|2,0,0]=4 1069 B4R0.3 C[N+](C)(C)C A17655 [1,1,0,0,0,0|2,0,0]=4 1070 B4R0.3 C[N+](C)(C)C A17864 [1,1,0,0,0,0|2,0,0]=4 1071 B4R0.3 C[N+](C)(C)C B24237 [1,1,0,0,0,0|2,0,0]=4 1072 B4R0.3 C[N+](C)(C)C H27659 [1,1,0,0,0,0|2,0,0]=4 1073 B4R0.3 C[N+](C)(C)C L09658 [1,1,0,0,0,0|2,0,0]=4 1074 B4R0.3 C[N+](C)(C)C L09991 [1,1,0,0,0,0|2,0,0]=4 1075 B4R0.3 C[N+](C)(C)[O-] A14916 [1,1,0,0,0,0|1,0,1]=4 1076 B4R0.3 C[P+](C)(C)C A17907 [1,1,0,0,0,0|2,0,0]=4 1077 B4R0.3 C[S+](=O)(C)C A14589 [1,1,0,0,0,0|1,0,1]=4 1078 B4R0.3 C[Si](C)(C)Br A15334 [1,1,0,0,0,0|1,1,0]=4 1079 B4R0.3 C[Si](C)(C)C A13148 [1,1,0,0,0,0|1,1,0]=4 1080 B4R0.3 C[Si](C)(C)Cl A13651 [1,1,0,0,0,0|1,1,0]=4 1081 B4R0.3 C[Si](C)(C)I A12902 [1,1,0,0,0,0|1,1,0]=4 1082 B4R0.3 C[Si](C)(C)O H61276 [1,1,0,0,0,0|0,1,0]=3 1083 B4R0.3 C[Si](C)(Cl)Cl L12133 [1,1,0,0,0,0|1,1,0]=4 1084 B4R0.3 C[Sn](C)(C)C 71145 [1,1,0,0,0,0|2,0,0]=4 1085 B4R0.3 C[Zr@](C)(C)C H27325 [1,1,0,0,0,0|2,0,0]=4 1086 B4R0.3 OP(=O)(O)F H26221 [1,1,0,0,0,0|2,0,0]=4 1087 B4R0.3 OP(=O)(O)O A18067 [1,1,0,0,0,0|2,0,0]=4 1088 B4R0.3 OP(=O)(O)[O-] A11316 [1,1,0,0,0,0|2,0,0]=4 1089 B4R0.3 OP(=O)(O)[O-] A12123 [1,1,0,0,0,0|2,0,0]=4 1090 B4R0.3 OP(=O)(O)[O-] A12142 [1,1,0,0,0,0|2,0,0]=4 1091 B4R0.3 OP(=O)(O)[O-] A15283 [1,1,0,0,0,0|2,0,0]=4 1092 B4R0.3 OP(=O)(O)[O-] A16987 [1,1,0,0,0,0|2,0,0]=4 1093 B4R0.3 OS(=O)(=O)O 88944 [1,1,0,0,0,0|2,0,0]=4 1094 B4R0.3 OS(=O)(=O)O A10792 [1,1,0,0,0,0|2,0,0]=4 1095 B4R0.3 OS(=O)(=O)O B22155 [1,1,0,0,0,0|2,0,0]=4 1096 B4R0.3 OS(=O)(=O)O L10122 [1,1,0,0,0,0|2,0,0]=4 1097 B4R0.3 O[As](=O)(O)[O-] A17644 [1,1,0,0,0,0|2,0,0]=4 1098 B4R0.3 O[Mo](=O)(=O)O A10537 [1,1,0,0,0,0|2,0,0]=4 1099 B4R0.3 [Li]C(C)(C)C 41251 [1,1,0,0,0,0|1,0,0]=3 1100 B4R0.3 [Li]C(C)(C)C 44125 [1,1,0,0,0,0|1,0,0]=3 1101 B4R0.3 [Li]C(C)(C)C 47239 [1,1,0,0,0,0|1,0,0]=3 1102 B6R0.1 C(C(=O)NCO)Cl A12247 [0,2,0,0,0,0|0,0,2]=4 1103 B6R0.1 C(CO)C(CO)O L05138 [0,2,0,0,0,0|0,0,0]=2 1104 B6R0.1 C(CO)[C@@H](CO)O L20258 [0,2,0,0,0,0|0,0,0]=2 1105 B6R0.1 C=CCC(C=C)O L03182 [0,2,0,0,0,0|1,0,1]=4 1106 B6R0.1 CC(CC=O)SC B22033 [0,2,0,0,0,0|0,1,1]=4 1107 B6R0.1 CCC(C#CC)O L09727 [0,2,0,0,0,0|1,0,0]=3 1108 B6R0.1 CCC(C)CCO B22356 [0,2,0,0,0,0|1,0,0]=3 1109 B6R0.1 CCC(CC#C)O L05437 [0,2,0,0,0,0|1,0,0]=3 1110 B6R0.1 CCCC(C#C)O L11549 [0,2,0,0,0,0|1,0,1]=4 1111 B6R0.1 CCCC(C)C#C L09296 [0,2,0,0,0,0|2,0,0]=4 1112 B6R0.1 CCCC(C)C=O B24199 [0,2,0,0,0,0|1,0,1]=4 1113 B6R0.1 CCCC(C=C)O A19672 [0,2,0,0,0,0|1,0,1]=4 1114 B6R0.1 CCCC(CC)Br L00818 [0,2,0,0,0,0|2,0,0]=4 1115 B6R0.1 CCCC(CC)O B20210 [0,2,0,0,0,0|1,0,0]=3 1116 B6R0.1 CCCC(CC)[Zn+] H58535 [0,2,0,0,0,0|2,0,0]=4 1117 B6R0.1 CCOC(=O)CO 41475 [0,2,0,0,0,0|0,0,2]=4 1118 B6R0.1 CCO\C(=N\O)\C A11006 [0,2,0,0,0,0|1,0,1]=4 1119 B6R0.1 CNCC(CO)O L12653 [0,2,0,0,0,0|0,0,0]=2 1120 B6R0.1 COCC(=O)OC B22528 [0,2,0,0,0,0|0,0,2]=4 1121 B6R0.1 COCC(CCl)O L16239 [0,2,0,0,0,0|0,0,0]=2 1122 B6R0.1 COCC(CO)O L08011 [0,2,0,0,0,0|0,0,0]=2 1123 B6R0.2 B(CC(C)C)(O)O H27698 [0,2,0,0,0,0|1,0,0]=3 1124 B6R0.2 C(C(=O)O)C(=O)O 31715 [0,2,0,0,0,0|1,0,1]=4 1125 B6R0.2 C(C(=O)O)C(=O)O A11526 [0,2,0,0,0,0|1,0,1]=4 1126 B6R0.2 CC(C)CC(=C)C B20002 [0,2,0,0,0,0|2,0,0]=4 1127 B6R0.2 CC(C)CC(=O)C 33346 [0,2,0,0,0,0|1,0,1]=4 1128 B6R0.2 CC(C)CC(=O)C 43170 [0,2,0,0,0,0|1,0,1]=4 1129 B6R0.2 CC(C)CC(=O)C A11618 [0,2,0,0,0,0|1,0,1]=4 1130 B6R0.2 CC(C)CC(=O)Cl B24002 [0,2,0,0,0,0|1,0,1]=4 1131 B6R0.2 CC(C)CC(=O)N L09072 [0,2,0,0,0,0|1,0,1]=4 1132 B6R0.2 CC(C)CC(=O)O A18642 [0,2,0,0,0,0|1,0,0]=3 1133 B6R0.2 CC(C)CC(C)C L03570 [0,2,0,0,0,0|2,0,0]=4 1134 B6R0.2 CC(C)CC(C)O A13435 [0,2,0,0,0,0|1,0,0]=3 1135 B6R0.2 CC(C)NC(C)C A10280 [0,2,0,0,0,0|2,0,0]=4 1136 B6R0.2 CC(C)NC(C)C H61341 [0,2,0,0,0,0|2,0,0]=4 1137 B6R0.2 CC(C)SC(C)C B21302 [0,2,0,0,0,0|2,0,0]=4 1138 B6R0.2 CC(C)[N-]C(C)C 47284 [0,2,0,0,0,0|2,0,0]=4 1139 B6R0.2 CC(CC(=O)C)[O-] 12542 [0,2,0,0,0,0|0,0,2]=4 1140 B6R0.2 CC(CC(=O)C)[O-] 44538 [0,2,0,0,0,0|0,0,2]=4 1141 B6R0.2 CC(CC(=O)O)Br B25684 [0,2,0,0,0,0|1,0,0]=3 1142 B6R0.2 CC(CC(=O)O)O 43354 [0,2,0,0,0,0|0,0,0]=2 1143 B6R0.2 CC(CC(=O)O)O H30426 [0,2,0,0,0,0|0,0,0]=2 1144 B6R0.2 CC(CC(=O)[O-])O A11613 [0,2,0,0,0,0|0,0,1]=3 1145 B6R0.2 CC(CC(C)O)O L01779 [0,2,0,0,0,0|0,0,0]=2 1146 B6R0.2 CC(CN(C)C)Cl B20882 [0,2,0,0,0,0|2,0,0]=4 1147 B6R0.2 CC(CN(C)C)O B24234 [0,2,0,0,0,0|1,0,0]=3 1148 B6R0.2 CC([O-])CC(=O)C 46727 [0,2,0,0,0,0|0,0,2]=4 1149 B6R0.2 CN(C)CC(=O)O A18892 [0,2,0,0,0,0|2,0,0]=4 1150 B6R0.2 CN(C)CC(=O)O A19670 [0,2,0,0,0,0|2,0,0]=4 1151 B6R0.2 C[C@@H](CC(C)C)O L18882 [0,2,0,0,0,0|1,0,0]=3 1152 B6R0.2 C[C@@H](C[C@H](C)O)O H36013 [0,2,0,0,0,0|0,0,0]=2 1153 B6R0.2 C[C@H](CC(C)C)O L18881 [0,2,0,0,0,0|1,0,0]=3 1154 B6R0.3 C(C(C(=O)O)Br)F H31718 [0,2,0,0,0,0|1,0,1]=4 1155 B6R0.3 C(C(C(=O)O)N)N L09485 [0,2,0,0,0,0|1,0,1]=4 1156 B6R0.3 C(C(C(=O)O)N)O A15184 [0,2,0,0,0,0|1,0,0]=3 1157 B6R0.3 C(C(C(=O)O)N)S H25779 [0,2,0,0,0,0|1,0,1]=4 1158 B6R0.3 C(C(C(=O)O)N)S H56126 [0,2,0,0,0,0|1,0,1]=4 1159 B6R0.3 C(C(C(=O)O)O)N H53412 [0,2,0,0,0,0|0,0,1]=3 1160 B6R0.3 C(C(C(=O)[O-])O)O L08214 [0,2,0,0,0,0|0,0,1]=3 1161 B6R0.3 C([C@@H](C(=O)N)N)O H65169 [0,2,0,0,0,0|1,0,1]=4 1162 B6R0.3 C([C@@H](C(=O)O)N)N H62128 [0,2,0,0,0,0|1,0,1]=4 1163 B6R0.3 C([C@@H](C(=O)O)N)O A11179 [0,2,0,0,0,0|1,0,0]=3 1164 B6R0.3 C([C@@H](C(=O)O)N)S A10389 [0,2,0,0,0,0|1,0,1]=4 1165 B6R0.3 C([C@@H](C(=O)O)N)S A10435 [0,2,0,0,0,0|1,0,1]=4 1166 B6R0.3 C([C@@H](C(=O)O)N)S L06328 [0,2,0,0,0,0|1,0,1]=4 1167 B6R0.3 C([C@@H](C(=O)O)O)N H60945 [0,2,0,0,0,0|0,0,1]=3 1168 B6R0.3 C([C@H](C(=O)O)N)O A11353 [0,2,0,0,0,0|1,0,0]=3 1169 B6R0.3 C([C@H](C(=O)O)N)S H27107 [0,2,0,0,0,0|1,0,1]=4 1170 B6R0.3 C([C@H](C(=O)O)N)S H62627 [0,2,0,0,0,0|1,0,1]=4 1171 B6R0.3 CC(C(=O)O)NC H65287 [0,2,0,0,0,0|1,0,1]=4 1172 B6R0.3 CC(C(=O)OC)Br A19558 [0,2,0,0,0,0|1,0,1]=4 1173 B6R0.3 CC(C(=O)OC)Cl A18541 [0,2,0,0,0,0|1,0,1]=4 1174 B6R0.3 CC(C(=O)OC)N A12599 [0,2,0,0,0,0|1,0,1]=4 1175 B6R0.3 CC(C(=O)OC)O H60455 [0,2,0,0,0,0|0,0,1]=3 1176 B6R0.3 CC(C)C(=N)OC H63386 [0,2,0,0,0,0|1,0,1]=4 1177 B6R0.3 CC(C)C(=O)OC A14070 [0,2,0,0,0,0|1,0,1]=4 1178 B6R0.3 CC(C)C(C#C)O L05318 [0,2,0,0,0,0|1,0,0]=3 1179 B6R0.3 CC(C)C(C=O)Br H52334 [0,2,0,0,0,0|1,0,1]=4 1180 B6R0.3 CC(C)[C@@H](CO)N L11300 [0,2,0,0,0,0|1,0,0]=3 1181 B6R0.3 CC(C)[C@H](CO)N L14166 [0,2,0,0,0,0|1,0,0]=3 1182 B6R0.3 CC(C)\C(=N\O)\N H50892 [0,2,0,0,0,0|1,0,1]=4 1183 B6R0.3 CC(CO)C(=O)C H28483 [0,2,0,0,0,0|0,0,1]=3 1184 B6R0.3 CC(CO)[N+](=O)[O-] 43843 [0,2,0,0,0,0|0,0,1]=3 1185 B6R0.3 CCC(C(=O)C)S B21797 [0,2,0,0,0,0|1,1,0]=4 1186 B6R0.3 CCC(C(=O)O)Br B21743 [0,2,0,0,0,0|1,0,1]=4 1187 B6R0.3 CCC(C(=O)O)Cl L20083 [0,2,0,0,0,0|1,0,1]=4 1188 B6R0.3 CCC(C(=O)O)N L06035 [0,2,0,0,0,0|1,0,1]=4 1189 B6R0.3 CCC(C(=O)[O-])O A18636 [0,2,0,0,0,0|0,0,2]=4 1190 B6R0.3 CCC(C(C)C)O L08015 [0,2,0,0,0,0|1,0,0]=3 1191 B6R0.3 CCC(C)C(=O)C A19999 [0,2,0,0,0,0|1,0,1]=4 1192 B6R0.3 CCC(C)C(=O)Cl B22599 [0,2,0,0,0,0|1,0,1]=4 1193 B6R0.3 CCC(C)C(=O)O A11546 [0,2,0,0,0,0|1,0,0]=3 1194 B6R0.3 CCC(C)C(C)C 43707 [0,2,0,0,0,0|2,0,0]=4 1195 B6R0.3 CC[C@@H](C(=O)O)N L13984 [0,2,0,0,0,0|1,0,1]=4 1196 B6R0.3 CC[C@H](C(=O)O)N L14096 [0,2,0,0,0,0|1,0,1]=4 1197 B6R0.3 C[C@@H](C(=O)O)NC H60103 [0,2,0,0,0,0|1,0,1]=4 1198 B6R0.3 C[C@@H](C(=O)OC)N A10178 [0,2,0,0,0,0|1,0,1]=4 1199 B6R0.3 C[C@@H](C(=O)OC)O B24468 [0,2,0,0,0,0|0,0,1]=3 1200 B6R0.3 C[C@H](C(=O)O)NC H65840 [0,2,0,0,0,0|1,0,1]=4 1201 B6R0.3 C[C@H](C(=O)OC)N H62472 [0,2,0,0,0,0|1,0,1]=4 1202 B6R0.4 C(COS(=O)O)O H60133 [0,2,0,0,0,0|2,0,0]=4 1203 B6R0.4 CC(=O)NCCO A18638 [0,2,0,0,0,0|0,0,2]=4 1204 B6R0.4 CC(C)CCC#C L06014 [0,2,0,0,0,0|2,0,0]=4 1205 B6R0.4 CC(C)CCC=C B20719 [0,2,0,0,0,0|2,0,0]=4 1206 B6R0.4 CC(C)CN=C=S A18932 [0,2,0,0,0,0|1,1,0]=4 1207 B6R0.4 CC(C)CON=O L05259 [0,2,0,0,0,0|1,0,0]=3 1208 B6R0.4 CC(C)NCCN B23391 [0,2,0,0,0,0|2,0,0]=4 1209 B6R0.4 CC(C)OCCO L13241 [0,2,0,0,0,0|1,0,0]=3 1210 B6R0.4 CC(C)SCCO L05312 [0,2,0,0,0,0|1,0,0]=3 1211 B6R0.4 CC(CCCBr)Br L09842 [0,2,0,0,0,0|2,0,0]=4 1212 B6R0.4 CCC#CC(C)O L11576 [0,2,0,0,0,0|1,0,0]=3 1213 B6R0.4 CCCCC(C)Br L03364 [0,2,0,0,0,0|2,0,0]=4 1214 B6R0.4 CCCCC(C)O L05993 [0,2,0,0,0,0|1,0,0]=3 1215 B6R0.4 CCCCC(C)[Zn+] H58543 [0,2,0,0,0,0|2,0,0]=4 1216 B6R0.4 CCCC[C@@H](C)N L19304 [0,2,0,0,0,0|2,0,0]=4 1217 B6R0.4 CCCC[C@H](C)N L19305 [0,2,0,0,0,0|2,0,0]=4 1218 B6R0.4 CCCC[C@H](C)O L10401 [0,2,0,0,0,0|1,0,0]=3 1219 B6R0.4 CCCNC(C)C H50256 [0,2,0,0,0,0|2,0,0]=4 1220 B6R0.4 CCOCC(=O)O B24194 [0,2,0,0,0,0|1,0,1]=4 1221 B6R0.4 CCOCC(C)O 43306 [0,2,0,0,0,0|0,0,0]=2 1222 B6R0.4 CN(C)CCCO A12800 [0,2,0,0,0,0|2,0,0]=4 1223 B6R0.5 C(CO)C(F)(F)F L16879 [0,2,0,0,0,0|2,0,0]=4 1224 B6R0.5 CC(C)(C)CC=O H55522 [0,2,0,0,0,0|1,0,1]=4 1225 B6R0.5 CC(C)(C)CCCl L11753 [0,2,0,0,0,0|2,0,0]=4 1226 B6R0.5 CC(C)(C)CCO H30194 [0,2,0,0,0,0|1,0,0]=3 1227 B6R0.5 CC(C)(CCBr)Br B20468 [0,2,0,0,0,0|2,0,0]=4 1228 B6R0.5 CC(C)(COC)O L20351 [0,2,0,0,0,0|0,0,0]=2 1229 B6R0.5 CC(C)(COC)[O-] 45488 [0,2,0,0,0,0|0,0,1]=3 1230 B6R0.5 CCCC(C)(C)Cl B20705 [0,2,0,0,0,0|2,0,0]=4 1231 B6R0.5 CCCC(C)(C)O A19090 [0,2,0,0,0,0|1,0,0]=3 1232 B6R0.5 CCOC(C)(C)C B22945 [0,2,0,0,0,0|2,0,0]=4 1233 B6R0.5 COCC(F)(F)F L17887 [0,2,0,0,0,0|2,0,0]=4 1234 B6R0.5 CS(=O)(=O)CCO L03159 [0,2,0,0,0,0|1,0,1]=4 1235 B6R0.5 C[N+](C)(C)CCO A15828 [0,2,0,0,0,0|2,0,0]=4 1236 B6R0.5 C[N+](C)(C)CCO B24443 [0,2,0,0,0,0|2,0,0]=4 1237 B6R0.5 C[N+](C)(C)CCO H27609 [0,2,0,0,0,0|2,0,0]=4 1238 B6R0.5 C[N+](C)(C)CCO L00860 [0,2,0,0,0,0|2,0,0]=4 1239 B6R0.5 C[Si](C)(C)CCO B20970 [0,2,0,0,0,0|1,1,0]=4 1240 B6R0.8 CC(C)(CN)CO L10429 [0,2,0,0,0,0|1,0,0]=3 1241 B6R0.8 CC(C)(CO)CO A10340 [0,2,0,0,0,0|0,0,0]=2 1242 B6R0.8 CC(C)(OC)OC A13810 [0,2,0,0,0,0|2,0,0]=4 1243 B6R0.8 CCC(C)(C)CC 43706 [0,2,0,0,0,0|2,0,0]=4 1244 B6R0.8 CCC(C)(C=C)O B20893 [0,2,0,0,0,0|1,0,0]=3 1245 B6R0.9 B(CC)(CC)OC L15107 [0,2,0,0,0,0|2,0,0]=4 1246 B6R0.9 CCC(CC)C=O B23465 [0,2,0,0,0,0|1,0,1]=4 1247 B6R0.9 CCC(CC)CBr H26445 [0,2,0,0,0,0|2,0,0]=4 1248 B6R0.9 CCC(CC)CN B20855 [0,2,0,0,0,0|2,0,0]=4 1249 B6R0.9 CCC(CC)CO B21026 [0,2,0,0,0,0|1,0,0]=3 1250 B6R0.9 CCC(CC)C[Zn+] H58054 [0,2,0,0,0,0|2,0,0]=4 1251 B6R0.9 COC(C=O)OC L18490 [0,2,0,0,0,0|0,0,2]=4 1252 B6R0.9 COC(CBr)OC A11324 [0,2,0,0,0,0|1,0,0]=3 1253 B6R0.9 COC(CCl)OC B25049 [0,2,0,0,0,0|1,0,0]=3 1254 B6R0.9 COC(CN)OC A15498 [0,2,0,0,0,0|1,0,0]=3 1255 B6R0.9 COC(CO)OC L07099 [0,2,0,0,0,0|0,0,0]=2 1256 B6R0.9 COC(OC)OC A13760 [0,2,0,0,0,0|2,0,0]=4 1257 B6R0.7 CC(=O)C(C)(C)O 43724 [0,2,0,0,0,0|0,0,2]=4 1258 B6R0.7 CC(C(=O)O)(F)F H26030 [0,2,0,0,0,0|1,0,1]=4 1259 B6R0.7 CC(C(C)(C)C)N A11530 [0,2,0,0,0,0|2,0,0]=4 1260 B6R0.7 CC(C(C)(C)C)O 43725 [0,2,0,0,0,0|1,0,0]=3 1261 B6R0.7 CC(C(F)(F)F)O L11150 [0,2,0,0,0,0|1,0,0]=3 1262 B6R0.7 CC(C)(C(=O)O)Br A15854 [0,2,0,0,0,0|1,0,1]=4 1263 B6R0.7 CC(C)(C(=O)O)F H25837 [0,2,0,0,0,0|1,0,1]=4 1264 B6R0.7 CC(C)(C(=O)O)N A13021 [0,2,0,0,0,0|1,0,1]=4 1265 B6R0.7 CC(C)(C(=O)O)O A13146 [0,2,0,0,0,0|0,0,1]=3 1266 B6R0.7 CC(C)(C)C(=O)O A10776 [0,2,0,0,0,0|1,0,1]=4 1267 B6R0.7 C[C@@H](C(C)(C)C)N L16327 [0,2,0,0,0,0|2,0,0]=4 1268 B6R0.7 C[C@H](C(C)(C)C)N L16326 [0,2,0,0,0,0|2,0,0]=4 1269 B4R1.1 C1CNC1 H56351 [1,0,0,1,0,0|1,0,0]=3 1270 B4R1.1 C1CNC1 H59935 [1,0,0,1,0,0|1,0,0]=3 1271 B4R1.1 C1COC1 A14452 [1,0,0,1,0,0|0,0,0]=2 1272 B4R1.2 C1CC1Br A14996 [1,0,0,1,0,0|1,0,0]=3 1273 B4R1.2 C1CC1N A13844 [1,0,0,1,0,0|1,0,0]=3 1274 B4R1.2 C1CC1[Mg+] H26273 [1,0,0,1,0,0|1,0,0]=3 1275 B4R1.2 C1CC1[Mg+] H51158 [1,0,0,1,0,0|1,0,0]=3 1276 B4R1.2 C1CC1[Mg+] H66668 [1,0,0,1,0,0|1,0,0]=3 1277 B4R1.2 C1CC1[Zn+] H58008 [1,0,0,1,0,0|1,0,0]=3 1278 B4R1.2 CC1CO1 30765 [1,0,0,1,0,0|0,0,0]=2 1279 B4R1.2 C[C@@H]1CO1 B21884 [1,0,0,1,0,0|0,0,0]=2 1280 B4R1.2 C[C@H]1CO1 B22341 [1,0,0,1,0,0|0,0,0]=2 1281 B6R1.2 C1CCC(C1)Br A15455 [0,1,0,1,0,0|2,0,0]=4 1282 B6R1.2 C1CCC(C1)Cl B25023 [0,1,0,1,0,0|2,0,0]=4 1283 B6R1.2 C1CCC(C1)I L01522 [0,1,0,1,0,0|2,0,0]=4 1284 B6R1.2 C1CCC(C1)N L01966 [0,1,0,1,0,0|2,0,0]=4 1285 B6R1.2 C1CCC(C1)O A15249 [0,1,0,1,0,0|1,0,0]=3 1286 B6R1.2 C1CCC(C1)S 39539 [0,1,0,1,0,0|1,1,0]=4 1287 B6R1.2 C1CCC(C1)S L03577 [0,1,0,1,0,0|1,1,0]=4 1288 B6R1.2 C1CCC(C1)[Mg+] H51166 [0,1,0,1,0,0|2,0,0]=4 1289 B6R1.2 C1CCC(C1)[Zn+] H58764 [0,1,0,1,0,0|2,0,0]=4 1290 B6R1.2 C1CNCC1Br H66833 [0,1,0,1,0,0|2,0,0]=4 1291 B6R1.2 C1CNCC1O H64975 [0,1,0,1,0,0|1,0,0]=3 1292 B6R1.2 C1CNC[C@@H]1F H26947 [0,1,0,1,0,0|2,0,0]=4 1293 B6R1.2 C1CNC[C@@H]1N L11173 [0,1,0,1,0,0|2,0,0]=4 1294 B6R1.2 C1CNC[C@@H]1O H52743 [0,1,0,1,0,0|1,0,0]=3 1295 B6R1.2 C1CNC[C@@H]1O L19499 [0,1,0,1,0,0|1,0,0]=3 1296 B6R1.2 C1CNC[C@H]1F H27536 [0,1,0,1,0,0|2,0,0]=4 1297 B6R1.2 C1CNC[C@H]1N L12222 [0,1,0,1,0,0|2,0,0]=4 1298 B6R1.2 C1CNC[C@H]1N L19500 [0,1,0,1,0,0|2,0,0]=4 1299 B6R1.2 C1CNC[C@H]1O H52815 [0,1,0,1,0,0|1,0,0]=3 1300 B6R1.2 C1CNC[C@H]1O L19498 [0,1,0,1,0,0|1,0,0]=3 1301 B6R1.2 C1COCC1=O H66940 [0,1,0,1,0,0|0,0,2]=4 1302 B6R1.2 C1COC[C@@H]1O H56307 [0,1,0,1,0,0|0,0,0]=2 1303 B6R1.2 C1COC[C@H]1N H66034 [0,1,0,1,0,0|1,0,0]=3 1304 B6R1.2 C1COC[C@H]1O H56476 [0,1,0,1,0,0|0,0,0]=2 1305 B6R1.2 CC1=NCCO1 B24612 [0,1,0,1,0,0|1,0,1]=4 1306 B6R1.2 CC1CCCC1 L03988 [0,1,0,1,0,0|2,0,0]=4 1307 B6R1.2 CC1CCCN1 31902 [0,1,0,1,0,0|2,0,0]=4 1308 B6R1.2 CC1CCCO1 L07356 [0,1,0,1,0,0|1,0,0]=3 1309 B6R1.2 CC1CCCS1 43456 [0,1,0,1,0,0|1,1,0]=4 1310 B6R1.2 CC1NCCS1 B22537 [0,1,0,1,0,0|1,1,0]=4 1311 B6R1.2 CC1OCCO1 A12824 [0,1,0,1,0,0|1,0,0]=3 1312 B6R1.2 CC1SCCS1 B23372 [0,1,0,1,0,0|1,1,0]=4 1313 B6R1.2 C[C@@H]1CCCN1 H57885 [0,1,0,1,0,0|2,0,0]=4 1314 B6R1.3 C1CC1CC#N L11950 [0,1,0,1,0,0|2,0,0]=4 1315 B6R1.3 C1CC1CCO L11080 [0,1,0,1,0,0|1,0,0]=3 1316 B6R1.8 CC1CC1CO H27337 [0,1,0,1,0,0|1,0,0]=3 1317 B6R1.9 C1C(C1(F)F)N H29051 [0,1,0,1,0,0|2,0,0]=4 1318 B6R1.10 C1C(CN1)(F)F H25751 [0,1,0,1,0,0|2,0,0]=4 1319 B6R1.10 CC1(COC1)C H27370 [0,1,0,1,0,0|1,0,0]=3 1320 B6R1.10 CC1(COC1)N H57588 [0,1,0,1,0,0|1,0,0]=3 1321 B6R1.11 B(C1CC1)(O)O H26254 [0,1,0,1,0,0|2,0,0]=4 1322 B6R1.11 C1CC1C(=O)O A14215 [0,1,0,1,0,0|1,0,1]=4 1323 B6R1.11 CC(C)C1CO1 L19291 [0,1,0,1,0,0|1,0,0]=3 1324 B6R1.11 C[C@@H](C1CC1)N H27499 [0,1,0,1,0,0|2,0,0]=4 1325 B6R1.11 C[C@H](C1CC1)N H26902 [0,1,0,1,0,0|2,0,0]=4 1326 B6R1.6 C1C(CN1)CO H57801 [0,1,0,1,0,0|1,0,0]=3 1327 B6R1.6 C1C(CO1)CN H66510 [0,1,0,1,0,0|1,0,0]=3 1328 B6R1.6 C1C(CO1)CO H66333 [0,1,0,1,0,0|0,0,0]=2 1329 B6R1.6 C1CC(C1)C#N A10309 [0,1,0,1,0,0|2,0,0]=4 1330 B6R1.6 C1CC(C1)CO B21480 [0,1,0,1,0,0|1,0,0]=3 1331 B6R1.6 C1COC1CBr H66276 [0,1,0,1,0,0|1,0,0]=3 1332 B6R1.6 C1COC1CI H66525 [0,1,0,1,0,0|1,0,0]=3 1333 B6R1.6 C1COC1CO H66218 [0,1,0,1,0,0|0,0,0]=2 1334 B6R1.6 CNC1COC1 H57425 [0,1,0,1,0,0|1,0,0]=3 1335 B6R1.6 COC1CNC1 H57769 [0,1,0,1,0,0|1,0,0]=3 1336 B6R1.7 CC1(CO1)C=C L19768 [0,1,0,1,0,0|1,0,0]=3