0 B4R0.1 C#C[C@@H](C)O AMY24232 [0,0,0,0,0,0|2,0,1]=3 1 B4R0.1 C#C[C@H](C)Br AMY12092 [0,0,0,0,0,0|2,0,1]=3 2 B4R0.1 C#C[C@H](C)N AM806670 [0,0,0,0,0,0|2,0,1]=3 3 B4R0.1 C#C[C@H](C)O AMY34392 [0,0,0,0,0,0|2,0,1]=3 4 B4R0.1 C=C(Br)C=O AMY19362 [0,0,0,0,0,0|1,0,2]=3 5 B4R0.1 C=C(C)C=O AMY28760 [0,0,0,0,0,0|0,0,2]=2 6 B4R0.1 C=C(C)CBr AM85592 [0,0,0,0,0,0|1,0,3]=4 7 B4R0.1 C=C(C)CN AMY13356 [0,0,0,0,0,0|1,0,3]=4 8 B4R0.1 C=C=C(C)C AMY42296 [0,0,0,0,0,0|1,0,2]=3 9 B4R0.1 C=CC(=C)C AMY37001 [0,0,0,0,0,0|1,0,2]=3 10 B4R0.1 C=CC(=O)Cl AMY18873 [0,0,0,0,0,0|3,0,1]=4 11 B4R0.1 C=CC(=O)[O-] AMY3817 [0,0,0,0,0,0|3,0,1]=4 12 B4R0.1 C=C[C@H](C)Cl AMY617 [0,0,0,0,0,0|2,0,0]=2 13 B4R0.1 C=C[C@H](C)O AMY1257 [0,0,0,0,0,0|2,0,0]=2 14 B4R0.1 C=C[N+](=O)[O-] AMY36706 [0,0,0,0,0,0|4,0,0]=4 15 B4R0.1 CC(=N)NO AMY18111 [0,0,0,0,0,0|2,0,2]=4 16 B4R0.1 CC(=O)C#N AMY39183 [0,0,0,0,0,0|2,0,2]=4 17 B4R0.1 CC(=O)CBr AM85840 [0,0,0,0,0,0|2,0,2]=4 18 B4R0.1 CC(=O)CN AMY15017 [0,0,0,0,0,0|2,0,2]=4 19 B4R0.1 CC(=O)CN AMY25062 [0,0,0,0,0,0|2,0,2]=4 20 B4R0.1 CC(=O)NN AM20080014 [0,0,0,0,0,0|3,0,1]=4 21 B4R0.1 CC(=O)NO AM20100343 [0,0,0,0,0,0|2,0,2]=4 22 B4R0.1 CC(C)=CBr AM85707 [0,0,0,0,0,0|1,0,1]=2 23 B4R0.1 CC(C)=NN AM9761 [0,0,0,0,0,0|2,0,1]=3 24 B4R0.1 CC(C)=NO AM90369 [0,0,0,0,0,0|1,0,2]=3 25 B4R0.1 CC(C)CBr AMY25783 [0,0,0,0,0,0|1,0,1]=2 26 B4R0.1 CC(C)NN AM20090002 [0,0,0,0,0,0|2,0,0]=2 27 B4R0.1 CC(C)NN AMY202003297 [0,0,0,0,0,0|2,0,0]=2 28 B4R0.1 CC(C)ON AM90376 [0,0,0,0,0,0|2,0,0]=2 29 B4R0.1 CCC(C)[O-] AMY22246 [0,0,0,0,0,0|2,0,1]=3 30 B4R0.1 CCN(C)C AMY13339 [0,0,0,0,0,0|2,0,1]=3 31 B4R0.1 CC[C@H](C)O AMY11001 [0,0,0,0,0,0|2,0,1]=3 32 B4R0.1 CN(C)C=S AMY40664 [0,0,0,0,0,0|1,1,0]=2 33 B4R0.1 CN(C)CCl AMY39211 [0,0,0,0,0,0|2,0,1]=3 34 B4R0.1 CNC(C)=O AMY4115 [0,0,0,0,0,0|3,0,1]=4 35 B4R0.1 CNC(C)C AMY13353 [0,0,0,0,0,0|2,0,0]=2 36 B4R0.1 COC(Cl)Cl AMY31937 [0,0,0,0,0,0|4,0,0]=4 37 B4R0.1 C[C@@H](Cl)CO AMY21413 [0,0,0,0,0,0|1,0,2]=3 38 B4R0.1 C[C@@H](N)CN AMY3648 [0,0,0,0,0,0|2,0,1]=3 39 B4R0.1 C[C@H](Br)C#N AMY39192 [0,0,0,0,0,0|2,0,1]=3 40 B4R0.1 C[C@H](Cl)CO AMY21357 [0,0,0,0,0,0|1,0,2]=3 41 B4R0.1 C[C@H](N)C#N AM9634 [0,0,0,0,0,0|2,0,1]=3 42 B4R0.1 C[C@H](N)CN AMY3672 [0,0,0,0,0,0|2,0,1]=3 43 B4R0.1 C[C@H](N)CO AM20090557 [0,0,0,0,0,0|1,0,2]=3 44 B4R0.1 C[C@H](N)CO AM20100507 [0,0,0,0,0,0|1,0,2]=3 45 B4R0.1 C[C@H](O)CN AM20090353 [0,0,0,0,0,0|2,0,1]=3 46 B4R0.1 C[C@H](O)CN AM20100779 [0,0,0,0,0,0|2,0,1]=3 47 B4R0.1 C[C@H](O)CN AM81450 [0,0,0,0,0,0|2,0,1]=3 48 B4R0.1 FC(F)CCl AMY6873 [0,0,0,0,0,0|3,0,1]=4 49 B4R0.1 FC(F)CI AMY20040 [0,0,0,0,0,0|3,0,1]=4 50 B4R0.1 F[C@@H](Br)CBr AMY6863 [0,0,0,0,0,0|3,0,1]=4 51 B4R0.1 N#CC(Cl)Cl AMY3929 [0,0,0,0,0,0|3,0,1]=4 52 B4R0.1 NCC(F)F AMY7132 [0,0,0,0,0,0|3,0,1]=4 53 B4R0.1 O=CC(=O)O AMY40947 [0,0,0,0,0,0|2,0,1]=3 54 B4R0.1 OCC(F)F AMY3957 [0,0,0,0,0,0|2,0,2]=4 55 B4R0.1 [Li]CC(C)C AMY14929 [0,0,0,0,0,0|1,0,1]=2 56 B4R0.1 [Li][C@@H](C)CC AMY14890 [0,0,0,0,0,0|2,0,1]=3 57 B3R0.1 BrCCBr AMY25519 [1,0,0,0,0,0|2,0,1]=4 58 B3R0.1 C#CCBr AM85466 [1,0,0,0,0,0|2,0,1]=4 59 B3R0.1 C#CCN AM86798 [1,0,0,0,0,0|2,0,1]=4 60 B3R0.1 C#CCN AMY22227 [1,0,0,0,0,0|2,0,1]=4 61 B3R0.1 C=CCN AMY22118 [1,0,0,0,0,0|2,0,0]=3 62 B3R0.1 CC#C[Mg+] AMY1254 [1,0,0,0,0,0|1,0,2]=4 63 B3R0.1 CCCO AMY11110 [1,0,0,0,0,0|0,0,2]=3 64 B3R0.1 CCNN AM10026 [1,0,0,0,0,0|2,0,0]=3 65 B3R0.1 CCNN AMY202003286 [1,0,0,0,0,0|2,0,0]=3 66 B3R0.1 CCON AM90373 [1,0,0,0,0,0|2,0,0]=3 67 B3R0.1 CN=C=S AMY11073 [1,0,0,0,0,0|1,1,1]=4 68 B3R0.1 CNOC AM20100609 [1,0,0,0,0,0|3,0,0]=4 69 B3R0.1 CSSC AMY39506 [1,0,0,0,0,0|3,0,0]=4 70 B3R0.1 C[Se][Se]C AMY31938 [1,0,0,0,0,0|3,0,0]=4 71 B3R0.1 C\C=C\Br AMY19968 [1,0,0,0,0,0|1,0,1]=3 72 B3R0.1 ClCCBr AMY25520 [1,0,0,0,0,0|2,0,1]=4 73 B3R0.1 ClCCCl AMY33455 [1,0,0,0,0,0|2,0,1]=4 74 B3R0.1 FCCBr AMY39418 [1,0,0,0,0,0|2,0,1]=4 75 B3R0.1 FCCI AM20100746 [1,0,0,0,0,0|2,0,1]=4 76 B3R0.1 N#CCBr AMY21970 [1,0,0,0,0,0|2,0,1]=4 77 B3R0.1 N#CCF AMY33527 [1,0,0,0,0,0|2,0,1]=4 78 B3R0.1 N#CCN AMY19488 [1,0,0,0,0,0|2,0,1]=4 79 B3R0.1 NCCBr AM20090316 [1,0,0,0,0,0|2,0,1]=4 80 B3R0.1 NCCCl AMY3602 [1,0,0,0,0,0|2,0,1]=4 81 B3R0.1 NCCF AM20100176 [1,0,0,0,0,0|2,0,1]=4 82 B3R0.1 NCCS AMY202100105 [1,0,0,0,0,0|1,1,1]=4 83 B3R0.1 NNC=O AM9981 [1,0,0,0,0,0|2,0,0]=3 84 B3R0.1 OCCBr AMY39504 [1,0,0,0,0,0|1,0,2]=4 85 B3R0.1 OCCF AMY25659 [1,0,0,0,0,0|1,0,2]=4 86 B3R0.1 OCCO AMY22336 [1,0,0,0,0,0|1,0,2]=4 87 B3R0.2 BrC(Br)Br AMY21869 [1,0,0,0,0,0|3,0,0]=4 88 B3R0.2 C=C(C)Br AMY955 [1,0,0,0,0,0|1,0,1]=3 89 B3R0.2 C=C(C)[Mg+] AMY1042 [1,0,0,0,0,0|1,0,1]=3 90 B3R0.2 C=C(F)Cl AMY6847 [1,0,0,0,0,0|2,0,1]=4 91 B3R0.2 CC(=O)Br AMY21856 [1,0,0,0,0,0|1,0,1]=3 92 B3R0.2 CC(=O)O AMY21906 [1,0,0,0,0,0|1,0,1]=3 93 B3R0.2 CC(=O)O AMY41276 [1,0,0,0,0,0|1,0,1]=3 94 B3R0.2 CC(=O)[O-] AMY11747 [1,0,0,0,0,0|1,0,1]=3 95 B3R0.2 CC(=O)[O-] AMY1789 [1,0,0,0,0,0|1,0,1]=3 96 B3R0.2 CC(=O)[O-] AMY22485 [1,0,0,0,0,0|1,0,1]=3 97 B3R0.2 CC(=O)[O-] AMY22494 [1,0,0,0,0,0|1,0,1]=3 98 B3R0.2 CC(=O)[O-] AMY23396 [1,0,0,0,0,0|1,0,1]=3 99 B3R0.2 CC(=O)[O-] AMY23411 [1,0,0,0,0,0|1,0,1]=3 100 B3R0.2 CC(=O)[O-] AMY37172 [1,0,0,0,0,0|1,0,1]=3 101 B3R0.2 CC(=O)[O-] AMY9236 [1,0,0,0,0,0|1,0,1]=3 102 B3R0.2 CC(C)Br AMY37129 [1,0,0,0,0,0|1,0,0]=2 103 B3R0.2 CC(C)O AMY11029 [1,0,0,0,0,0|0,0,1]=2 104 B3R0.2 CC(C)[Mg+] AMY40195 [1,0,0,0,0,0|1,0,0]=2 105 B3R0.2 CC(C)[O-] AMY38606 [1,0,0,0,0,0|0,0,1]=2 106 B3R0.2 CC(C)[O-] AMY40472 [1,0,0,0,0,0|0,0,1]=2 107 B3R0.2 CP(C)C AMY19776 [1,0,0,0,0,0|1,0,1]=3 108 B3R0.2 CS(C)=O AMY14894 [1,0,0,0,0,0|1,0,0]=2 109 B3R0.2 C[PH](C)=O AM90266 [1,0,0,0,0,0|1,0,0]=2 110 B3R0.2 C[S+](C)C AMY12539 [1,0,0,0,0,0|1,0,1]=3 111 B3R0.2 C[S+](C)C AMY9344 [1,0,0,0,0,0|1,0,1]=3 112 B3R0.2 C[SiH](C)C AMY21899 [1,0,0,0,0,0|0,1,1]=3 113 B3R0.2 FC(Br)Br AMY6818 [1,0,0,0,0,0|3,0,0]=4 114 B3R0.2 NC(N)=O AMY37159 [1,0,0,0,0,0|2,0,1]=4 115 B3R0.2 N[13C](N)=O AMY37002 [1,0,0,0,0,0|2,0,1]=4 116 B3R0.2 O=C([O-])O AMY40219 [1,0,0,0,0,0|2,0,1]=4 117 B3R0.2 O=C([O-])[O-] AMY31070 [1,0,0,0,0,0|2,0,1]=4 118 B3R0.2 O=[N+]([O-])[O-] AMY22245 [1,0,0,0,0,0|3,0,0]=4 119 B3R0.2 O=[N+]([O-])[O-] AMY22270 [1,0,0,0,0,0|3,0,0]=4 120 B3R0.2 O=[N+]([O-])[O-] AMY22502 [1,0,0,0,0,0|3,0,0]=4 121 B3R0.2 O=[Si]([O-])[O-] AMY37025 [1,0,0,0,0,0|2,1,0]=4 122 B5R0.1 C=CCC(C)=O AMY31929 [0,1,0,0,0,0|2,0,1]=4 123 B5R0.1 C=CC[C@H](C)N AM9152 [0,1,0,0,0,0|2,0,0]=3 124 B5R0.1 C=CC[C@H](C)O AM804193 [0,1,0,0,0,0|2,0,0]=3 125 B5R0.1 CC(=O)\C=N\O AM806560 [0,1,0,0,0,0|1,0,2]=4 126 B5R0.1 CC(C)=CC=O AMY42093 [0,1,0,0,0,0|0,0,1]=2 127 B5R0.1 CC(C)=CCBr AMY21882 [0,1,0,0,0,0|1,0,1]=3 128 B5R0.1 CC(C)CNN AM806328 [0,1,0,0,0,0|1,0,1]=3 129 B5R0.1 CC(C)CNN AM9787 [0,1,0,0,0,0|1,0,1]=3 130 B5R0.1 CC(C)CON AMY31434 [0,1,0,0,0,0|0,0,2]=3 131 B5R0.1 CC(C)OCCl AMY23885 [0,1,0,0,0,0|1,0,1]=3 132 B5R0.1 CC(C)\C=N\O AMY37290 [0,1,0,0,0,0|0,0,1]=2 133 B5R0.1 CCC[C@H](C)N AMY12548 [0,1,0,0,0,0|2,0,1]=4 134 B5R0.1 CCNC(C)C AMY13342 [0,1,0,0,0,0|1,0,1]=3 135 B5R0.1 CN(C)CCBr AM84884 [0,1,0,0,0,0|2,0,1]=4 136 B5R0.1 CN(C)CCCl AM20080022 [0,1,0,0,0,0|2,0,1]=4 137 B5R0.1 CN(C)CCCl AM20100171 [0,1,0,0,0,0|2,0,1]=4 138 B5R0.1 CN(C)CCN AM20080032 [0,1,0,0,0,0|2,0,1]=4 139 B5R0.1 COC[C@@H](C)N AMY19545 [0,1,0,0,0,0|1,0,2]=4 140 B5R0.1 COC[C@H](C)O AM20100219 [0,1,0,0,0,0|1,0,2]=4 141 B5R0.1 C[C@@H](O)CCO AMY25740 [0,1,0,0,0,0|1,0,2]=4 142 B5R0.1 C[C@H](N)CCO AM84886 [0,1,0,0,0,0|1,0,2]=4 143 B5R0.1 C[C@H](N)CCO AM9719 [0,1,0,0,0,0|1,0,2]=4 144 B5R0.1 C[C@H](N)CCO AMY409 [0,1,0,0,0,0|1,0,2]=4 145 B5R0.1 C[C@H](O)CNN AM803409 [0,1,0,0,0,0|2,0,1]=4 146 B5R0.1 C\C(Br)=C/CO AMY11209 [0,1,0,0,0,0|1,0,2]=4 147 B5R0.1 C\C=C\C(C)=O AMY31928 [0,1,0,0,0,0|2,0,1]=4 148 B5R0.3 C=CC(=O)CBr AMY31126 [0,1,0,0,0,0|2,0,1]=4 149 B5R0.3 C=CC(O)C=C AMY14244 [0,1,0,0,0,0|2,0,1]=4 150 B5R0.3 C=C[C@@H](O)CC AMY851 [0,1,0,0,0,0|2,0,0]=3 151 B5R0.3 C=C[C@H](N)CO AMY14650 [0,1,0,0,0,0|2,0,0]=3 152 B5R0.3 CC(CBr)CBr AMY21213 [0,1,0,0,0,0|1,0,1]=3 153 B5R0.3 CC(CI)CI AMY32062 [0,1,0,0,0,0|1,0,1]=3 154 B5R0.3 CCC(N)CC AMY4054 [0,1,0,0,0,0|2,0,1]=4 155 B5R0.3 CCN(C)CC AMY13336 [0,1,0,0,0,0|2,0,1]=4 156 B5R0.3 CC[C@@H](N)CO AM85835 [0,1,0,0,0,0|1,0,2]=4 157 B5R0.3 CC[C@@H](O)CN AMY6653 [0,1,0,0,0,0|2,0,1]=4 158 B5R0.3 CC[C@@H](O)CO AMY40578 [0,1,0,0,0,0|1,0,2]=4 159 B5R0.3 CC[C@H](Br)CBr AMY31902 [0,1,0,0,0,0|2,0,1]=4 160 B5R0.3 CC[C@H](C)CBr AMY28688 [0,1,0,0,0,0|1,0,1]=3 161 B5R0.3 CC[C@H](C)NN AM803011 [0,1,0,0,0,0|2,0,0]=3 162 B5R0.3 CC[C@H](C)NN AM9772 [0,1,0,0,0,0|2,0,0]=3 163 B5R0.3 CC[C@H](N)CO AM85834 [0,1,0,0,0,0|1,0,2]=4 164 B5R0.3 CC[C@H](N)CO AM85988 [0,1,0,0,0,0|1,0,2]=4 165 B5R0.3 CC[C@H](O)CO AMY40584 [0,1,0,0,0,0|1,0,2]=4 166 B5R0.3 CC\C(C)=N\O AM90385 [0,1,0,0,0,0|1,0,2]=4 167 B5R0.3 CN(C=O)C=O AMY39203 [0,1,0,0,0,0|1,0,1]=3 168 B5R0.3 COC(=O)C=O AMY1633 [0,1,0,0,0,0|1,0,1]=3 169 B5R0.3 CO[C@@H](C)CN AMY21775 [0,1,0,0,0,0|1,0,1]=3 170 B5R0.3 C[C@@H](CO)CBr AMY14347 [0,1,0,0,0,0|0,0,2]=3 171 B5R0.3 ClCC(Cl)CCl AMY22833 [0,1,0,0,0,0|2,0,1]=4 172 B5R0.3 NC(CO)CO AM20100310 [0,1,0,0,0,0|1,0,2]=4 173 B5R0.3 NCC(O)CN AM20100500 [0,1,0,0,0,0|2,0,1]=4 174 B5R0.3 NC[C@H](F)CO AMY34391 [0,1,0,0,0,0|1,0,2]=4 175 B5R0.3 NC[C@H](O)CCl AMY31075 [0,1,0,0,0,0|2,0,1]=4 176 B5R0.3 NC[C@H](O)CO AM20100501 [0,1,0,0,0,0|1,0,2]=4 177 B5R0.3 NC[C@H](O)CO AM20100602 [0,1,0,0,0,0|1,0,2]=4 178 B5R0.3 NC[C@H](O)CO AMY18546 [0,1,0,0,0,0|1,0,2]=4 179 B5R0.3 O=CC(Br)C=O AM20090162 [0,1,0,0,0,0|1,0,1]=3 180 B5R0.3 OC[C@H](Br)CBr AMY25826 [0,1,0,0,0,0|1,0,2]=4 181 B5R0.3 OC[C@H](O)CCl AM81448 [0,1,0,0,0,0|1,0,2]=4 182 B5R0.3 OC[C@H](O)CCl AM81449 [0,1,0,0,0,0|1,0,2]=4 183 B5R0.3 OC[C@H](O)CCl AMY21866 [0,1,0,0,0,0|1,0,2]=4 184 B5R0.4 C#CC(C)(C)Cl AMY19182 [0,1,0,0,0,0|1,0,1]=3 185 B5R0.4 C#CC(C)(C)F AMY30164 [0,1,0,0,0,0|1,0,1]=3 186 B5R0.4 C#CC(C)(C)N AMY19729 [0,1,0,0,0,0|1,0,1]=3 187 B5R0.4 C#CC(C)(C)O AMY3792 [0,1,0,0,0,0|1,0,1]=3 188 B5R0.4 C#C[Si](C)(C)C AMY1236 [0,1,0,0,0,0|1,1,1]=4 189 B5R0.4 C=CC(C)(C)O AMY3791 [0,1,0,0,0,0|1,0,0]=2 190 B5R0.4 C=CC(F)(F)Br AMY37200 [0,1,0,0,0,0|3,0,0]=4 191 B5R0.4 C=C[Si](C)(C)C AMY1250 [0,1,0,0,0,0|1,1,0]=3 192 B5R0.4 CC(C)(C)C=O AMY14201 [0,1,0,0,0,0|0,0,0]=1 193 B5R0.4 CC(C)(C)CBr AMY020 [0,1,0,0,0,0|1,0,1]=3 194 B5R0.4 CC(C)(C)CCl AMY1168 [0,1,0,0,0,0|1,0,1]=3 195 B5R0.4 CC(C)(C)CI AMY25581 [0,1,0,0,0,0|1,0,1]=3 196 B5R0.4 CC(C)(C)CN AMY5183 [0,1,0,0,0,0|1,0,1]=3 197 B5R0.4 CC(C)(C)CO AMY18878 [0,1,0,0,0,0|0,0,2]=3 198 B5R0.4 CC(C)(C)NN AMY4095 [0,1,0,0,0,0|2,0,0]=3 199 B5R0.4 CC(C)(N)C#N AM20090129 [0,1,0,0,0,0|1,0,1]=3 200 B5R0.4 CC(C)(N)CN AMY14283 [0,1,0,0,0,0|1,0,1]=3 201 B5R0.4 CC(C)(N)CO AMY25550 [0,1,0,0,0,0|0,0,2]=3 202 B5R0.4 CC(C)(O)CCl AMY10400 [0,1,0,0,0,0|1,0,1]=3 203 B5R0.4 CC(C)(O)CN AM20090364 [0,1,0,0,0,0|1,0,1]=3 204 B5R0.4 CC(F)(F)CCl AMY6016 [0,1,0,0,0,0|2,0,1]=4 205 B5R0.4 CC(F)(F)CN AMY1251 [0,1,0,0,0,0|2,0,1]=4 206 B5R0.4 CC(F)(F)CO AMY1243 [0,1,0,0,0,0|1,0,2]=4 207 B5R0.4 CCC(C)(C)O AMY11089 [0,1,0,0,0,0|1,0,1]=3 208 B5R0.4 CCC(C)(C)[O-] AMY33539 [0,1,0,0,0,0|1,0,1]=3 209 B5R0.4 COC(C)(C)C AMY11032 [0,1,0,0,0,0|2,0,0]=3 210 B5R0.4 CP(C)(=O)CCl AM10868 [0,1,0,0,0,0|2,0,1]=4 211 B5R0.4 CP(C)(=O)CO AM10876 [0,1,0,0,0,0|1,0,2]=4 212 B5R0.4 C[Si](C)(C)C#N AMY6985 [0,1,0,0,0,0|1,1,1]=4 213 B5R0.4 C[Si](C)(C)CBr AMY42229 [0,1,0,0,0,0|1,1,1]=4 214 B5R0.4 C[Si](C)(C)CCl AMY39317 [0,1,0,0,0,0|1,1,1]=4 215 B5R0.4 C[Si](C)(C)CI AMY42187 [0,1,0,0,0,0|1,1,1]=4 216 B5R0.4 C[Si](C)(C)CO AMY36454 [0,1,0,0,0,0|0,1,2]=4 217 B5R0.4 O=CC(F)(F)F AMY7125 [0,1,0,0,0,0|2,0,0]=3 218 B5R0.4 [Li]C[Si](C)(C)C AMY14833 [0,1,0,0,0,0|1,1,1]=4 219 B5R0.5 C=C(C)C(=O)Cl AMY25816 [0,1,0,0,0,0|0,0,2]=3 220 B5R0.5 C=C(C)C(N)=O AMY13351 [0,1,0,0,0,0|0,0,2]=3 221 B5R0.5 C=C(F)C(=O)O AM84938 [0,1,0,0,0,0|1,0,2]=4 222 B5R0.5 CC(=O)C(=O)O AMY6082 [0,1,0,0,0,0|1,0,1]=3 223 B5R0.5 CC(=O)C(=O)[O-] AMY25534 [0,1,0,0,0,0|1,0,1]=3 224 B5R0.5 CC(=O)C(=O)[O-] AMY25673 [0,1,0,0,0,0|1,0,1]=3 225 B5R0.5 CC(=O)C(=O)[O-] AMY25702 [0,1,0,0,0,0|1,0,1]=3 226 B5R0.5 CC(=O)C(C)C AMY11021 [0,1,0,0,0,0|0,0,0]=1 227 B5R0.5 CC(=O)C(F)F AMY6800 [0,1,0,0,0,0|2,0,0]=3 228 B5R0.5 CC(=O)C(O)O AMY25827 [0,1,0,0,0,0|2,0,0]=3 229 B5R0.5 CC(=O)[C@H](C)F AMY5968 [0,1,0,0,0,0|1,0,0]=2 230 B5R0.5 CC(C)B(O)O AM1192 [0,1,0,0,0,0|1,0,1]=3 231 B5R0.5 CC(C)N(C)C AMY13340 [0,1,0,0,0,0|2,0,0]=3 232 B5R0.5 CC(C)[C@@H](C)N AMY22001 [0,1,0,0,0,0|1,0,1]=3 233 B5R0.5 CC(C)[C@H](C)N AMY14243 [0,1,0,0,0,0|1,0,1]=3 234 B5R0.5 CC(C)[N+](=O)[O-] AMY25784 [0,1,0,0,0,0|1,0,0]=2 235 B5R0.5 CC(F)=C(F)F AMY37198 [0,1,0,0,0,0|2,0,1]=4 236 B5R0.5 CC(O)C(=O)[O-] AMY37027 [0,1,0,0,0,0|1,0,0]=2 237 B5R0.5 CN(C)C(=N)N AM804111 [0,1,0,0,0,0|2,0,0]=3 238 B5R0.5 C[C@H](Br)C(=O)O AM81431 [0,1,0,0,0,0|1,0,0]=2 239 B5R0.5 C[C@H](Br)C(=O)O AM81432 [0,1,0,0,0,0|1,0,0]=2 240 B5R0.5 C[C@H](Br)C(=O)O AMY21881 [0,1,0,0,0,0|1,0,0]=2 241 B5R0.5 C[C@H](Br)C(N)=O AMY7273 [0,1,0,0,0,0|1,0,0]=2 242 B5R0.5 C[C@H](Cl)C(=O)Cl AMY40167 [0,1,0,0,0,0|1,0,0]=2 243 B5R0.5 C[C@H](Cl)C(=O)O AM81429 [0,1,0,0,0,0|1,0,0]=2 244 B5R0.5 C[C@H](Cl)C(=O)O AM81430 [0,1,0,0,0,0|1,0,0]=2 245 B5R0.5 C[C@H](Cl)C(=O)O AMY4045 [0,1,0,0,0,0|1,0,0]=2 246 B5R0.5 C[C@H](F)C(=O)O AMY5967 [0,1,0,0,0,0|1,0,0]=2 247 B5R0.5 C[C@H](N)C(=O)O AM20090411 [0,1,0,0,0,0|1,0,0]=2 248 B5R0.5 C[C@H](N)C(=O)O AM20090517 [0,1,0,0,0,0|1,0,0]=2 249 B5R0.5 C[C@H](N)C(=O)O AM20100374 [0,1,0,0,0,0|1,0,0]=2 250 B5R0.5 C[C@H](N)C(N)=O AM20090503 [0,1,0,0,0,0|1,0,0]=2 251 B5R0.5 C[C@H](N)C(N)=O AM81484 [0,1,0,0,0,0|1,0,0]=2 252 B5R0.5 C[C@H](O)C(=N)N AM806558 [0,1,0,0,0,0|2,0,0]=3 253 B5R0.5 C[C@H](O)C(=O)O AM87208 [0,1,0,0,0,0|1,0,0]=2 254 B5R0.5 C[C@H](O)C(=O)[O-] AMY22237 [0,1,0,0,0,0|1,0,0]=2 255 B5R0.5 NC(=O)C(N)=O AMY23583 [0,1,0,0,0,0|2,0,1]=4 256 B5R0.5 O=C(O)C(=O)O AMY514 [0,1,0,0,0,0|2,0,1]=4 257 B5R0.5 O=C(O)C(=O)O AMY6125 [0,1,0,0,0,0|2,0,1]=4 258 B5R0.5 O=C(O)C(F)F AM20100014 [0,1,0,0,0,0|2,0,0]=3 259 B5R0.5 O=C([O-])C(Cl)Cl AMY37987 [0,1,0,0,0,0|2,0,0]=3 260 B5R0.5 O=C([O-])C(Cl)Cl AMY37994 [0,1,0,0,0,0|2,0,0]=3 261 B5R0.5 O=C([O-])[C@@H](F)Cl AMY7116 [0,1,0,0,0,0|2,0,0]=3 262 B5R0.5 O=[S@]([O-])C(F)F AMY7114 [0,1,0,0,0,0|3,0,0]=4 263 B5R1.2 BrC1CCC1 AM803913 [0,0,0,1,0,0|2,0,1]=4 264 B5R1.2 BrC1CNC1 AMY34832 [0,0,0,1,0,0|2,0,1]=4 265 B5R1.2 BrC1COC1 AM20020035 [0,0,0,1,0,0|1,0,2]=4 266 B5R1.2 CC1CNC1 AM20120351 [0,0,0,1,0,0|1,0,1]=3 267 B5R1.2 C[C@H]1CCN1 AM806564 [0,0,0,1,0,0|2,0,0]=3 268 B5R1.2 ClC1CCC1 AMY6175 [0,0,0,1,0,0|2,0,1]=4 269 B5R1.2 ClC1CNC1 AMY33719 [0,0,0,1,0,0|2,0,1]=4 270 B5R1.2 ClC1COC1 AMY34839 [0,0,0,1,0,0|1,0,2]=4 271 B5R1.2 FC1CNC1 AM20100512 [0,0,0,1,0,0|2,0,1]=4 272 B5R1.2 FC1CNC1 AMY12200 [0,0,0,1,0,0|2,0,1]=4 273 B5R1.2 FC1COC1 AM20020027 [0,0,0,1,0,0|1,0,2]=4 274 B5R1.2 IC1CCC1 AMY6180 [0,0,0,1,0,0|2,0,1]=4 275 B5R1.2 IC1COC1 AM20020026 [0,0,0,1,0,0|1,0,2]=4 276 B5R1.2 NC1CCC1 AMY2668 [0,0,0,1,0,0|2,0,1]=4 277 B5R1.2 NC1CCC1 AMY6177 [0,0,0,1,0,0|2,0,1]=4 278 B5R1.2 NC1CNC1 AMY6172 [0,0,0,1,0,0|2,0,1]=4 279 B5R1.2 NC1COC1 AM20020021 [0,0,0,1,0,0|1,0,2]=4 280 B5R1.2 NC1COC1 AM85383 [0,0,0,1,0,0|1,0,2]=4 281 B5R1.2 NC1CSC1 AM20120367 [0,0,0,1,0,0|1,1,1]=4 282 B5R1.2 N[C@@H]1CCO1 AMY1804 [0,0,0,1,0,0|3,0,0]=4 283 B5R1.2 OC1CCC1 AM803645 [0,0,0,1,0,0|2,0,1]=4 284 B5R1.2 OC1CNC1 AM20100158 [0,0,0,1,0,0|2,0,1]=4 285 B5R1.2 OC1COC1 AM20020046 [0,0,0,1,0,0|1,0,2]=4 286 B5R1.2 OC1CSC1 AMY35636 [0,0,0,1,0,0|1,1,1]=4 287 B5R1.2 SC1COC1 AMY33758 [0,0,0,1,0,0|1,0,2]=4 288 B5R1.3 BrCC1CC1 AM90231 [0,0,0,1,0,0|1,0,1]=3 289 B5R1.3 BrC[C@H]1CO1 AMY31919 [0,0,0,1,0,0|2,0,1]=4 290 B5R1.3 C#CC1CC1 AM20100625 [0,0,0,1,0,0|1,0,1]=3 291 B5R1.3 C=C[C@@H]1CO1 AMY40815 [0,0,0,1,0,0|2,0,0]=3 292 B5R1.3 CNC1CC1 AM20100262 [0,0,0,1,0,0|2,0,0]=3 293 B5R1.3 CNC1CC1 AM20100622 [0,0,0,1,0,0|2,0,0]=3 294 B5R1.3 ClCC1CC1 AM20100440 [0,0,0,1,0,0|1,0,1]=3 295 B5R1.3 ClC[C@H]1CO1 AM20090809 [0,0,0,1,0,0|2,0,1]=4 296 B5R1.3 ClC[C@H]1CO1 AM20090812 [0,0,0,1,0,0|2,0,1]=4 297 B5R1.3 ClC[C@H]1CO1 AMY40813 [0,0,0,1,0,0|2,0,1]=4 298 B5R1.3 ICC1CC1 AMY6123 [0,0,0,1,0,0|1,0,1]=3 299 B5R1.3 IC[C@H]1CO1 AMY5696 [0,0,0,1,0,0|2,0,1]=4 300 B5R1.3 N#CC1CC1 AMY3403 [0,0,0,1,0,0|1,0,1]=3 301 B5R1.3 NCC1CC1 AM61420 [0,0,0,1,0,0|1,0,1]=3 302 B5R1.3 NNC1CC1 AM10015 [0,0,0,1,0,0|2,0,0]=3 303 B5R1.3 O=CC1CC1 AM90182 [0,0,0,1,0,0|0,0,0]=1 304 B5R1.3 OCC1CC1 AM20090298 [0,0,0,1,0,0|0,0,2]=3 305 B5R1.3 OC[C@H]1CO1 AM20100365 [0,0,0,1,0,0|1,0,2]=4 306 B5R1.3 OC[C@H]1CO1 AM20100474 [0,0,0,1,0,0|1,0,2]=4 307 B5R1.3 OC[C@H]1CO1 AM81447 [0,0,0,1,0,0|1,0,2]=4 308 B5R1.4 CC1CC1N AM806543 [0,0,0,1,0,0|1,0,1]=3 309 B5R1.4 CC1CC1N AM806563 [0,0,0,1,0,0|1,0,1]=3 310 B5R1.4 C[C@H]1C[C@H]1F AMY5813 [0,0,0,1,0,0|1,0,1]=3 311 B5R1.4 FC1CC1Br AMY5835 [0,0,0,1,0,0|2,0,1]=4 312 B5R1.4 N[C@@H]1CC1F AM84389 [0,0,0,1,0,0|2,0,1]=4 313 B5R1.4 N[C@H]1C[C@H]1N AMY35674 [0,0,0,1,0,0|2,0,1]=4 314 B5R1.5 CC1(N)CC1 AM803556 [0,0,0,1,0,0|2,0,1]=4 315 B5R1.5 CC1(O)CC1 AMY38664 [0,0,0,1,0,0|2,0,1]=4 316 B2R0.1 BrCBr AMY11088 [2,0,0,0,0,0|2,0,0]=4 317 B2R0.1 C=C[CH2-] AMY41856 [2,0,0,0,0,0|0,0,2]=4 318 B2R0.1 C=C[Mg+] AMY14834 [2,0,0,0,0,0|1,0,1]=4 319 B2R0.1 C=C[Mg+] AMY19835 [2,0,0,0,0,0|1,0,1]=4 320 B2R0.1 CCC AMY22280 [2,0,0,0,0,0|0,0,0]=2 321 B2R0.1 CCI AMY39500 [2,0,0,0,0,0|1,0,0]=3 322 B2R0.1 CC[O-] AMY14850 [2,0,0,0,0,0|0,0,1]=3 323 B2R0.1 CNC AM90364 [2,0,0,0,0,0|1,0,0]=3 324 B2R0.1 CNC AMY14900 [2,0,0,0,0,0|1,0,0]=3 325 B2R0.1 CNO AMY23438 [2,0,0,0,0,0|1,0,1]=4 326 B2R0.1 CON AM90382 [2,0,0,0,0,0|2,0,0]=4 327 B2R0.1 CSC AMY11755 [2,0,0,0,0,0|1,0,0]=3 328 B2R0.1 CSC AMY14803 [2,0,0,0,0,0|1,0,0]=3 329 B2R0.1 ClCBr AMY11119 [2,0,0,0,0,0|2,0,0]=4 330 B2R0.1 ClCI AMY2690 [2,0,0,0,0,0|2,0,0]=4 331 B2R0.1 FCBr AMY6811 [2,0,0,0,0,0|2,0,0]=4 332 B2R0.1 FCF AMY37122 [2,0,0,0,0,0|2,0,0]=4 333 B2R0.1 ICI AMY25773 [2,0,0,0,0,0|2,0,0]=4 334 B2R0.1 N=CN AMY2665 [2,0,0,0,0,0|2,0,0]=4 335 B2R0.1 NC=O AMY3583 [2,0,0,0,0,0|1,0,0]=3 336 B2R0.1 NC=S AMY33487 [2,0,0,0,0,0|1,1,0]=4 337 B2R0.1 O=CO AMY11055 [2,0,0,0,0,0|1,0,0]=3 338 B2R0.1 O=P[O-] AMY21929 [2,0,0,0,0,0|2,0,0]=4 339 B2R0.1 O=[AlH3][O-] AMY534 [2,0,0,0,0,0|2,0,0]=4 340 B2R0.1 O=[Se]=O AMY10040 [2,0,0,0,0,0|2,0,0]=4 341 B2R0.1 O=[Si]=O AMY37125 [2,0,0,0,0,0|1,1,0]=4 342 B4R0.2 BrCCCBr AMY25527 [1,1,0,0,0,0|1,0,1]=4 343 B4R0.2 C#CCCBr AMY1272 [1,1,0,0,0,0|1,0,1]=4 344 B4R0.2 C#CCOC AMY1246 [1,1,0,0,0,0|1,0,1]=4 345 B4R0.2 C#COCC AMY33551 [1,1,0,0,0,0|1,0,1]=4 346 B4R0.2 C=CCCCl AMY11185 [1,1,0,0,0,0|1,0,0]=3 347 B4R0.2 C=CCCO AMY14291 [1,1,0,0,0,0|1,0,0]=3 348 B4R0.2 C=CCNC AMY13350 [1,1,0,0,0,0|1,0,0]=3 349 B4R0.2 C=CCNN AM806419 [1,1,0,0,0,0|2,0,0]=4 350 B4R0.2 C=CCOC AM20100534 [1,1,0,0,0,0|1,0,0]=3 351 B4R0.2 C=CCON AM90375 [1,1,0,0,0,0|2,0,0]=4 352 B4R0.2 CCCCN AMY21914 [1,1,0,0,0,0|1,0,1]=4 353 B4R0.2 CCCNN AM9771 [1,1,0,0,0,0|1,0,1]=4 354 B4R0.2 CCNCC AMY25752 [1,1,0,0,0,0|1,0,1]=4 355 B4R0.2 CCPCC AMY11725 [1,1,0,0,0,0|1,0,1]=4 356 B4R0.2 CC\C=C\Br AMY796 [1,1,0,0,0,0|1,0,0]=3 357 B4R0.2 CNCC#N AM20090317 [1,1,0,0,0,0|1,0,1]=4 358 B4R0.2 CNCCCl AM803928 [1,1,0,0,0,0|1,0,1]=4 359 B4R0.2 CNCCF AMY202003232 [1,1,0,0,0,0|1,0,1]=4 360 B4R0.2 CNCCO AMY32697 [1,1,0,0,0,0|0,0,2]=4 361 B4R0.2 COCCCl AMY25739 [1,1,0,0,0,0|1,0,1]=4 362 B4R0.2 COCCN AM808206 [1,1,0,0,0,0|1,0,1]=4 363 B4R0.2 CSCCCl AMY15533 [1,1,0,0,0,0|1,0,1]=4 364 B4R0.2 CSCCN AMY33509 [1,1,0,0,0,0|1,0,1]=4 365 B4R0.2 CSCCO AMY19250 [1,1,0,0,0,0|0,0,2]=4 366 B4R0.2 C\C=C\CCl AMY618 [1,1,0,0,0,0|1,0,1]=4 367 B4R0.2 C\C=C\CO AMY21936 [1,1,0,0,0,0|0,0,2]=4 368 B4R0.2 ClCCCBr AMY40180 [1,1,0,0,0,0|1,0,1]=4 369 B4R0.2 ClCCCCl AMY22013 [1,1,0,0,0,0|1,0,1]=4 370 B4R0.2 ClCCCI AMY25762 [1,1,0,0,0,0|1,0,1]=4 371 B4R0.2 FCCCBr AMY28674 [1,1,0,0,0,0|1,0,1]=4 372 B4R0.2 N#CCCCl AMY21819 [1,1,0,0,0,0|1,0,1]=4 373 B4R0.2 NCCCBr AM20100225 [1,1,0,0,0,0|1,0,1]=4 374 B4R0.2 NCCCN AMY21886 [1,1,0,0,0,0|1,0,1]=4 375 B4R0.2 NCCON AMY10143 [1,1,0,0,0,0|2,0,0]=4 376 B4R0.2 NNCCO AM20080045 [1,1,0,0,0,0|2,0,0]=4 377 B4R0.2 OCCCBr AM20100533 [1,1,0,0,0,0|0,0,2]=4 378 B4R0.2 OCCCCl AMY9478 [1,1,0,0,0,0|0,0,2]=4 379 B4R0.2 OCCCF AM1014 [1,1,0,0,0,0|0,0,2]=4 380 B4R0.2 SCCCBr AM806637 [1,1,0,0,0,0|0,1,1]=4 381 B4R0.2 [Li]CCCC AMY14790 [1,1,0,0,0,0|1,0,1]=4 382 B4R0.3 CC(C)(C)N AMY14898 [1,1,0,0,0,0|0,0,1]=3 383 B4R0.3 CC(C)(C)N AMY40503 [1,1,0,0,0,0|0,0,1]=3 384 B4R0.3 CC(C)(C)O AMY11058 [1,1,0,0,0,0|0,0,1]=3 385 B4R0.3 CC(C)(C)S AMY28695 [1,1,0,0,0,0|0,0,1]=3 386 B4R0.3 CC(C)(C)[O-] AMY3409 [1,1,0,0,0,0|0,0,1]=3 387 B4R0.3 CC(C)(C)[O-] AMY36772 [1,1,0,0,0,0|0,0,1]=3 388 B4R0.3 CC(C)(C)[O-] AMY39324 [1,1,0,0,0,0|0,0,1]=3 389 B4R0.3 CP(=O)(Cl)Cl AMY21900 [1,1,0,0,0,0|2,0,0]=4 390 B4R0.3 CP(=O)(O)O AM20120404 [1,1,0,0,0,0|2,0,0]=4 391 B4R0.3 CS(=O)(=O)O AMY32450 [1,1,0,0,0,0|2,0,0]=4 392 B4R0.3 CS(=O)(=O)[O-] AMY11772 [1,1,0,0,0,0|2,0,0]=4 393 B4R0.3 CS(C)(=N)=O AMY3326 [1,1,0,0,0,0|1,0,0]=3 394 B4R0.3 CS(C)(=O)=O AMY25756 [1,1,0,0,0,0|1,0,0]=3 395 B4R0.3 C[N+](C)(C)C AMY13717 [1,1,0,0,0,0|1,0,1]=4 396 B4R0.3 C[N+](C)(C)C AMY15434 [1,1,0,0,0,0|1,0,1]=4 397 B4R0.3 C[N+](C)(C)C AMY22331 [1,1,0,0,0,0|1,0,1]=4 398 B4R0.3 C[N+](C)(C)C AMY6671 [1,1,0,0,0,0|1,0,1]=4 399 B4R0.3 C[N+](C)(C)C AMY6672 [1,1,0,0,0,0|1,0,1]=4 400 B4R0.3 C[P+](C)(C)C AMY13780 [1,1,0,0,0,0|1,0,1]=4 401 B4R0.3 C[S+](C)(C)=O AMY22243 [1,1,0,0,0,0|1,0,0]=3 402 B4R0.3 C[S+](C)(C)=O AMY24038 [1,1,0,0,0,0|1,0,0]=3 403 B4R0.3 C[Si](C)(C)Br AMY39323 [1,1,0,0,0,0|0,1,1]=4 404 B4R0.3 C[Si](C)(C)Cl AMY15614 [1,1,0,0,0,0|0,1,1]=4 405 B4R0.3 C[Si](C)(C)I AMY39353 [1,1,0,0,0,0|0,1,1]=4 406 B4R0.3 C[Si](C)(Cl)Cl AMY40504 [1,1,0,0,0,0|1,1,0]=4 407 B4R0.3 [Li]C(C)(C)C AMY14889 [1,1,0,0,0,0|0,0,1]=3 408 B6R0.1 CC\C=C(/C)C=O AMY2564 [0,2,0,0,0,0|0,0,1]=3 409 B6R0.1 C[C@@H](CO)CCO AMY37668 [0,2,0,0,0,0|0,0,2]=4 410 B6R0.1 C[C@H](CN)CCN AMY1782 [0,2,0,0,0,0|1,0,1]=4 411 B6R0.1 C[C@H](CO)CCO AMY37676 [0,2,0,0,0,0|0,0,2]=4 412 B6R0.2 CC(=O)C=C(C)C AMY23356 [0,2,0,0,0,0|0,0,1]=3 413 B6R0.2 CC(=O)CC(C)C AMY11098 [0,2,0,0,0,0|0,0,0]=2 414 B6R0.2 CC(=O)NC(C)C AMY3785 [0,2,0,0,0,0|0,0,0]=2 415 B6R0.2 CC(=O)\C=C(\C)N AMY24718 [0,2,0,0,0,0|1,0,1]=4 416 B6R0.2 CC(=O)\C=C(\C)[O-] AMY11696 [0,2,0,0,0,0|1,0,1]=4 417 B6R0.2 CC(=O)\C=C(\C)[O-] AMY19683 [0,2,0,0,0,0|1,0,1]=4 418 B6R0.2 CC(=O)\C=C(\C)[O-] AMY41912 [0,2,0,0,0,0|1,0,1]=4 419 B6R0.2 CC(C)=CB(O)O AMY021 [0,2,0,0,0,0|0,0,2]=4 420 B6R0.2 CC(C)CB(O)O AM80872 [0,2,0,0,0,0|0,0,2]=4 421 B6R0.2 CC(C)CC(=O)O AMY40214 [0,2,0,0,0,0|0,0,0]=2 422 B6R0.2 CC(C)C[C@H](C)N AMY36830 [0,2,0,0,0,0|1,0,1]=4 423 B6R0.2 CC(C)NC(C)C AMY8971 [0,2,0,0,0,0|1,0,1]=4 424 B6R0.2 CC(C)OC(=O)Cl AMY3776 [0,2,0,0,0,0|0,0,0]=2 425 B6R0.2 CC(O)CC(=O)[O-] AMY10051 [0,2,0,0,0,0|1,0,0]=3 426 B6R0.2 CC(O)CC(=O)[O-] AMY10054 [0,2,0,0,0,0|1,0,0]=3 427 B6R0.2 CN(C)CC(=O)O AM20080064 [0,2,0,0,0,0|1,0,0]=3 428 B6R0.2 CN(C)CC(=O)O AM81799 [0,2,0,0,0,0|1,0,0]=3 429 B6R0.2 CN(C)CC(=O)[O-] AMY42162 [0,2,0,0,0,0|1,0,0]=3 430 B6R0.2 CN(C)CC(=O)[O-] AMY42163 [0,2,0,0,0,0|1,0,0]=3 431 B6R0.2 C[C@@H](O)CC(=O)O AMY24176 [0,2,0,0,0,0|1,0,0]=3 432 B6R0.2 C[C@H](N)CC(=O)O AM20100008 [0,2,0,0,0,0|1,0,0]=3 433 B6R0.2 C[C@H](N)CC(=O)O AM20100009 [0,2,0,0,0,0|1,0,0]=3 434 B6R0.2 C[C@H](N)CC(=O)O AM20100428 [0,2,0,0,0,0|1,0,0]=3 435 B6R0.2 C[C@H](N)CC(=O)O AM804090 [0,2,0,0,0,0|1,0,0]=3 436 B6R0.2 C[C@H](O)CC(=O)O AMY10050 [0,2,0,0,0,0|1,0,0]=3 437 B6R0.2 C[C@H](O)CC(=O)O AMY24175 [0,2,0,0,0,0|1,0,0]=3 438 B6R0.2 C[C@H](O)CC(=O)[O-] AM86469 [0,2,0,0,0,0|1,0,0]=3 439 B6R0.2 C[C@H](O)CC(=O)[O-] AMY10052 [0,2,0,0,0,0|1,0,0]=3 440 B6R0.2 C[C@H](O)CC(=O)[O-] AMY10055 [0,2,0,0,0,0|1,0,0]=3 441 B6R0.2 C[S+](C)CC(=O)[O-] AM90363 [0,2,0,0,0,0|1,0,0]=3 442 B6R0.2 O=C(O)CC(F)F AMY6157 [0,2,0,0,0,0|2,0,0]=4 443 B6R0.3 C=C(I)[C@H](C)CI AMY6046 [0,2,0,0,0,0|1,0,0]=3 444 B6R0.3 C=CC(=O)N(C)C AM84856 [0,2,0,0,0,0|1,0,0]=3 445 B6R0.3 C=CN(C)C(C)=O AMY3934 [0,2,0,0,0,0|1,0,1]=4 446 B6R0.3 CC(=O)C(=O)CBr AMY23002 [0,2,0,0,0,0|1,0,1]=4 447 B6R0.3 CC(=O)C(=O)CCl AMY42031 [0,2,0,0,0,0|1,0,1]=4 448 B6R0.3 CC(=O)[C@@H](C)C=O AMY6397 [0,2,0,0,0,0|0,0,0]=2 449 B6R0.3 CC(C)C(=N)NO AM803769 [0,2,0,0,0,0|0,0,1]=3 450 B6R0.3 CC(C)C(=O)NN AMY3958 [0,2,0,0,0,0|0,0,0]=2 451 B6R0.3 CC(C)[C@@H](C)CO AMY19225 [0,2,0,0,0,0|0,0,2]=4 452 B6R0.3 CC(C)[C@@H](N)CO AM20080457 [0,2,0,0,0,0|0,0,2]=4 453 B6R0.3 CC(C)[C@@H](N)CO AM20090150 [0,2,0,0,0,0|0,0,2]=4 454 B6R0.3 CC(C)[C@@H](N)CO AM20100129 [0,2,0,0,0,0|0,0,2]=4 455 B6R0.3 CC(C)[C@H](N)C#N AMY32625 [0,2,0,0,0,0|1,0,1]=4 456 B6R0.3 CC(C)\C(Cl)=N\O AMY37414 [0,2,0,0,0,0|0,0,1]=3 457 B6R0.3 CCC(=O)C(=O)O AM90224 [0,2,0,0,0,0|1,0,1]=4 458 B6R0.3 CCC(=O)C(=O)[O-] AMY7718 [0,2,0,0,0,0|1,0,1]=4 459 B6R0.3 CCC(=O)C(C)=O AMY4046 [0,2,0,0,0,0|1,0,1]=4 460 B6R0.3 CCC(=O)N(C)C AMY38676 [0,2,0,0,0,0|1,0,0]=3 461 B6R0.3 CCC(=O)[C@H](C)Br AMY6079 [0,2,0,0,0,0|1,0,0]=3 462 B6R0.3 CCN(C)C(=O)Cl AM20090787 [0,2,0,0,0,0|1,0,0]=3 463 B6R0.3 CCN(O)C(C)=O AMY33549 [0,2,0,0,0,0|2,0,0]=4 464 B6R0.3 CC[C@@H](Br)C(=O)O AMY2458 [0,2,0,0,0,0|1,0,0]=3 465 B6R0.3 CC[C@@H](N)C(N)=O AMY725 [0,2,0,0,0,0|1,0,0]=3 466 B6R0.3 CC[C@H](Br)C(=O)O AM81433 [0,2,0,0,0,0|1,0,0]=3 467 B6R0.3 CC[C@H](C)B(O)O AM85121 [0,2,0,0,0,0|1,0,1]=4 468 B6R0.3 CC[C@H](C)C(=O)O AM802977 [0,2,0,0,0,0|0,0,0]=2 469 B6R0.3 CC[C@H](N)C(=O)O AM20080375 [0,2,0,0,0,0|1,0,0]=3 470 B6R0.3 CC[C@H](N)C(=O)O AM20090323 [0,2,0,0,0,0|1,0,0]=3 471 B6R0.3 CC[C@H](N)C(=O)O AM20090360 [0,2,0,0,0,0|1,0,0]=3 472 B6R0.3 CC[C@H](N)C(N)=O AM20100759 [0,2,0,0,0,0|1,0,0]=3 473 B6R0.3 CC[C@H](N)C(N)=O AM20120294 [0,2,0,0,0,0|1,0,0]=3 474 B6R0.3 CC[C@H](S)C(=O)O AMY2446 [0,2,0,0,0,0|1,0,0]=3 475 B6R0.3 CN(C)C(=O)CCl AM84854 [0,2,0,0,0,0|1,0,0]=3 476 B6R0.3 CN(C)C(=O)CI AM805909 [0,2,0,0,0,0|1,0,0]=3 477 B6R0.3 CN(C)C(=O)CN AM20100689 [0,2,0,0,0,0|1,0,0]=3 478 B6R0.3 CN(C)C(=O)CN AMY4281 [0,2,0,0,0,0|1,0,0]=3 479 B6R0.3 CN(N=O)C(N)=O AMY36707 [0,2,0,0,0,0|2,0,0]=4 480 B6R0.3 CN[C@@H](C)C(=O)O AM81482 [0,2,0,0,0,0|0,0,0]=2 481 B6R0.3 CN[C@@H](C)C(=O)O AM82991 [0,2,0,0,0,0|0,0,0]=2 482 B6R0.3 CN[C@@H](C)C(=O)O AM9397 [0,2,0,0,0,0|0,0,0]=2 483 B6R0.3 CN[C@@H](C)C(=O)[O-] AM9064 [0,2,0,0,0,0|0,0,0]=2 484 B6R0.3 CN[C@@H](C)C(C)C AMY37353 [0,2,0,0,0,0|1,0,1]=4 485 B6R0.3 CN[C@H](C)C(=O)O AMY25382 [0,2,0,0,0,0|0,0,0]=2 486 B6R0.3 COC(=O)C(C)=O AMY40825 [0,2,0,0,0,0|1,0,1]=4 487 B6R0.3 COC(=O)C(F)F AMY3631 [0,2,0,0,0,0|2,0,0]=4 488 B6R0.3 COC(=O)[C@H](C)Br AMY21873 [0,2,0,0,0,0|1,0,0]=3 489 B6R0.3 COC(=O)[C@H](C)Cl AM81434 [0,2,0,0,0,0|1,0,0]=3 490 B6R0.3 COC(=O)[C@H](C)Cl AM81435 [0,2,0,0,0,0|1,0,0]=3 491 B6R0.3 COC(=O)[C@H](C)Cl AMY3875 [0,2,0,0,0,0|1,0,0]=3 492 B6R0.3 COC(=O)[C@H](C)N AM20080254 [0,2,0,0,0,0|1,0,0]=3 493 B6R0.3 COC(=O)[C@H](C)N AM20090283 [0,2,0,0,0,0|1,0,0]=3 494 B6R0.3 COC(=O)[C@H](C)N AM81485 [0,2,0,0,0,0|1,0,0]=3 495 B6R0.3 CON(C)C(C)=O AM1188 [0,2,0,0,0,0|1,0,0]=3 496 B6R0.3 CO[C@H](C)C(=O)O AM84813 [0,2,0,0,0,0|0,0,0]=2 497 B6R0.3 C[C@@H](CN)C(=O)O AMY22008 [0,2,0,0,0,0|0,0,0]=2 498 B6R0.3 C[C@@H](CO)C(=O)O AMY18825 [0,2,0,0,0,0|0,0,0]=2 499 B6R0.3 C[C@H](C#N)C(=O)O AMY19783 [0,2,0,0,0,0|0,0,1]=3 500 B6R0.3 C\C=C(/C)C(C)=O AMY4030 [0,2,0,0,0,0|0,0,1]=3 501 B6R0.3 C\C=C(\C)C(=O)O AMY19230 [0,2,0,0,0,0|0,0,1]=3 502 B6R0.3 N#C[C@@H](N)C(N)=O AMY203 [0,2,0,0,0,0|1,0,1]=4 503 B6R0.3 NC(=O)C(N)CO AM806435 [0,2,0,0,0,0|1,0,0]=3 504 B6R0.3 NC(=O)[C@@H](N)CO AM20100594 [0,2,0,0,0,0|1,0,0]=3 505 B6R0.3 NC[C@H](N)C(=O)O AM20080367 [0,2,0,0,0,0|1,0,0]=3 506 B6R0.3 NC[C@H](N)C(=O)O AM20100354 [0,2,0,0,0,0|1,0,0]=3 507 B6R0.3 NC[C@H](N)C(=O)O AM20100470 [0,2,0,0,0,0|1,0,0]=3 508 B6R0.3 NC[C@H](O)C(=O)O AM1113 [0,2,0,0,0,0|1,0,0]=3 509 B6R0.3 NC[C@H](O)C(=O)O AM82574 [0,2,0,0,0,0|1,0,0]=3 510 B6R0.3 NNC(=O)C(F)F AMY7118 [0,2,0,0,0,0|2,0,0]=4 511 B6R0.3 N[C@@H](CCl)C(=O)O AMY22074 [0,2,0,0,0,0|1,0,0]=3 512 B6R0.3 N[C@@H](CCl)C(=O)O AMY22075 [0,2,0,0,0,0|1,0,0]=3 513 B6R0.3 N[C@@H](CO)C(=O)O AM20090412 [0,2,0,0,0,0|1,0,0]=3 514 B6R0.3 N[C@@H](CO)C(=O)O AM20090441 [0,2,0,0,0,0|1,0,0]=3 515 B6R0.3 N[C@@H](CO)C(=O)O AM20100375 [0,2,0,0,0,0|1,0,0]=3 516 B6R0.3 N[C@@H](CS)C(=O)O AM20070682 [0,2,0,0,0,0|1,0,0]=3 517 B6R0.3 N[C@@H](CS)C(=O)O AM81647 [0,2,0,0,0,0|1,0,0]=3 518 B6R0.3 N[C@@H](CS)C(=O)O AM81648 [0,2,0,0,0,0|1,0,0]=3 519 B6R0.3 N[C@@H](CS)C(=O)O AM81649 [0,2,0,0,0,0|1,0,0]=3 520 B6R0.3 N[C@@H](CS)C(=O)O AM81651 [0,2,0,0,0,0|1,0,0]=3 521 B6R0.3 N[C@H](CCl)C(=O)O AMY19767 [0,2,0,0,0,0|1,0,0]=3 522 B6R0.3 O=C(O)C(=O)CBr AM84337 [0,2,0,0,0,0|1,0,1]=4 523 B6R0.3 O=C(O)[C@@H](Br)CBr AM20100466 [0,2,0,0,0,0|1,0,0]=3 524 B6R0.4 CC(C)CCCO AMY39142 [0,2,0,0,0,0|0,0,2]=4 525 B6R0.4 CC(C)CON=O AMY4012 [0,2,0,0,0,0|0,0,1]=3 526 B6R0.4 CC(C)NCCCl AMY31121 [0,2,0,0,0,0|1,0,1]=4 527 B6R0.4 CC(C)OCCBr AM80879 [0,2,0,0,0,0|1,0,1]=4 528 B6R0.4 CN(C)\C=C\C=O AM20120332 [0,2,0,0,0,0|1,0,0]=3 529 B6R0.4 CNCCC(C)C AMY37348 [0,2,0,0,0,0|1,0,1]=4 530 B6R0.4 CNCCC(C)C AMY37370 [0,2,0,0,0,0|1,0,1]=4 531 B6R0.5 C#CCC(C)(C)O AM806691 [0,2,0,0,0,0|1,0,1]=4 532 B6R0.5 C=CC[Si](C)(C)C AMY7007 [0,2,0,0,0,0|1,1,0]=4 533 B6R0.5 C=CC[Si](C)(C)Cl AMY19831 [0,2,0,0,0,0|1,1,0]=4 534 B6R0.5 CC(C)(C)CC=O AM20090398 [0,2,0,0,0,0|0,0,0]=2 535 B6R0.5 CC(C)(C)CCO AM20100528 [0,2,0,0,0,0|0,0,2]=4 536 B6R0.5 CC(C)(C)N=C=S AMY23377 [0,2,0,0,0,0|0,1,1]=4 537 B6R0.5 CC(C)(C)ON=O AMY4009 [0,2,0,0,0,0|1,0,0]=3 538 B6R0.5 CC(C)(N)CCO AMY117 [0,2,0,0,0,0|0,0,2]=4 539 B6R0.5 CC(C)(O)CCN AMY42489 [0,2,0,0,0,0|1,0,1]=4 540 B6R0.5 CNCC(C)(C)O AM807013 [0,2,0,0,0,0|1,0,1]=4 541 B6R0.5 COCC(C)(C)O AMY9274 [0,2,0,0,0,0|0,0,2]=4 542 B6R0.5 C[Si](C)(C)C=[N+]=[N-] AMY15608 [0,2,0,0,0,0|1,1,0]=4 543 B6R0.5 C[Si](C)(C)\C=C\Br AMY1268 [0,2,0,0,0,0|1,1,0]=4 544 B6R0.8 C#C[C@@](C)(O)CC AMY4108 [0,2,0,0,0,0|1,0,1]=4 545 B6R0.8 C=C[Si](C)(C)C=C AMY22506 [0,2,0,0,0,0|1,1,0]=4 546 B6R0.8 CC(C)(CCl)CCl AMY32075 [0,2,0,0,0,0|1,0,1]=4 547 B6R0.8 CC(C)(CI)CI AMY32061 [0,2,0,0,0,0|1,0,1]=4 548 B6R0.8 CC(C)(CN)CO AMY14344 [0,2,0,0,0,0|0,0,2]=4 549 B6R0.8 CC(C)(CO)CCl AMY42053 [0,2,0,0,0,0|0,0,2]=4 550 B6R0.8 CC(C)(CO)CO AMY25552 [0,2,0,0,0,0|0,0,2]=4 551 B6R0.8 CC(N)(CO)CO AMY14265 [0,2,0,0,0,0|0,0,2]=4 552 B6R0.8 CCC(Br)(Br)C=O AMY2945 [0,2,0,0,0,0|1,0,0]=3 553 B6R0.8 CC[C@](C)(N)CN AMY40943 [0,2,0,0,0,0|1,0,1]=4 554 B6R0.8 CC[C@](C)(O)CN AMY24170 [0,2,0,0,0,0|1,0,1]=4 555 B6R0.8 CNC(C)(C)CO AM85695 [0,2,0,0,0,0|0,0,2]=4 556 B6R0.8 COC(C)(C)CBr AM806263 [0,2,0,0,0,0|1,0,1]=4 557 B6R0.8 COC(C)(C)CN AMY36536 [0,2,0,0,0,0|1,0,1]=4 558 B6R0.8 COC(C)(C)CO AM90075 [0,2,0,0,0,0|0,0,2]=4 559 B6R0.9 C=C[C@@H](CC)CO AMY36984 [0,2,0,0,0,0|1,0,0]=3 560 B6R0.9 CCC(CC)NN AM10003 [0,2,0,0,0,0|2,0,0]=4 561 B6R0.9 CCC(CC)NN AM10008 [0,2,0,0,0,0|2,0,0]=4 562 B6R0.9 CCC(CO)CO AM10034 [0,2,0,0,0,0|0,0,2]=4 563 B6R0.9 COC(CCl)OC AMY3314 [0,2,0,0,0,0|1,0,1]=4 564 B6R0.9 COC(OC)OC AMY41181 [0,2,0,0,0,0|2,0,0]=4 565 B6R0.9 OCC(CO)CO AM20100186 [0,2,0,0,0,0|0,0,2]=4 566 B6R0.7 C=C(Br)[Si](C)(C)C AMY1247 [0,2,0,0,0,0|1,1,0]=4 567 B6R0.7 CC(=O)C(C)(C)N AM806454 [0,2,0,0,0,0|0,0,0]=2 568 B6R0.7 CC(=O)C(C)(C)O AM84347 [0,2,0,0,0,0|0,0,0]=2 569 B6R0.7 CC(=O)C(F)(F)F AMY3622 [0,2,0,0,0,0|2,0,0]=4 570 B6R0.7 CC(C)(Br)C(=O)Br AM84723 [0,2,0,0,0,0|0,0,0]=2 571 B6R0.7 CC(C)(Br)C(=O)O AM20090161 [0,2,0,0,0,0|0,0,0]=2 572 B6R0.7 CC(C)(Br)C(N)=O AMY7268 [0,2,0,0,0,0|0,0,0]=2 573 B6R0.7 CC(C)(C)C(=N)N AM804113 [0,2,0,0,0,0|1,0,0]=3 574 B6R0.7 CC(C)(C)C(=N)N AMY25598 [0,2,0,0,0,0|1,0,0]=3 575 B6R0.7 CC(C)(C)C(N)=S AM20100553 [0,2,0,0,0,0|0,1,0]=3 576 B6R0.7 CC(C)(C)[S@@](N)=O AM20080353 [0,2,0,0,0,0|1,0,0]=3 577 B6R0.7 CC(C)(C)[S@@](N)=O AM62752 [0,2,0,0,0,0|1,0,0]=3 578 B6R0.7 CC(C)(C)[S@@](N)=O AM62767 [0,2,0,0,0,0|1,0,0]=3 579 B6R0.7 CC(C)(N)C(=O)O AM20100517 [0,2,0,0,0,0|0,0,0]=2 580 B6R0.7 CC(C)(N)C(N)=O AMY20154 [0,2,0,0,0,0|0,0,0]=2 581 B6R0.7 CC(C)C(C)(C)C AMY31971 [0,2,0,0,0,0|1,0,1]=4 582 B6R0.7 CC(C)[Si](C)(C)Cl AMY42251 [0,2,0,0,0,0|1,1,0]=4 583 B6R0.7 CC(F)(F)C(=O)O AMY1273 [0,2,0,0,0,0|1,0,0]=3 584 B6R0.7 CN(C)S(=O)(=O)Cl AM20080241 [0,2,0,0,0,0|2,0,0]=4 585 B6R0.7 CN(C)S(N)(=O)=O AM20100051 [0,2,0,0,0,0|2,0,0]=4 586 B6R0.7 C[SiH](C)C(C)(C)C AMY42267 [0,2,0,0,0,0|1,1,0]=4 587 B6R0.7 NC(=O)C(F)(F)F AMY3625 [0,2,0,0,0,0|2,0,0]=4 588 B6R0.7 O=C(Cl)C(F)(F)F AMY3623 [0,2,0,0,0,0|2,0,0]=4 589 B6R0.7 O=C(O)C(Br)(Br)Br AMY18080 [0,2,0,0,0,0|2,0,0]=4 590 B6R0.7 O=C(O)C(F)(F)Br AMY6892 [0,2,0,0,0,0|2,0,0]=4 591 B6R0.7 O=C(O)C(F)(F)Cl AMY3628 [0,2,0,0,0,0|2,0,0]=4 592 B6R0.7 O=C(O)C(F)(F)F AM10013 [0,2,0,0,0,0|2,0,0]=4 593 B6R0.7 O=C(O)C(F)(F)F AMY22314 [0,2,0,0,0,0|2,0,0]=4 594 B6R0.7 O=C(O)C(F)(F)F AMY35811 [0,2,0,0,0,0|2,0,0]=4 595 B6R0.7 O=C(O)C(F)(F)F AMY3605 [0,2,0,0,0,0|2,0,0]=4 596 B6R0.7 O=C([O-])C(F)(F)Br AMY6893 [0,2,0,0,0,0|2,0,0]=4 597 B6R0.7 O=C([O-])C(F)(F)Br AMY7112 [0,2,0,0,0,0|2,0,0]=4 598 B6R0.7 O=C([O-])C(F)(F)Cl AMY6799 [0,2,0,0,0,0|2,0,0]=4 599 B6R0.7 O=C([O-])C(F)(F)F AMY11767 [0,2,0,0,0,0|2,0,0]=4 600 B6R0.7 O=C([O-])C(F)(F)F AMY19734 [0,2,0,0,0,0|2,0,0]=4 601 B6R0.7 O=C([O-])C(F)(F)F AMY37341 [0,2,0,0,0,0|2,0,0]=4 602 B4R1.1 C1CNC1 AM20080889 [1,0,0,1,0,0|1,0,1]=4 603 B4R1.1 C1CNC1 AM20090583 [1,0,0,1,0,0|1,0,1]=4 604 B4R1.1 C1COC1 AM20020039 [1,0,0,1,0,0|0,0,2]=4 605 B4R1.2 BrC1CC1 AM90210 [1,0,0,1,0,0|1,0,1]=4 606 B4R1.2 C[C@H]1CO1 AM81470 [1,0,0,1,0,0|0,0,2]=4 607 B4R1.2 C[C@H]1CO1 AM81471 [1,0,0,1,0,0|0,0,2]=4 608 B4R1.2 NC1CC1 AM804333 [1,0,0,1,0,0|1,0,1]=4 609 B4R1.2 OC1CC1 AMY35209 [1,0,0,1,0,0|0,0,2]=4 610 B6R1.2 CC1=CCCC1 AMY6023 [0,1,0,1,0,0|1,0,1]=4 611 B6R1.2 CC1CCCC1 AMY21930 [0,1,0,1,0,0|1,0,1]=4 612 B6R1.2 C[C@@H]1CCNC1 AMY37511 [0,1,0,1,0,0|1,0,1]=4 613 B6R1.2 C[C@H]1CCCN1 AM20080260 [0,1,0,1,0,0|1,0,1]=4 614 B6R1.2 C[C@H]1CCCN1 AM20090040 [0,1,0,1,0,0|1,0,1]=4 615 B6R1.2 C[C@H]1CCCN1 AM20100102 [0,1,0,1,0,0|1,0,1]=4 616 B6R1.2 C[C@H]1CCCN1 AM20100445 [0,1,0,1,0,0|1,0,1]=4 617 B6R1.2 C[C@H]1CCCN1 AM20100751 [0,1,0,1,0,0|1,0,1]=4 618 B6R1.2 C[C@H]1CCCO1 AM81816 [0,1,0,1,0,0|1,0,1]=4 619 B6R1.2 C[C@H]1CCNC1 AM803039 [0,1,0,1,0,0|1,0,1]=4 620 B6R1.2 C[C@H]1CCNC1 AM803735 [0,1,0,1,0,0|1,0,1]=4 621 B6R1.2 C[C@H]1CCNC1 AMY37562 [0,1,0,1,0,0|1,0,1]=4 622 B6R1.2 NC1CC=CC1 AM20120323 [0,1,0,1,0,0|2,0,0]=4 623 B6R1.2 OC1CC=CC1 AMY9178 [0,1,0,1,0,0|2,0,0]=4 624 B6R1.3 BrCCC1CC1 AMY202003230 [0,1,0,1,0,0|1,0,1]=4 625 B6R1.3 CNCC1CC1 AM803431 [0,1,0,1,0,0|1,0,1]=4 626 B6R1.3 CNCC1CC1 AMY34463 [0,1,0,1,0,0|1,0,1]=4 627 B6R1.3 ICCC1CC1 AMY34362 [0,1,0,1,0,0|1,0,1]=4 628 B6R1.3 N#CCC1CC1 AM20100595 [0,1,0,1,0,0|1,0,1]=4 629 B6R1.3 NCCC1CC1 AMY39140 [0,1,0,1,0,0|1,0,1]=4 630 B6R1.3 NCCC1CC1 AMY4139 [0,1,0,1,0,0|1,0,1]=4 631 B6R1.3 NNCC1CC1 AM10018 [0,1,0,1,0,0|1,0,1]=4 632 B6R1.3 NNCC1CC1 AMY16104 [0,1,0,1,0,0|1,0,1]=4 633 B6R1.3 NOCC1CC1 AM90383 [0,1,0,1,0,0|0,0,2]=4 634 B6R1.3 O=CNC1CC1 AM804092 [0,1,0,1,0,0|0,0,0]=2 635 B6R1.3 OCCC1CC1 AMY3915 [0,1,0,1,0,0|0,0,2]=4 636 B6R1.3 S=C=NC1CC1 AM20080903 [0,1,0,1,0,0|0,1,1]=4 637 B6R1.5 C=C1CC(N)C1 AM84287 [0,1,0,1,0,0|2,0,0]=4 638 B6R1.5 C=C1CC(N)C1 AM84288 [0,1,0,1,0,0|2,0,0]=4 639 B6R1.5 CC1CC(=O)C1 AM806996 [0,1,0,1,0,0|0,0,0]=2 640 B6R1.5 NC1CC(=O)C1 AM20070559 [0,1,0,1,0,0|1,0,0]=3 641 B6R1.5 O=C1CC(O)C1 AMY33736 [0,1,0,1,0,0|1,0,0]=3 642 B6R1.8 CC1CC1CN AM806562 [0,1,0,1,0,0|1,0,1]=4 643 B6R1.8 CC1CC1CO AM804126 [0,1,0,1,0,0|0,0,2]=4 644 B6R1.8 OC[C@@H]1C[C@@H]1F AMY5785 [0,1,0,1,0,0|0,0,2]=4 645 B6R1.10 CC1(C)CNC1 AMY14184 [0,1,0,1,0,0|1,0,1]=4 646 B6R1.10 CC1(C)COC1 AM20020043 [0,1,0,1,0,0|0,0,2]=4 647 B6R1.10 CC1(N)CCC1 AM808140 [0,1,0,1,0,0|1,0,1]=4 648 B6R1.10 CC1(N)CCC1 AMY1785 [0,1,0,1,0,0|1,0,1]=4 649 B6R1.10 CC1(N)COC1 AM20020051 [0,1,0,1,0,0|0,0,2]=4 650 B6R1.10 CC1(O)CNC1 AM81138 [0,1,0,1,0,0|1,0,1]=4 651 B6R1.10 CC1(O)COC1 AMY33735 [0,1,0,1,0,0|0,0,2]=4 652 B6R1.11 CC(=O)C1CC1 AM83286 [0,1,0,1,0,0|0,0,0]=2 653 B6R1.11 C[C@H](N)C1CC1 AM804149 [0,1,0,1,0,0|1,0,1]=4 654 B6R1.11 C[C@H](N)C1CC1 AM806511 [0,1,0,1,0,0|1,0,1]=4 655 B6R1.11 C[C@H](O)C1CC1 AM804334 [0,1,0,1,0,0|0,0,2]=4 656 B6R1.11 N=C(N)C1CC1 AM804064 [0,1,0,1,0,0|1,0,0]=3 657 B6R1.11 N=C(N)C1CC1 AMY202003285 [0,1,0,1,0,0|1,0,0]=3 658 B6R1.11 NC(=O)C1CC1 AM20100524 [0,1,0,1,0,0|0,0,0]=2 659 B6R1.11 NC(=O)[C@@H]1CN1 AMY19258 [0,1,0,1,0,0|1,0,0]=3 660 B6R1.11 NC(=S)C1CC1 AMY30195 [0,1,0,1,0,0|0,1,0]=3 661 B6R1.11 O=C(Cl)C1CC1 AMY3975 [0,1,0,1,0,0|0,0,0]=2 662 B6R1.11 O=C(O)C1CC1 AM83282 [0,1,0,1,0,0|0,0,0]=2 663 B6R1.11 O=C([O-])[C@@H]1CO1 AM85800 [0,1,0,1,0,0|1,0,0]=3 664 B6R1.11 O=[S@]([O-])C1CC1 AMY20620 [0,1,0,1,0,0|1,0,0]=3 665 B6R1.11 OB(O)C1CC1 AM20100093 [0,1,0,1,0,0|1,0,1]=4 666 B6R1.6 BrCC1CCC1 AM20070598 [0,1,0,1,0,0|1,0,1]=4 667 B6R1.6 BrCC1COC1 AM807116 [0,1,0,1,0,0|0,0,2]=4 668 B6R1.6 BrC[C@H]1CCO1 AM20020056 [0,1,0,1,0,0|1,0,1]=4 669 B6R1.6 CNC1CNC1 AM20090279 [0,1,0,1,0,0|1,0,1]=4 670 B6R1.6 CNC1CNC1 AMY34231 [0,1,0,1,0,0|1,0,1]=4 671 B6R1.6 CNC1COC1 AM20020057 [0,1,0,1,0,0|0,0,2]=4 672 B6R1.6 CNC1COC1 AMY5742 [0,1,0,1,0,0|0,0,2]=4 673 B6R1.6 COC1CNC1 AM20080370 [0,1,0,1,0,0|1,0,1]=4 674 B6R1.6 COC1CNC1 AMY33741 [0,1,0,1,0,0|1,0,1]=4 675 B6R1.6 CSC1CNC1 AM20080315 [0,1,0,1,0,0|1,0,1]=4 676 B6R1.6 ClCC1CCC1 AMY31015 [0,1,0,1,0,0|1,0,1]=4 677 B6R1.6 ClCC1COC1 AM807016 [0,1,0,1,0,0|0,0,2]=4 678 B6R1.6 ClC[C@H]1CCO1 AM807017 [0,1,0,1,0,0|1,0,1]=4 679 B6R1.6 ICC1CCC1 AMY34464 [0,1,0,1,0,0|1,0,1]=4 680 B6R1.6 ICC1COC1 AM807382 [0,1,0,1,0,0|0,0,2]=4 681 B6R1.6 IC[C@H]1CCO1 AM20020012 [0,1,0,1,0,0|1,0,1]=4 682 B6R1.6 N#CC1CCC1 AM20070614 [0,1,0,1,0,0|1,0,1]=4 683 B6R1.6 N#CC1CNC1 AM20090541 [0,1,0,1,0,0|1,0,1]=4 684 B6R1.6 N#C[C@H]1CCN1 AMY35836 [0,1,0,1,0,0|1,0,1]=4 685 B6R1.6 NCC1CCC1 AM20070613 [0,1,0,1,0,0|1,0,1]=4 686 B6R1.6 NCC1COC1 AM20020041 [0,1,0,1,0,0|0,0,2]=4 687 B6R1.6 NC[C@H]1CCN1 AM20070687 [0,1,0,1,0,0|1,0,1]=4 688 B6R1.6 NC[C@H]1CCO1 AM20020052 [0,1,0,1,0,0|1,0,1]=4 689 B6R1.6 NNC1CCC1 AM9769 [0,1,0,1,0,0|2,0,0]=4 690 B6R1.6 NNC1CCC1 AM9783 [0,1,0,1,0,0|2,0,0]=4 691 B6R1.6 NNC1COC1 AM9958 [0,1,0,1,0,0|2,0,0]=4 692 B6R1.6 O=CC1CCC1 AM90197 [0,1,0,1,0,0|0,0,0]=2 693 B6R1.6 O=CC1COC1 AMY38489 [0,1,0,1,0,0|0,0,0]=2 694 B6R1.6 OCC1CCC1 AM90211 [0,1,0,1,0,0|0,0,2]=4 695 B6R1.6 OCC1CNC1 AM20120333 [0,1,0,1,0,0|0,0,2]=4 696 B6R1.6 OCC1CNC1 AMY6173 [0,1,0,1,0,0|0,0,2]=4 697 B6R1.6 OCC1COC1 AM806983 [0,1,0,1,0,0|0,0,2]=4 698 B6R1.6 OC[C@H]1CCO1 AM807004 [0,1,0,1,0,0|0,0,2]=4 699 B6R1.7 C#CC1(N)CC1 AMY34606 [0,1,0,1,0,0|1,0,1]=4 700 B6R1.7 CC1(CN)CC1 AM806561 [0,1,0,1,0,0|1,0,1]=4 701 B6R1.7 CC1(CN)CC1 AMY19193 [0,1,0,1,0,0|1,0,1]=4 702 B6R1.7 CC1(CO)CC1 AM803621 [0,1,0,1,0,0|0,0,2]=4 703 B6R1.7 C[C@]1(CO)CO1 AM806634 [0,1,0,1,0,0|0,0,2]=4 704 B6R1.7 C[C@]1(CO)CO1 AM85933 [0,1,0,1,0,0|0,0,2]=4 705 B6R1.7 N#CC1(Br)CC1 AMY18834 [0,1,0,1,0,0|1,0,1]=4 706 B6R1.7 N#CC1(N)CC1 AM20080205 [0,1,0,1,0,0|1,0,1]=4 707 B6R1.7 NC1(CO)CC1 AM81133 [0,1,0,1,0,0|0,0,2]=4 708 B6R1.7 NC1(CO)CC1 AMY5592 [0,1,0,1,0,0|0,0,2]=4 709 B6R1.7 NCC1(F)CC1 AMY202003206 [0,1,0,1,0,0|1,0,1]=4 710 B6R1.7 NCC1(O)CC1 AM804312 [0,1,0,1,0,0|1,0,1]=4