0 B4R0.1 C#CC(=O)O AMY7000 [0,0,0,0,0,0|2,0,1]=3 1 B4R0.1 C#CC(N)=O AM20100705 [0,0,0,0,0,0|2,0,1]=3 2 B4R0.1 C#C[C@@H](C)O AMY24232 [0,0,0,0,0,0|1,0,3]=4 3 B4R0.1 C#C[C@H](C)Br AMY12092 [0,0,0,0,0,0|2,0,2]=4 4 B4R0.1 C#C[C@H](C)N AM806670 [0,0,0,0,0,0|2,0,2]=4 5 B4R0.1 C#C[C@H](C)O AMY34392 [0,0,0,0,0,0|1,0,3]=4 6 B4R0.1 C=C(Br)C=O AMY19362 [0,0,0,0,0,0|1,1,2]=4 7 B4R0.1 C=C(C)C=O AMY28760 [0,0,0,0,0,0|1,1,1]=3 8 B4R0.1 C=C(C)CBr AM85592 [0,0,0,0,0,0|2,0,0]=2 9 B4R0.1 C=C(C)CN AMY13356 [0,0,0,0,0,0|2,0,0]=2 10 B4R0.1 C=C(Cl)C#N AMY25815 [0,0,0,0,0,0|2,0,2]=4 11 B4R0.1 C=C(Cl)CCl AMY4111 [0,0,0,0,0,0|2,0,1]=3 12 B4R0.1 C=C=C(C)C AMY42296 [0,0,0,0,0,0|2,0,1]=3 13 B4R0.1 C=CC(=C)C AMY37001 [0,0,0,0,0,0|2,0,1]=3 14 B4R0.1 C=CC(=O)Cl AMY18873 [0,0,0,0,0,0|2,0,1]=3 15 B4R0.1 C=CC(=O)[O-] AMY3817 [0,0,0,0,0,0|2,0,1]=3 16 B4R0.1 C=C[C@H](C)Cl AMY617 [0,0,0,0,0,0|2,0,2]=4 17 B4R0.1 C=C[C@H](C)O AMY1257 [0,0,0,0,0,0|1,0,3]=4 18 B4R0.1 C=C[N+](=O)[O-] AMY36706 [0,0,0,0,0,0|3,0,1]=4 19 B4R0.1 CC(=N)NO AMY18111 [0,0,0,0,0,0|2,1,0]=3 20 B4R0.1 CC(=O)C#N AMY39183 [0,0,0,0,0,0|1,0,1]=2 21 B4R0.1 CC(=O)CBr AM85840 [0,0,0,0,0,0|1,0,0]=1 22 B4R0.1 CC(=O)CN AMY15017 [0,0,0,0,0,0|1,0,0]=1 23 B4R0.1 CC(=O)CN AMY25062 [0,0,0,0,0,0|1,0,0]=1 24 B4R0.1 CC(=O)NN AM20080014 [0,0,0,0,0,0|2,0,0]=2 25 B4R0.1 CC(=O)NO AM20100343 [0,0,0,0,0,0|1,1,0]=2 26 B4R0.1 CC(C)=CBr AM85707 [0,0,0,0,0,0|2,0,1]=3 27 B4R0.1 CC(C)=NN AM9761 [0,0,0,0,0,0|3,0,0]=3 28 B4R0.1 CC(C)=NO AM90369 [0,0,0,0,0,0|2,1,0]=3 29 B4R0.1 CC(C)CBr AMY25783 [0,0,0,0,0,0|2,0,1]=3 30 B4R0.1 CC(C)NN AM20090002 [0,0,0,0,0,0|3,0,1]=4 31 B4R0.1 CC(C)NN AMY202003297 [0,0,0,0,0,0|3,0,1]=4 32 B4R0.1 CC(C)ON AM90376 [0,0,0,0,0,0|3,0,1]=4 33 B4R0.1 CCB(O)O AM80871 [0,0,0,0,0,0|3,0,1]=4 34 B4R0.1 CCC(=N)N AM803843 [0,0,0,0,0,0|3,0,0]=3 35 B4R0.1 CCC(=O)Cl AMY4112 [0,0,0,0,0,0|2,0,0]=2 36 B4R0.1 CCC(=O)O AMY4114 [0,0,0,0,0,0|2,0,0]=2 37 B4R0.1 CCC(=O)[O-] AMY22300 [0,0,0,0,0,0|2,0,0]=2 38 B4R0.1 CCC(=O)[O-] AMY37013 [0,0,0,0,0,0|2,0,0]=2 39 B4R0.1 CCC(C)[O-] AMY22246 [0,0,0,0,0,0|1,0,2]=3 40 B4R0.1 CCC(N)=S AMY39288 [0,0,0,0,0,0|2,1,0]=3 41 B4R0.1 CCN(C)C AMY13339 [0,0,0,0,0,0|3,0,0]=3 42 B4R0.1 CC[C@H](C)O AMY11001 [0,0,0,0,0,0|1,0,2]=3 43 B4R0.1 CC[S@](=O)[O-] AMY15674 [0,0,0,0,0,0|3,0,0]=3 44 B4R0.1 CN(C)C=S AMY40664 [0,0,0,0,0,0|2,0,2]=4 45 B4R0.1 CN(C)CCl AMY39211 [0,0,0,0,0,0|3,0,0]=3 46 B4R0.1 CNC(=N)N AM20090228 [0,0,0,0,0,0|4,0,0]=4 47 B4R0.1 CNC(C)=O AMY4115 [0,0,0,0,0,0|2,0,0]=2 48 B4R0.1 CNC(C)C AMY13353 [0,0,0,0,0,0|3,0,1]=4 49 B4R0.1 CNC(N)=O AMY40217 [0,0,0,0,0,0|3,0,0]=3 50 B4R0.1 COC(=N)N AM85805 [0,0,0,0,0,0|4,0,0]=4 51 B4R0.1 COC(=N)N AMY8981 [0,0,0,0,0,0|4,0,0]=4 52 B4R0.1 COC(N)=O AMY4044 [0,0,0,0,0,0|3,0,0]=3 53 B4R0.1 CSC(=N)N AMY22236 [0,0,0,0,0,0|4,0,0]=4 54 B4R0.1 CSC(=N)N AMY304 [0,0,0,0,0,0|4,0,0]=4 55 B4R0.1 C[C@@H](Cl)CO AMY21413 [0,0,0,0,0,0|1,1,1]=3 56 B4R0.1 C[C@@H](N)CN AMY3648 [0,0,0,0,0,0|2,0,1]=3 57 B4R0.1 C[C@H](Br)C#N AMY39192 [0,0,0,0,0,0|2,0,2]=4 58 B4R0.1 C[C@H](Cl)CO AMY21357 [0,0,0,0,0,0|1,1,1]=3 59 B4R0.1 C[C@H](N)C#N AM9634 [0,0,0,0,0,0|2,0,2]=4 60 B4R0.1 C[C@H](N)CN AMY3672 [0,0,0,0,0,0|2,0,1]=3 61 B4R0.1 C[C@H](N)CO AM20090557 [0,0,0,0,0,0|1,1,1]=3 62 B4R0.1 C[C@H](N)CO AM20100507 [0,0,0,0,0,0|1,1,1]=3 63 B4R0.1 C[C@H](O)CN AM20090353 [0,0,0,0,0,0|1,0,2]=3 64 B4R0.1 C[C@H](O)CN AM20100779 [0,0,0,0,0,0|1,0,2]=3 65 B4R0.1 C[C@H](O)CN AM81450 [0,0,0,0,0,0|1,0,2]=3 66 B4R0.1 FC(F)CCl AMY6873 [0,0,0,0,0,0|3,0,1]=4 67 B4R0.1 FC(F)CI AMY20040 [0,0,0,0,0,0|3,0,1]=4 68 B4R0.1 F[C@@H](Br)CBr AMY6863 [0,0,0,0,0,0|3,0,1]=4 69 B4R0.1 N=C(N)NN AMY40484 [0,0,0,0,0,0|4,0,0]=4 70 B4R0.1 N=C(N)NN AMY873 [0,0,0,0,0,0|4,0,0]=4 71 B4R0.1 N=C(N)NO AMY31983 [0,0,0,0,0,0|3,1,0]=4 72 B4R0.1 NC(=O)CBr AM85872 [0,0,0,0,0,0|2,0,0]=2 73 B4R0.1 NC(=O)CCl AMY4113 [0,0,0,0,0,0|2,0,0]=2 74 B4R0.1 NC(=O)NO AMY40858 [0,0,0,0,0,0|2,1,0]=3 75 B4R0.1 NCC(=O)O AM81781 [0,0,0,0,0,0|2,0,0]=2 76 B4R0.1 NCC(=O)[O-] AMY37022 [0,0,0,0,0,0|2,0,0]=2 77 B4R0.1 NCC(F)F AMY7132 [0,0,0,0,0,0|3,0,1]=4 78 B4R0.1 NCC(N)=O AM20080473 [0,0,0,0,0,0|2,0,0]=2 79 B4R0.1 NCC(N)=O AMY20517 [0,0,0,0,0,0|2,0,0]=2 80 B4R0.1 NCC(N)=O AMY22705 [0,0,0,0,0,0|2,0,0]=2 81 B4R0.1 NNC(N)=S AM20100785 [0,0,0,0,0,0|3,1,0]=4 82 B4R0.1 O=C(Br)CBr AMY21867 [0,0,0,0,0,0|2,0,0]=2 83 B4R0.1 O=C(Cl)CBr AMY13645 [0,0,0,0,0,0|2,0,0]=2 84 B4R0.1 O=C(Cl)CCl AMY40193 [0,0,0,0,0,0|2,0,0]=2 85 B4R0.1 O=C([O-])CS AMY25320 [0,0,0,0,0,0|1,0,0]=1 86 B4R0.1 O=CC(=O)O AMY40947 [0,0,0,0,0,0|1,1,1]=3 87 B4R0.1 O=[N+]([O-])CBr AMY33516 [0,0,0,0,0,0|3,0,0]=3 88 B4R0.1 OCC(F)F AMY3957 [0,0,0,0,0,0|2,1,1]=4 89 B4R0.1 ON=C(Br)Br AMY16047 [0,0,0,0,0,0|3,1,0]=4 90 B4R0.1 [Li]CC(C)C AMY14929 [0,0,0,0,0,0|2,0,1]=3 91 B4R0.1 [Li][C@@H](C)CC AMY14890 [0,0,0,0,0,0|2,0,1]=3 92 B3R0.1 BrCCBr AMY25519 [1,0,0,0,0,0|2,0,1]=4 93 B3R0.1 C#CCBr AM85466 [1,0,0,0,0,0|1,0,2]=4 94 B3R0.1 C#CCN AM86798 [1,0,0,0,0,0|1,0,2]=4 95 B3R0.1 C#CCN AMY22227 [1,0,0,0,0,0|1,0,2]=4 96 B3R0.1 C=CCN AMY22118 [1,0,0,0,0,0|1,0,1]=3 97 B3R0.1 CC#C[Mg+] AMY1254 [1,0,0,0,0,0|1,0,2]=4 98 B3R0.1 CCCO AMY11110 [1,0,0,0,0,0|0,1,1]=3 99 B3R0.1 CCNN AM10026 [1,0,0,0,0,0|2,0,1]=4 100 B3R0.1 CCNN AMY202003286 [1,0,0,0,0,0|2,0,1]=4 101 B3R0.1 CCON AM90373 [1,0,0,0,0,0|2,0,1]=4 102 B3R0.1 CN=C=S AMY11073 [1,0,0,0,0,0|1,0,2]=4 103 B3R0.1 CNOC AM20100609 [1,0,0,0,0,0|3,0,0]=4 104 B3R0.1 CSSC AMY39506 [1,0,0,0,0,0|3,0,0]=4 105 B3R0.1 C[Se][Se]C AMY31938 [1,0,0,0,0,0|3,0,0]=4 106 B3R0.1 C\C=C\Br AMY19968 [1,0,0,0,0,0|1,0,1]=3 107 B3R0.1 ClCCBr AMY25520 [1,0,0,0,0,0|2,0,1]=4 108 B3R0.1 ClCCCl AMY33455 [1,0,0,0,0,0|2,0,1]=4 109 B3R0.1 FCCBr AMY39418 [1,0,0,0,0,0|2,0,1]=4 110 B3R0.1 FCCI AM20100746 [1,0,0,0,0,0|2,0,1]=4 111 B3R0.1 N#CCBr AMY21970 [1,0,0,0,0,0|2,0,1]=4 112 B3R0.1 N#CCF AMY33527 [1,0,0,0,0,0|2,0,1]=4 113 B3R0.1 N#CCN AMY19488 [1,0,0,0,0,0|2,0,1]=4 114 B3R0.1 NCCBr AM20090316 [1,0,0,0,0,0|2,0,1]=4 115 B3R0.1 NCCCl AMY3602 [1,0,0,0,0,0|2,0,1]=4 116 B3R0.1 NCCF AM20100176 [1,0,0,0,0,0|2,0,1]=4 117 B3R0.1 NCCS AMY202100105 [1,0,0,0,0,0|1,0,1]=3 118 B3R0.1 NNC=O AM9981 [1,0,0,0,0,0|2,0,0]=3 119 B3R0.1 OCCBr AMY39504 [1,0,0,0,0,0|1,0,2]=4 120 B3R0.1 OCCF AMY25659 [1,0,0,0,0,0|1,0,2]=4 121 B3R0.1 OCCO AMY22336 [1,0,0,0,0,0|0,1,2]=4 122 B3R0.2 C=C(C)Br AMY955 [1,0,0,0,0,0|1,0,1]=3 123 B3R0.2 C=C(C)[Mg+] AMY1042 [1,0,0,0,0,0|1,0,1]=3 124 B3R0.2 C=C(F)Cl AMY6847 [1,0,0,0,0,0|2,0,1]=4 125 B3R0.2 CC(=O)Br AMY21856 [1,0,0,0,0,0|1,0,0]=2 126 B3R0.2 CC(=O)O AMY21906 [1,0,0,0,0,0|0,1,0]=2 127 B3R0.2 CC(=O)O AMY41276 [1,0,0,0,0,0|0,1,0]=2 128 B3R0.2 CC(=O)[O-] AMY11747 [1,0,0,0,0,0|0,1,0]=2 129 B3R0.2 CC(=O)[O-] AMY1789 [1,0,0,0,0,0|0,1,0]=2 130 B3R0.2 CC(=O)[O-] AMY22485 [1,0,0,0,0,0|0,1,0]=2 131 B3R0.2 CC(=O)[O-] AMY22494 [1,0,0,0,0,0|0,1,0]=2 132 B3R0.2 CC(=O)[O-] AMY23396 [1,0,0,0,0,0|0,1,0]=2 133 B3R0.2 CC(=O)[O-] AMY23411 [1,0,0,0,0,0|0,1,0]=2 134 B3R0.2 CC(=O)[O-] AMY37172 [1,0,0,0,0,0|0,1,0]=2 135 B3R0.2 CC(=O)[O-] AMY9236 [1,0,0,0,0,0|0,1,0]=2 136 B3R0.2 CC(C)Br AMY37129 [1,0,0,0,0,0|1,0,1]=3 137 B3R0.2 CC(C)O AMY11029 [1,0,0,0,0,0|0,0,2]=3 138 B3R0.2 CC(C)[Mg+] AMY40195 [1,0,0,0,0,0|1,0,1]=3 139 B3R0.2 CC(C)[O-] AMY38606 [1,0,0,0,0,0|0,0,2]=3 140 B3R0.2 CC(C)[O-] AMY40472 [1,0,0,0,0,0|0,0,2]=3 141 B3R0.2 CP(C)C AMY19776 [1,0,0,0,0,0|2,0,0]=3 142 B3R0.2 CS(C)=O AMY14894 [1,0,0,0,0,0|1,0,0]=2 143 B3R0.2 C[PH](C)=O AM90266 [1,0,0,0,0,0|1,0,0]=2 144 B3R0.2 C[S+](C)C AMY12539 [1,0,0,0,0,0|2,0,0]=3 145 B3R0.2 C[S+](C)C AMY9344 [1,0,0,0,0,0|2,0,0]=3 146 B3R0.2 C[SiH](C)C AMY21899 [1,0,0,0,0,0|1,1,0]=3 147 B3R0.2 N=C(N)N AMY21875 [1,0,0,0,0,0|3,0,0]=4 148 B3R0.2 NC(=S)S AMY40763 [1,0,0,0,0,0|1,1,0]=3 149 B3R0.2 NC(N)=O AMY37159 [1,0,0,0,0,0|2,0,0]=3 150 B3R0.2 NC(N)=S AMY40190 [1,0,0,0,0,0|2,0,1]=4 151 B3R0.2 N[13C](N)=O AMY37002 [1,0,0,0,0,0|2,0,0]=3 152 B3R0.2 O=C([O-])O AMY40219 [1,0,0,0,0,0|1,1,0]=3 153 B3R0.2 O=C([O-])[O-] AMY31070 [1,0,0,0,0,0|1,1,0]=3 154 B3R0.2 O=[N+]([O-])[O-] AMY22245 [1,0,0,0,0,0|2,1,0]=4 155 B3R0.2 O=[N+]([O-])[O-] AMY22270 [1,0,0,0,0,0|2,1,0]=4 156 B3R0.2 O=[N+]([O-])[O-] AMY22502 [1,0,0,0,0,0|2,1,0]=4 157 B3R0.2 O=[Si]([O-])[O-] AMY37025 [1,0,0,0,0,0|1,2,0]=4 158 B5R0.1 C#CCC(=O)O AMY19285 [0,1,0,0,0,0|2,0,0]=3 159 B5R0.1 C=C(C)CCBr AMY7022 [0,1,0,0,0,0|2,0,0]=3 160 B5R0.1 C=CCC(C)=O AMY31929 [0,1,0,0,0,0|1,0,0]=2 161 B5R0.1 C=CC[C@H](C)N AM9152 [0,1,0,0,0,0|2,0,1]=4 162 B5R0.1 C=CC[C@H](C)O AM804193 [0,1,0,0,0,0|1,0,2]=4 163 B5R0.1 CC#CC(=O)Cl AMY41204 [0,1,0,0,0,0|2,0,1]=4 164 B5R0.1 CC#CC(=O)O AM90222 [0,1,0,0,0,0|2,0,1]=4 165 B5R0.1 CC(=O)CC#N AM86800 [0,1,0,0,0,0|1,0,0]=2 166 B5R0.1 CC(=O)CC#N AMY7035 [0,1,0,0,0,0|1,0,0]=2 167 B5R0.1 CC(=O)CCO AMY31061 [0,1,0,0,0,0|0,1,0]=2 168 B5R0.1 CC(=O)OCCl AMY28690 [0,1,0,0,0,0|1,0,0]=2 169 B5R0.1 CC(=O)\C=N\O AM806560 [0,1,0,0,0,0|0,1,1]=3 170 B5R0.1 CC(C)=CC=O AMY42093 [0,1,0,0,0,0|1,1,1]=4 171 B5R0.1 CC(C)=CCBr AMY21882 [0,1,0,0,0,0|2,0,0]=3 172 B5R0.1 CC(C)CNN AM806328 [0,1,0,0,0,0|2,0,1]=4 173 B5R0.1 CC(C)CNN AM9787 [0,1,0,0,0,0|2,0,1]=4 174 B5R0.1 CC(C)CON AMY31434 [0,1,0,0,0,0|1,1,1]=4 175 B5R0.1 CC(C)OCCl AMY23885 [0,1,0,0,0,0|2,0,1]=4 176 B5R0.1 CCCC(=N)N AM802888 [0,1,0,0,0,0|3,0,0]=4 177 B5R0.1 CCCC(=N)N AMY2389 [0,1,0,0,0,0|3,0,0]=4 178 B5R0.1 CCCC(C)=O AMY25524 [0,1,0,0,0,0|1,0,0]=2 179 B5R0.1 CCC[C@H](C)N AMY12548 [0,1,0,0,0,0|2,0,1]=4 180 B5R0.1 CCNC(=N)N AMY1900 [0,1,0,0,0,0|3,0,0]=4 181 B5R0.1 CCNC(C)C AMY13342 [0,1,0,0,0,0|2,0,1]=4 182 B5R0.1 CCNC(N)=S AMY18739 [0,1,0,0,0,0|2,1,0]=4 183 B5R0.1 CCOC(=S)[S-] AM20080300 [0,1,0,0,0,0|2,1,0]=4 184 B5R0.1 CCOC(C)=N AM90190 [0,1,0,0,0,0|2,0,0]=3 185 B5R0.1 CCOC(N)=O AM20100253 [0,1,0,0,0,0|2,0,0]=3 186 B5R0.1 CCO[PH](=O)[O-] AMY22458 [0,1,0,0,0,0|3,0,0]=4 187 B5R0.1 CCSC(C)=S AM90236 [0,1,0,0,0,0|1,1,0]=3 188 B5R0.1 CN(C)CCBr AM84884 [0,1,0,0,0,0|3,0,0]=4 189 B5R0.1 CN(C)CCCl AM20080022 [0,1,0,0,0,0|3,0,0]=4 190 B5R0.1 CN(C)CCCl AM20100171 [0,1,0,0,0,0|3,0,0]=4 191 B5R0.1 CN(C)CCN AM20080032 [0,1,0,0,0,0|3,0,0]=4 192 B5R0.1 CNCC(=O)O AM20080021 [0,1,0,0,0,0|2,0,0]=3 193 B5R0.1 CNCC(C)=O AM806508 [0,1,0,0,0,0|1,0,0]=2 194 B5R0.1 CNCC(N)=O AM82642 [0,1,0,0,0,0|2,0,0]=3 195 B5R0.1 COCC(=N)N AM20120573 [0,1,0,0,0,0|2,1,0]=4 196 B5R0.1 COCC(=O)Cl AMY40728 [0,1,0,0,0,0|1,1,0]=3 197 B5R0.1 COCC(=O)O AMY4059 [0,1,0,0,0,0|1,1,0]=3 198 B5R0.1 COC[C@@H](C)N AMY19545 [0,1,0,0,0,0|1,1,1]=4 199 B5R0.1 COC[C@H](C)O AM20100219 [0,1,0,0,0,0|0,1,2]=4 200 B5R0.1 CSCC(N)=O AMY10906 [0,1,0,0,0,0|1,0,0]=2 201 B5R0.1 C[C@@H](O)CCO AMY25740 [0,1,0,0,0,0|0,1,2]=4 202 B5R0.1 C[C@H](N)CCO AM84886 [0,1,0,0,0,0|1,1,1]=4 203 B5R0.1 C[C@H](N)CCO AM9719 [0,1,0,0,0,0|1,1,1]=4 204 B5R0.1 C[C@H](N)CCO AMY409 [0,1,0,0,0,0|1,1,1]=4 205 B5R0.1 C[C@H](O)CNN AM803409 [0,1,0,0,0,0|1,0,2]=4 206 B5R0.1 C\C(Br)=C/CO AMY11209 [0,1,0,0,0,0|1,1,0]=3 207 B5R0.1 C\C=C\C(=O)O AMY11255 [0,1,0,0,0,0|2,0,1]=4 208 B5R0.1 C\C=C\C(C)=O AMY31928 [0,1,0,0,0,0|1,0,1]=3 209 B5R0.1 N#CCC(N)=O AM20080019 [0,1,0,0,0,0|2,0,0]=3 210 B5R0.1 N#CNC(N)=O AMY397 [0,1,0,0,0,0|2,0,1]=4 211 B5R0.1 NCCC(=O)O AM20080020 [0,1,0,0,0,0|2,0,0]=3 212 B5R0.1 NCCC(=O)O AMY22128 [0,1,0,0,0,0|2,0,0]=3 213 B5R0.1 NCCC(N)=O AM20100576 [0,1,0,0,0,0|2,0,0]=3 214 B5R0.1 NCCC(N)=O AMY6958 [0,1,0,0,0,0|2,0,0]=3 215 B5R0.1 NNCC(=O)O AMY202100023 [0,1,0,0,0,0|2,0,0]=3 216 B5R0.1 NOCC(=O)O AMY19484 [0,1,0,0,0,0|1,1,0]=3 217 B5R0.1 O=C(Cl)CCBr AM90184 [0,1,0,0,0,0|2,0,0]=3 218 B5R0.1 O=C(O)CCBr AM20100434 [0,1,0,0,0,0|2,0,0]=3 219 B5R0.1 O=C(O)CCF AM803932 [0,1,0,0,0,0|2,0,0]=3 220 B5R0.1 O=C(O)CCO AM85796 [0,1,0,0,0,0|1,1,0]=3 221 B5R0.1 O=C(O)CCS AMY27767 [0,1,0,0,0,0|1,0,0]=2 222 B5R0.1 O=C(O)\C=C/I AMY22685 [0,1,0,0,0,0|2,0,1]=4 223 B5R0.1 O=C(O)\C=C\I AM806037 [0,1,0,0,0,0|2,0,1]=4 224 B5R0.3 C#CC(=O)OC AMY7053 [0,1,0,0,0,0|1,0,1]=3 225 B5R0.3 C=C(CCl)CCl AM80980 [0,1,0,0,0,0|2,0,0]=3 226 B5R0.3 C=C(CO)CO AM20090550 [0,1,0,0,0,0|1,1,0]=3 227 B5R0.3 C=CC(=O)CBr AMY31126 [0,1,0,0,0,0|1,0,1]=3 228 B5R0.3 CC(CBr)CBr AMY21213 [0,1,0,0,0,0|2,0,1]=4 229 B5R0.3 CC(CI)CI AMY32062 [0,1,0,0,0,0|2,0,1]=4 230 B5R0.3 CCC(=O)CC AMY11060 [0,1,0,0,0,0|1,0,0]=2 231 B5R0.3 CCC(=O)OC AMY21940 [0,1,0,0,0,0|1,0,0]=2 232 B5R0.3 CCC(N)CC AMY4054 [0,1,0,0,0,0|2,0,1]=4 233 B5R0.3 CCN(C)CC AMY13336 [0,1,0,0,0,0|3,0,0]=4 234 B5R0.3 CCN(O)CC AMY25658 [0,1,0,0,0,0|2,0,1]=4 235 B5R0.3 CC[C@@H](N)CO AM85835 [0,1,0,0,0,0|1,1,1]=4 236 B5R0.3 CC[C@@H](O)CN AMY6653 [0,1,0,0,0,0|1,0,2]=4 237 B5R0.3 CC[C@@H](O)CO AMY40578 [0,1,0,0,0,0|0,1,2]=4 238 B5R0.3 CC[C@H](Br)CBr AMY31902 [0,1,0,0,0,0|2,0,1]=4 239 B5R0.3 CC[C@H](C)CBr AMY28688 [0,1,0,0,0,0|2,0,1]=4 240 B5R0.3 CC[C@H](C)NN AM803011 [0,1,0,0,0,0|2,0,1]=4 241 B5R0.3 CC[C@H](C)NN AM9772 [0,1,0,0,0,0|2,0,1]=4 242 B5R0.3 CC[C@H](N)CO AM85834 [0,1,0,0,0,0|1,1,1]=4 243 B5R0.3 CC[C@H](N)CO AM85988 [0,1,0,0,0,0|1,1,1]=4 244 B5R0.3 CC[C@H](O)CO AMY40584 [0,1,0,0,0,0|0,1,2]=4 245 B5R0.3 CC\C(C)=N\O AM90385 [0,1,0,0,0,0|1,0,1]=3 246 B5R0.3 CN(C=O)C=O AMY39203 [0,1,0,0,0,0|1,1,1]=4 247 B5R0.3 CNC(=O)NN AMY42564 [0,1,0,0,0,0|2,0,0]=3 248 B5R0.3 COC(=O)C=O AMY1633 [0,1,0,0,0,0|0,1,1]=3 249 B5R0.3 COC(=O)CF AM20100155 [0,1,0,0,0,0|1,0,0]=2 250 B5R0.3 COC(=O)CN AM81785 [0,1,0,0,0,0|1,0,0]=2 251 B5R0.3 COC(=O)OC AMY37165 [0,1,0,0,0,0|2,0,0]=3 252 B5R0.3 COS(=O)OC AMY18046 [0,1,0,0,0,0|3,0,0]=4 253 B5R0.3 CO[C@@H](C)CN AMY21775 [0,1,0,0,0,0|1,0,2]=4 254 B5R0.3 C[C@@H](CO)CBr AMY14347 [0,1,0,0,0,0|1,0,2]=4 255 B5R0.3 ClCC(Cl)CCl AMY22833 [0,1,0,0,0,0|2,0,1]=4 256 B5R0.3 NC(CO)CO AM20100310 [0,1,0,0,0,0|1,1,1]=4 257 B5R0.3 NCC(O)CN AM20100500 [0,1,0,0,0,0|1,0,2]=4 258 B5R0.3 NC[C@H](F)CO AMY34391 [0,1,0,0,0,0|1,1,1]=4 259 B5R0.3 NC[C@H](O)CCl AMY31075 [0,1,0,0,0,0|1,0,2]=4 260 B5R0.3 NC[C@H](O)CO AM20100501 [0,1,0,0,0,0|0,1,2]=4 261 B5R0.3 NC[C@H](O)CO AM20100602 [0,1,0,0,0,0|0,1,2]=4 262 B5R0.3 NC[C@H](O)CO AMY18546 [0,1,0,0,0,0|0,1,2]=4 263 B5R0.3 NNC(=O)CCl AMY39922 [0,1,0,0,0,0|2,0,0]=3 264 B5R0.3 NNC(=O)CO AM803763 [0,1,0,0,0,0|1,1,0]=3 265 B5R0.3 NNC(=O)NN AMY40845 [0,1,0,0,0,0|3,0,0]=4 266 B5R0.3 O=C(CBr)CBr AM85919 [0,1,0,0,0,0|1,0,0]=2 267 B5R0.3 O=C(CO)CBr AMY19754 [0,1,0,0,0,0|0,1,0]=2 268 B5R0.3 OC[C@H](Br)CBr AMY25826 [0,1,0,0,0,0|1,1,1]=4 269 B5R0.3 OC[C@H](O)CCl AM81448 [0,1,0,0,0,0|0,1,2]=4 270 B5R0.3 OC[C@H](O)CCl AM81449 [0,1,0,0,0,0|0,1,2]=4 271 B5R0.3 OC[C@H](O)CCl AMY21866 [0,1,0,0,0,0|0,1,2]=4 272 B5R0.4 CC(C)(C)CBr AMY020 [0,1,0,0,0,0|2,0,1]=4 273 B5R0.4 CC(C)(C)CCl AMY1168 [0,1,0,0,0,0|2,0,1]=4 274 B5R0.4 CC(C)(C)CI AMY25581 [0,1,0,0,0,0|2,0,1]=4 275 B5R0.4 CC(C)(C)CN AMY5183 [0,1,0,0,0,0|2,0,1]=4 276 B5R0.4 CC(C)(C)CO AMY18878 [0,1,0,0,0,0|1,1,1]=4 277 B5R0.4 CC(C)(N)CN AMY14283 [0,1,0,0,0,0|2,0,1]=4 278 B5R0.4 CC(C)(N)CO AMY25550 [0,1,0,0,0,0|1,1,1]=4 279 B5R0.4 CC(C)(O)CCl AMY10400 [0,1,0,0,0,0|1,0,2]=4 280 B5R0.4 CC(C)(O)CN AM20090364 [0,1,0,0,0,0|1,0,2]=4 281 B5R0.4 CC(F)(F)CCl AMY6016 [0,1,0,0,0,0|2,0,1]=4 282 B5R0.4 CC(F)(F)CN AMY1251 [0,1,0,0,0,0|2,0,1]=4 283 B5R0.4 CC(F)(F)CO AMY1243 [0,1,0,0,0,0|1,1,1]=4 284 B5R0.4 CCC(C)(C)O AMY11089 [0,1,0,0,0,0|1,0,2]=4 285 B5R0.4 CCC(C)(C)[O-] AMY33539 [0,1,0,0,0,0|1,0,2]=4 286 B5R0.4 CCS(N)(=O)=O AMY33485 [0,1,0,0,0,0|3,0,0]=4 287 B5R0.4 CNS(C)(=O)=O AMY40669 [0,1,0,0,0,0|3,0,0]=4 288 B5R0.4 CP(C)(=O)CCl AM10868 [0,1,0,0,0,0|2,0,0]=3 289 B5R0.4 CP(C)(=O)CO AM10876 [0,1,0,0,0,0|1,1,0]=3 290 B5R0.4 CS(=O)(=O)NN AM85458 [0,1,0,0,0,0|3,0,0]=4 291 B5R0.4 CSS(C)(=O)=O AM20080910 [0,1,0,0,0,0|3,0,0]=4 292 B5R0.4 C[Si](C)(C)CBr AMY42229 [0,1,0,0,0,0|2,1,0]=4 293 B5R0.4 C[Si](C)(C)CCl AMY39317 [0,1,0,0,0,0|2,1,0]=4 294 B5R0.4 C[Si](C)(C)CI AMY42187 [0,1,0,0,0,0|2,1,0]=4 295 B5R0.4 C[Si](C)(C)CO AMY36454 [0,1,0,0,0,0|1,2,0]=4 296 B5R0.4 NCS(=O)(=O)O AMY8974 [0,1,0,0,0,0|3,0,0]=4 297 B5R0.4 [Li]C[Si](C)(C)C AMY14833 [0,1,0,0,0,0|2,1,0]=4 298 B5R0.5 C=C(C)C(=O)Cl AMY25816 [0,1,0,0,0,0|1,1,1]=4 299 B5R0.5 C=C(C)C(N)=O AMY13351 [0,1,0,0,0,0|1,1,1]=4 300 B5R0.5 C=C(F)C(=O)O AM84938 [0,1,0,0,0,0|2,0,1]=4 301 B5R0.5 CC(=O)C(=O)O AMY6082 [0,1,0,0,0,0|0,1,1]=3 302 B5R0.5 CC(=O)C(=O)[O-] AMY25534 [0,1,0,0,0,0|0,1,1]=3 303 B5R0.5 CC(=O)C(=O)[O-] AMY25673 [0,1,0,0,0,0|0,1,1]=3 304 B5R0.5 CC(=O)C(=O)[O-] AMY25702 [0,1,0,0,0,0|0,1,1]=3 305 B5R0.5 CC(=O)C(C)C AMY11021 [0,1,0,0,0,0|1,0,0]=2 306 B5R0.5 CC(=O)C(F)F AMY6800 [0,1,0,0,0,0|1,0,0]=2 307 B5R0.5 CC(=O)C(O)O AMY25827 [0,1,0,0,0,0|0,1,0]=2 308 B5R0.5 CC(=O)[C@H](C)F AMY5968 [0,1,0,0,0,0|1,0,0]=2 309 B5R0.5 CC(C)N(C)C AMY13340 [0,1,0,0,0,0|3,0,0]=4 310 B5R0.5 CC(C)[C@@H](C)N AMY22001 [0,1,0,0,0,0|2,0,1]=4 311 B5R0.5 CC(C)[C@H](C)N AMY14243 [0,1,0,0,0,0|2,0,1]=4 312 B5R0.5 CC(C)[N+](=O)[O-] AMY25784 [0,1,0,0,0,0|3,0,0]=4 313 B5R0.5 CC(F)=C(F)F AMY37198 [0,1,0,0,0,0|2,0,1]=4 314 B5R0.5 CC(O)C(=O)[O-] AMY37027 [0,1,0,0,0,0|1,1,0]=3 315 B5R0.5 C[C@H](Br)C(=O)O AM81431 [0,1,0,0,0,0|2,0,0]=3 316 B5R0.5 C[C@H](Br)C(=O)O AM81432 [0,1,0,0,0,0|2,0,0]=3 317 B5R0.5 C[C@H](Br)C(=O)O AMY21881 [0,1,0,0,0,0|2,0,0]=3 318 B5R0.5 C[C@H](Br)C(N)=O AMY7273 [0,1,0,0,0,0|2,0,0]=3 319 B5R0.5 C[C@H](Cl)C(=O)Cl AMY40167 [0,1,0,0,0,0|2,0,0]=3 320 B5R0.5 C[C@H](Cl)C(=O)O AM81429 [0,1,0,0,0,0|2,0,0]=3 321 B5R0.5 C[C@H](Cl)C(=O)O AM81430 [0,1,0,0,0,0|2,0,0]=3 322 B5R0.5 C[C@H](Cl)C(=O)O AMY4045 [0,1,0,0,0,0|2,0,0]=3 323 B5R0.5 C[C@H](F)C(=O)O AMY5967 [0,1,0,0,0,0|2,0,0]=3 324 B5R0.5 C[C@H](N)C(=O)O AM20090411 [0,1,0,0,0,0|2,0,0]=3 325 B5R0.5 C[C@H](N)C(=O)O AM20090517 [0,1,0,0,0,0|2,0,0]=3 326 B5R0.5 C[C@H](N)C(=O)O AM20100374 [0,1,0,0,0,0|2,0,0]=3 327 B5R0.5 C[C@H](N)C(N)=O AM20090503 [0,1,0,0,0,0|2,0,0]=3 328 B5R0.5 C[C@H](N)C(N)=O AM81484 [0,1,0,0,0,0|2,0,0]=3 329 B5R0.5 C[C@H](O)C(=N)N AM806558 [0,1,0,0,0,0|2,1,0]=4 330 B5R0.5 C[C@H](O)C(=O)O AM87208 [0,1,0,0,0,0|1,1,0]=3 331 B5R0.5 C[C@H](O)C(=O)[O-] AMY22237 [0,1,0,0,0,0|1,1,0]=3 332 B5R0.5 NC(=O)C(N)=O AMY23583 [0,1,0,0,0,0|1,1,1]=4 333 B5R0.5 O=C(O)C(=O)O AMY514 [0,1,0,0,0,0|1,1,1]=4 334 B5R0.5 O=C(O)C(=O)O AMY6125 [0,1,0,0,0,0|1,1,1]=4 335 B5R0.5 O=C(O)C(F)F AM20100014 [0,1,0,0,0,0|2,0,0]=3 336 B5R0.5 O=C([O-])C(Cl)Cl AMY37987 [0,1,0,0,0,0|2,0,0]=3 337 B5R0.5 O=C([O-])C(Cl)Cl AMY37994 [0,1,0,0,0,0|2,0,0]=3 338 B5R0.5 O=C([O-])[C@@H](F)Cl AMY7116 [0,1,0,0,0,0|2,0,0]=3 339 B5R0.5 O=[S@]([O-])C(F)F AMY7114 [0,1,0,0,0,0|3,0,0]=4 340 B5R1.2 BrC1CCC1 AM803913 [0,0,0,1,0,0|2,0,1]=4 341 B5R1.2 BrC1CNC1 AMY34832 [0,0,0,1,0,0|2,0,1]=4 342 B5R1.2 BrC1COC1 AM20020035 [0,0,0,1,0,0|1,1,1]=4 343 B5R1.2 CC1CNC1 AM20120351 [0,0,0,1,0,0|2,0,1]=4 344 B5R1.2 C[C@H]1CCN1 AM806564 [0,0,0,1,0,0|2,0,1]=4 345 B5R1.2 ClC1CCC1 AMY6175 [0,0,0,1,0,0|2,0,1]=4 346 B5R1.2 ClC1CNC1 AMY33719 [0,0,0,1,0,0|2,0,1]=4 347 B5R1.2 ClC1COC1 AMY34839 [0,0,0,1,0,0|1,1,1]=4 348 B5R1.2 FC1CNC1 AM20100512 [0,0,0,1,0,0|2,0,1]=4 349 B5R1.2 FC1CNC1 AMY12200 [0,0,0,1,0,0|2,0,1]=4 350 B5R1.2 FC1COC1 AM20020027 [0,0,0,1,0,0|1,1,1]=4 351 B5R1.2 IC1CCC1 AMY6180 [0,0,0,1,0,0|2,0,1]=4 352 B5R1.2 IC1COC1 AM20020026 [0,0,0,1,0,0|1,1,1]=4 353 B5R1.2 NC1CCC1 AMY2668 [0,0,0,1,0,0|2,0,1]=4 354 B5R1.2 NC1CCC1 AMY6177 [0,0,0,1,0,0|2,0,1]=4 355 B5R1.2 NC1CNC1 AMY6172 [0,0,0,1,0,0|2,0,1]=4 356 B5R1.2 NC1COC1 AM20020021 [0,0,0,1,0,0|1,1,1]=4 357 B5R1.2 NC1COC1 AM85383 [0,0,0,1,0,0|1,1,1]=4 358 B5R1.2 NC1CSC1 AM20120367 [0,0,0,1,0,0|1,0,1]=3 359 B5R1.2 O=C1CCC1 AM20070575 [0,0,0,1,0,0|1,0,0]=2 360 B5R1.2 O=C1CCN1 AMY18291 [0,0,0,1,0,0|2,0,0]=3 361 B5R1.2 O=C1CCO1 AM20020040 [0,0,0,1,0,0|2,0,0]=3 362 B5R1.2 O=C1CNC1 AM20090048 [0,0,0,1,0,0|1,0,0]=2 363 B5R1.2 O=C1CNC1 AM20100329 [0,0,0,1,0,0|1,0,0]=2 364 B5R1.2 O=C1COC1 AM20020042 [0,0,0,1,0,0|0,1,0]=2 365 B5R1.2 O=C1CSC1 AM20090216 [0,0,0,1,0,0|0,0,0]=1 366 B5R1.2 OC1CCC1 AM803645 [0,0,0,1,0,0|1,0,2]=4 367 B5R1.2 OC1CNC1 AM20100158 [0,0,0,1,0,0|1,0,2]=4 368 B5R1.2 OC1COC1 AM20020046 [0,0,0,1,0,0|0,1,2]=4 369 B5R1.2 OC1CSC1 AMY35636 [0,0,0,1,0,0|0,0,2]=3 370 B5R1.2 SC1COC1 AMY33758 [0,0,0,1,0,0|0,2,1]=4 371 B5R1.3 BrCC1CC1 AM90231 [0,0,0,1,0,0|2,0,1]=4 372 B5R1.3 BrC[C@H]1CO1 AMY31919 [0,0,0,1,0,0|1,0,2]=4 373 B5R1.3 ClCC1CC1 AM20100440 [0,0,0,1,0,0|2,0,1]=4 374 B5R1.3 ClC[C@H]1CO1 AM20090809 [0,0,0,1,0,0|1,0,2]=4 375 B5R1.3 ClC[C@H]1CO1 AM20090812 [0,0,0,1,0,0|1,0,2]=4 376 B5R1.3 ClC[C@H]1CO1 AMY40813 [0,0,0,1,0,0|1,0,2]=4 377 B5R1.3 ICC1CC1 AMY6123 [0,0,0,1,0,0|2,0,1]=4 378 B5R1.3 IC[C@H]1CO1 AMY5696 [0,0,0,1,0,0|1,0,2]=4 379 B5R1.3 NCC1CC1 AM61420 [0,0,0,1,0,0|2,0,1]=4 380 B5R1.3 OCC1CC1 AM20090298 [0,0,0,1,0,0|1,1,1]=4 381 B5R1.3 OC[C@H]1CO1 AM20100365 [0,0,0,1,0,0|0,1,2]=4 382 B5R1.3 OC[C@H]1CO1 AM20100474 [0,0,0,1,0,0|0,1,2]=4 383 B5R1.3 OC[C@H]1CO1 AM81447 [0,0,0,1,0,0|0,1,2]=4 384 B5R1.4 CC1CC1N AM806543 [0,0,0,1,0,0|2,0,1]=4 385 B5R1.4 CC1CC1N AM806563 [0,0,0,1,0,0|2,0,1]=4 386 B5R1.4 C[C@H]1C[C@H]1F AMY5813 [0,0,0,1,0,0|2,0,1]=4 387 B5R1.4 FC1CC1Br AMY5835 [0,0,0,1,0,0|2,0,1]=4 388 B5R1.4 N[C@@H]1CC1F AM84389 [0,0,0,1,0,0|2,0,1]=4 389 B5R1.4 N[C@H]1C[C@H]1N AMY35674 [0,0,0,1,0,0|2,0,1]=4 390 B5R1.5 CC1(N)CC1 AM803556 [0,0,0,1,0,0|2,0,1]=4 391 B5R1.5 CC1(O)CC1 AMY38664 [0,0,0,1,0,0|1,0,2]=4 392 B2R0.1 BrCBr AMY11088 [2,0,0,0,0,0|2,0,0]=4 393 B2R0.1 C=C[CH2-] AMY41856 [2,0,0,0,0,0|0,0,2]=4 394 B2R0.1 C=C[Mg+] AMY14834 [2,0,0,0,0,0|1,0,1]=4 395 B2R0.1 C=C[Mg+] AMY19835 [2,0,0,0,0,0|1,0,1]=4 396 B2R0.1 CCC AMY22280 [2,0,0,0,0,0|0,0,1]=3 397 B2R0.1 CCI AMY39500 [2,0,0,0,0,0|1,0,0]=3 398 B2R0.1 CC[O-] AMY14850 [2,0,0,0,0,0|0,1,0]=3 399 B2R0.1 CNC AM90364 [2,0,0,0,0,0|1,0,0]=3 400 B2R0.1 CNC AMY14900 [2,0,0,0,0,0|1,0,0]=3 401 B2R0.1 CNO AMY23438 [2,0,0,0,0,0|1,0,1]=4 402 B2R0.1 CON AM90382 [2,0,0,0,0,0|2,0,0]=4 403 B2R0.1 CSC AMY11755 [2,0,0,0,0,0|1,0,0]=3 404 B2R0.1 CSC AMY14803 [2,0,0,0,0,0|1,0,0]=3 405 B2R0.1 ClCBr AMY11119 [2,0,0,0,0,0|2,0,0]=4 406 B2R0.1 ClCI AMY2690 [2,0,0,0,0,0|2,0,0]=4 407 B2R0.1 FCBr AMY6811 [2,0,0,0,0,0|2,0,0]=4 408 B2R0.1 FCF AMY37122 [2,0,0,0,0,0|2,0,0]=4 409 B2R0.1 ICI AMY25773 [2,0,0,0,0,0|2,0,0]=4 410 B2R0.1 N=CN AMY2665 [2,0,0,0,0,0|2,0,0]=4 411 B2R0.1 NC=O AMY3583 [2,0,0,0,0,0|1,0,0]=3 412 B2R0.1 NC=S AMY33487 [2,0,0,0,0,0|1,0,1]=4 413 B2R0.1 O=CO AMY11055 [2,0,0,0,0,0|0,1,0]=3 414 B2R0.1 O=P[O-] AMY21929 [2,0,0,0,0,0|1,1,0]=4 415 B2R0.1 O=[AlH3][O-] AMY534 [2,0,0,0,0,0|1,1,0]=4 416 B2R0.1 O=[Se]=O AMY10040 [2,0,0,0,0,0|1,1,0]=4 417 B2R0.1 O=[Si]=O AMY37125 [2,0,0,0,0,0|0,2,0]=4 418 B4R0.2 BrCCCBr AMY25527 [1,1,0,0,0,0|1,0,1]=4 419 B4R0.2 C#CCOC AMY1246 [1,1,0,0,0,0|2,0,0]=4 420 B4R0.2 C=CCCCl AMY11185 [1,1,0,0,0,0|1,0,1]=4 421 B4R0.2 C=CCCO AMY14291 [1,1,0,0,0,0|0,1,1]=4 422 B4R0.2 C=CCNC AMY13350 [1,1,0,0,0,0|1,0,1]=4 423 B4R0.2 C=CCNN AM806419 [1,1,0,0,0,0|1,0,1]=4 424 B4R0.2 C=CCOC AM20100534 [1,1,0,0,0,0|0,1,1]=4 425 B4R0.2 C=CCON AM90375 [1,1,0,0,0,0|0,1,1]=4 426 B4R0.2 CC#CCBr AMY1227 [1,1,0,0,0,0|1,0,1]=4 427 B4R0.2 CC#CCO AMY19259 [1,1,0,0,0,0|0,1,1]=4 428 B4R0.2 CCCCN AMY21914 [1,1,0,0,0,0|1,0,1]=4 429 B4R0.2 CCCNN AM9771 [1,1,0,0,0,0|1,0,1]=4 430 B4R0.2 CCNCC AMY25752 [1,1,0,0,0,0|1,0,1]=4 431 B4R0.2 CCPCC AMY11725 [1,1,0,0,0,0|1,0,1]=4 432 B4R0.2 CC\C=C\Br AMY796 [1,1,0,0,0,0|1,0,1]=4 433 B4R0.2 CNCC#N AM20090317 [1,1,0,0,0,0|2,0,0]=4 434 B4R0.2 CNCCCl AM803928 [1,1,0,0,0,0|1,0,1]=4 435 B4R0.2 CNCCF AMY202003232 [1,1,0,0,0,0|1,0,1]=4 436 B4R0.2 CNCCO AMY32697 [1,1,0,0,0,0|0,1,1]=4 437 B4R0.2 COCCCl AMY25739 [1,1,0,0,0,0|1,0,1]=4 438 B4R0.2 COCCN AM808206 [1,1,0,0,0,0|1,0,1]=4 439 B4R0.2 CSCCCl AMY15533 [1,1,0,0,0,0|1,0,1]=4 440 B4R0.2 CSCCN AMY33509 [1,1,0,0,0,0|1,0,1]=4 441 B4R0.2 CSCCO AMY19250 [1,1,0,0,0,0|0,0,2]=4 442 B4R0.2 C\C=C\CCl AMY618 [1,1,0,0,0,0|1,0,0]=3 443 B4R0.2 C\C=C\CO AMY21936 [1,1,0,0,0,0|0,1,0]=3 444 B4R0.2 ClCCCBr AMY40180 [1,1,0,0,0,0|1,0,1]=4 445 B4R0.2 ClCCCCl AMY22013 [1,1,0,0,0,0|1,0,1]=4 446 B4R0.2 ClCCCI AMY25762 [1,1,0,0,0,0|1,0,1]=4 447 B4R0.2 FCCCBr AMY28674 [1,1,0,0,0,0|1,0,1]=4 448 B4R0.2 NCCCBr AM20100225 [1,1,0,0,0,0|1,0,1]=4 449 B4R0.2 NCCCN AMY21886 [1,1,0,0,0,0|1,0,1]=4 450 B4R0.2 OCCCBr AM20100533 [1,1,0,0,0,0|0,1,1]=4 451 B4R0.2 OCCCCl AMY9478 [1,1,0,0,0,0|0,1,1]=4 452 B4R0.2 OCCCF AM1014 [1,1,0,0,0,0|0,1,1]=4 453 B4R0.2 SCCCBr AM806637 [1,1,0,0,0,0|0,0,1]=3 454 B4R0.2 [Li]CCCC AMY14790 [1,1,0,0,0,0|1,0,1]=4 455 B4R0.3 CC(C)(C)N AMY14898 [1,1,0,0,0,0|1,0,1]=4 456 B4R0.3 CC(C)(C)N AMY40503 [1,1,0,0,0,0|1,0,1]=4 457 B4R0.3 CC(C)(C)O AMY11058 [1,1,0,0,0,0|0,0,2]=4 458 B4R0.3 CC(C)(C)S AMY28695 [1,1,0,0,0,0|0,1,1]=4 459 B4R0.3 CC(C)(C)[O-] AMY3409 [1,1,0,0,0,0|0,0,2]=4 460 B4R0.3 CC(C)(C)[O-] AMY36772 [1,1,0,0,0,0|0,0,2]=4 461 B4R0.3 CC(C)(C)[O-] AMY39324 [1,1,0,0,0,0|0,0,2]=4 462 B4R0.3 CP(=O)(Cl)Cl AMY21900 [1,1,0,0,0,0|2,0,0]=4 463 B4R0.3 CP(=O)(O)O AM20120404 [1,1,0,0,0,0|1,1,0]=4 464 B4R0.3 CS(=O)(=O)O AMY32450 [1,1,0,0,0,0|1,1,0]=4 465 B4R0.3 CS(=O)(=O)[O-] AMY11772 [1,1,0,0,0,0|1,1,0]=4 466 B4R0.3 CS(C)(=N)=O AMY3326 [1,1,0,0,0,0|1,0,0]=3 467 B4R0.3 CS(C)(=O)=O AMY25756 [1,1,0,0,0,0|1,0,0]=3 468 B4R0.3 C[N+](C)(C)C AMY13717 [1,1,0,0,0,0|2,0,0]=4 469 B4R0.3 C[N+](C)(C)C AMY15434 [1,1,0,0,0,0|2,0,0]=4 470 B4R0.3 C[N+](C)(C)C AMY22331 [1,1,0,0,0,0|2,0,0]=4 471 B4R0.3 C[N+](C)(C)C AMY6671 [1,1,0,0,0,0|2,0,0]=4 472 B4R0.3 C[N+](C)(C)C AMY6672 [1,1,0,0,0,0|2,0,0]=4 473 B4R0.3 C[P+](C)(C)C AMY13780 [1,1,0,0,0,0|2,0,0]=4 474 B4R0.3 C[S+](C)(C)=O AMY22243 [1,1,0,0,0,0|1,0,0]=3 475 B4R0.3 C[S+](C)(C)=O AMY24038 [1,1,0,0,0,0|1,0,0]=3 476 B4R0.3 C[Si](C)(C)Br AMY39323 [1,1,0,0,0,0|1,1,0]=4 477 B4R0.3 C[Si](C)(C)Cl AMY15614 [1,1,0,0,0,0|1,1,0]=4 478 B4R0.3 C[Si](C)(C)I AMY39353 [1,1,0,0,0,0|1,1,0]=4 479 B4R0.3 C[Si](C)(Cl)Cl AMY40504 [1,1,0,0,0,0|1,1,0]=4 480 B4R0.3 [Li]C(C)(C)C AMY14889 [1,1,0,0,0,0|1,0,1]=4 481 B6R0.1 C#CC(=O)OCC AM20100525 [0,2,0,0,0,0|1,0,1]=4 482 B6R0.1 C=CC(=O)NCC AMY36703 [0,2,0,0,0,0|1,0,1]=4 483 B6R0.1 C=CC(=O)OCC AMY40211 [0,2,0,0,0,0|1,0,1]=4 484 B6R0.1 CC#CC(=O)OC AMY1234 [0,2,0,0,0,0|1,0,1]=4 485 B6R0.1 CCC(=O)CC#N AMY10591 [0,2,0,0,0,0|1,0,0]=3 486 B6R0.1 CCNC(=O)CCl AM802871 [0,2,0,0,0,0|1,0,0]=3 487 B6R0.1 CCNC(=O)NC AM85700 [0,2,0,0,0,0|1,0,0]=3 488 B6R0.1 CCOC(=N)CCl AMY15738 [0,2,0,0,0,0|2,0,0]=4 489 B6R0.1 CCOC(=O)CBr AM20070701 [0,2,0,0,0,0|1,0,0]=3 490 B6R0.1 CCOC(=O)CC AMY21941 [0,2,0,0,0,0|1,0,0]=3 491 B6R0.1 CCOC(=O)CN AM81786 [0,2,0,0,0,0|1,0,0]=3 492 B6R0.1 CCOC(=O)NC AMY3767 [0,2,0,0,0,0|1,0,0]=3 493 B6R0.1 CCOC(=O)NN AMY23328 [0,2,0,0,0,0|2,0,0]=4 494 B6R0.1 CC\C=C(/C)C=O AMY2564 [0,2,0,0,0,0|1,0,0]=3 495 B6R0.1 CNC(=O)CC#N AM20100565 [0,2,0,0,0,0|1,0,0]=3 496 B6R0.1 CNCC(=O)OC AM82645 [0,2,0,0,0,0|1,0,0]=3 497 B6R0.1 COC(=O)CCBr AMY21872 [0,2,0,0,0,0|1,0,0]=3 498 B6R0.1 COC(=O)CCN AM20090461 [0,2,0,0,0,0|1,0,0]=3 499 B6R0.1 COC(=O)CCO AM85845 [0,2,0,0,0,0|0,1,0]=3 500 B6R0.1 COC(=O)CSC AMY10908 [0,2,0,0,0,0|0,0,0]=2 501 B6R0.1 COC(=O)OCCl AMY37648 [0,2,0,0,0,0|1,0,0]=3 502 B6R0.1 COC(=O)\C=C\I AMY21721 [0,2,0,0,0,0|1,0,1]=4 503 B6R0.1 COCC(=O)NN AMY3068 [0,2,0,0,0,0|1,1,0]=4 504 B6R0.1 COCC(=O)OC AMY4063 [0,2,0,0,0,0|0,1,0]=3 505 B6R0.1 C\C=C\C(=O)OC AMY15442 [0,2,0,0,0,0|1,0,1]=4 506 B6R0.1 N#CCC(=O)NN AMY5330 [0,2,0,0,0,0|2,0,0]=4 507 B6R0.1 O=C(CCl)CCCl AM9592 [0,2,0,0,0,0|1,0,0]=3 508 B6R0.2 CC(=O)C=C(C)C AMY23356 [0,2,0,0,0,0|1,0,1]=4 509 B6R0.2 CC(=O)CC(C)C AMY11098 [0,2,0,0,0,0|1,0,0]=3 510 B6R0.2 CC(=O)NC(C)C AMY3785 [0,2,0,0,0,0|1,0,0]=3 511 B6R0.2 CC(=O)\C=C(\C)N AMY24718 [0,2,0,0,0,0|1,0,1]=4 512 B6R0.2 CC(=O)\C=C(\C)[O-] AMY11696 [0,2,0,0,0,0|0,1,1]=4 513 B6R0.2 CC(=O)\C=C(\C)[O-] AMY19683 [0,2,0,0,0,0|0,1,1]=4 514 B6R0.2 CC(=O)\C=C(\C)[O-] AMY41912 [0,2,0,0,0,0|0,1,1]=4 515 B6R0.2 CC(C)CC(=O)O AMY40214 [0,2,0,0,0,0|2,0,0]=4 516 B6R0.2 CC(C)OC(=O)Cl AMY3776 [0,2,0,0,0,0|2,0,0]=4 517 B6R0.2 CC(O)CC(=O)[O-] AMY10051 [0,2,0,0,0,0|1,1,0]=4 518 B6R0.2 CC(O)CC(=O)[O-] AMY10054 [0,2,0,0,0,0|1,1,0]=4 519 B6R0.2 CN(C)CC(=O)O AM20080064 [0,2,0,0,0,0|2,0,0]=4 520 B6R0.2 CN(C)CC(=O)O AM81799 [0,2,0,0,0,0|2,0,0]=4 521 B6R0.2 CN(C)CC(=O)[O-] AMY42162 [0,2,0,0,0,0|2,0,0]=4 522 B6R0.2 CN(C)CC(=O)[O-] AMY42163 [0,2,0,0,0,0|2,0,0]=4 523 B6R0.2 C[C@@H](O)CC(=O)O AMY24176 [0,2,0,0,0,0|1,1,0]=4 524 B6R0.2 C[C@H](N)CC(=O)O AM20100008 [0,2,0,0,0,0|2,0,0]=4 525 B6R0.2 C[C@H](N)CC(=O)O AM20100009 [0,2,0,0,0,0|2,0,0]=4 526 B6R0.2 C[C@H](N)CC(=O)O AM20100428 [0,2,0,0,0,0|2,0,0]=4 527 B6R0.2 C[C@H](N)CC(=O)O AM804090 [0,2,0,0,0,0|2,0,0]=4 528 B6R0.2 C[C@H](O)CC(=O)O AMY10050 [0,2,0,0,0,0|1,1,0]=4 529 B6R0.2 C[C@H](O)CC(=O)O AMY24175 [0,2,0,0,0,0|1,1,0]=4 530 B6R0.2 C[C@H](O)CC(=O)[O-] AM86469 [0,2,0,0,0,0|1,1,0]=4 531 B6R0.2 C[C@H](O)CC(=O)[O-] AMY10052 [0,2,0,0,0,0|1,1,0]=4 532 B6R0.2 C[C@H](O)CC(=O)[O-] AMY10055 [0,2,0,0,0,0|1,1,0]=4 533 B6R0.2 C[S+](C)CC(=O)[O-] AM90363 [0,2,0,0,0,0|1,0,1]=4 534 B6R0.2 NC(=O)C[N+](=O)[O-] AM86587 [0,2,0,0,0,0|1,1,0]=4 535 B6R0.2 O=C(Cl)CC(=O)Cl AM10012 [0,2,0,0,0,0|1,1,0]=4 536 B6R0.2 O=C(O)CC(=O)O AMY11201 [0,2,0,0,0,0|1,1,0]=4 537 B6R0.2 O=C(O)CC(F)F AMY6157 [0,2,0,0,0,0|2,0,0]=4 538 B6R0.3 C=C(F)C(=O)OC AM20120633 [0,2,0,0,0,0|1,0,1]=4 539 B6R0.3 C=CC(=O)N(C)C AM84856 [0,2,0,0,0,0|1,0,1]=4 540 B6R0.3 C=CN(C)C(C)=O AMY3934 [0,2,0,0,0,0|1,0,1]=4 541 B6R0.3 CC(=O)C(=O)CBr AMY23002 [0,2,0,0,0,0|1,0,0]=3 542 B6R0.3 CC(=O)C(=O)CCl AMY42031 [0,2,0,0,0,0|1,0,0]=3 543 B6R0.3 CC(=O)[C@@H](C)C=O AMY6397 [0,2,0,0,0,0|0,1,0]=3 544 B6R0.3 CC(C)C(=O)NN AMY3958 [0,2,0,0,0,0|2,0,0]=4 545 B6R0.3 CCC(=O)C(=O)O AM90224 [0,2,0,0,0,0|0,1,1]=4 546 B6R0.3 CCC(=O)C(=O)[O-] AMY7718 [0,2,0,0,0,0|0,1,1]=4 547 B6R0.3 CCC(=O)C(C)=O AMY4046 [0,2,0,0,0,0|1,0,0]=3 548 B6R0.3 CCC(=O)N(C)C AMY38676 [0,2,0,0,0,0|1,0,0]=3 549 B6R0.3 CCC(=O)[C@H](C)Br AMY6079 [0,2,0,0,0,0|1,0,0]=3 550 B6R0.3 CCN(C)C(=O)Cl AM20090787 [0,2,0,0,0,0|2,0,0]=4 551 B6R0.3 CCN(O)C(C)=O AMY33549 [0,2,0,0,0,0|1,0,0]=3 552 B6R0.3 CC[C@@H](Br)C(=O)O AMY2458 [0,2,0,0,0,0|2,0,0]=4 553 B6R0.3 CC[C@@H](N)C(N)=O AMY725 [0,2,0,0,0,0|2,0,0]=4 554 B6R0.3 CC[C@H](Br)C(=O)O AM81433 [0,2,0,0,0,0|2,0,0]=4 555 B6R0.3 CC[C@H](C)C(=O)O AM802977 [0,2,0,0,0,0|1,0,1]=4 556 B6R0.3 CC[C@H](N)C(=O)O AM20080375 [0,2,0,0,0,0|2,0,0]=4 557 B6R0.3 CC[C@H](N)C(=O)O AM20090323 [0,2,0,0,0,0|2,0,0]=4 558 B6R0.3 CC[C@H](N)C(=O)O AM20090360 [0,2,0,0,0,0|2,0,0]=4 559 B6R0.3 CC[C@H](N)C(N)=O AM20100759 [0,2,0,0,0,0|2,0,0]=4 560 B6R0.3 CC[C@H](N)C(N)=O AM20120294 [0,2,0,0,0,0|2,0,0]=4 561 B6R0.3 CC[C@H](S)C(=O)O AMY2446 [0,2,0,0,0,0|1,0,0]=3 562 B6R0.3 CN(C)C(=O)CCl AM84854 [0,2,0,0,0,0|1,0,0]=3 563 B6R0.3 CN(C)C(=O)CI AM805909 [0,2,0,0,0,0|1,0,0]=3 564 B6R0.3 CN(C)C(=O)CN AM20100689 [0,2,0,0,0,0|1,0,0]=3 565 B6R0.3 CN(C)C(=O)CN AMY4281 [0,2,0,0,0,0|1,0,0]=3 566 B6R0.3 CN[C@@H](C)C(=O)O AM81482 [0,2,0,0,0,0|2,0,0]=4 567 B6R0.3 CN[C@@H](C)C(=O)O AM82991 [0,2,0,0,0,0|2,0,0]=4 568 B6R0.3 CN[C@@H](C)C(=O)O AM9397 [0,2,0,0,0,0|2,0,0]=4 569 B6R0.3 CN[C@@H](C)C(=O)[O-] AM9064 [0,2,0,0,0,0|2,0,0]=4 570 B6R0.3 CN[C@H](C)C(=O)O AMY25382 [0,2,0,0,0,0|2,0,0]=4 571 B6R0.3 COC(=O)C(=N)N AM804117 [0,2,0,0,0,0|1,0,1]=4 572 B6R0.3 COC(=O)C(C)=O AMY40825 [0,2,0,0,0,0|0,1,1]=4 573 B6R0.3 COC(=O)C(F)F AMY3631 [0,2,0,0,0,0|1,0,0]=3 574 B6R0.3 COC(=O)[C@H](C)Br AMY21873 [0,2,0,0,0,0|1,0,0]=3 575 B6R0.3 COC(=O)[C@H](C)Cl AM81434 [0,2,0,0,0,0|1,0,0]=3 576 B6R0.3 COC(=O)[C@H](C)Cl AM81435 [0,2,0,0,0,0|1,0,0]=3 577 B6R0.3 COC(=O)[C@H](C)Cl AMY3875 [0,2,0,0,0,0|1,0,0]=3 578 B6R0.3 COC(=O)[C@H](C)N AM20080254 [0,2,0,0,0,0|1,0,0]=3 579 B6R0.3 COC(=O)[C@H](C)N AM20090283 [0,2,0,0,0,0|1,0,0]=3 580 B6R0.3 COC(=O)[C@H](C)N AM81485 [0,2,0,0,0,0|1,0,0]=3 581 B6R0.3 CON(C)C(C)=O AM1188 [0,2,0,0,0,0|1,1,0]=4 582 B6R0.3 CO[C@H](C)C(=O)O AM84813 [0,2,0,0,0,0|1,1,0]=4 583 B6R0.3 C[C@@H](CN)C(=O)O AMY22008 [0,2,0,0,0,0|1,0,1]=4 584 B6R0.3 C[C@@H](CO)C(=O)O AMY18825 [0,2,0,0,0,0|0,1,1]=4 585 B6R0.3 C[C@H](C#N)C(=O)O AMY19783 [0,2,0,0,0,0|2,0,0]=4 586 B6R0.3 C\C=C(/C)C(C)=O AMY4030 [0,2,0,0,0,0|1,0,1]=4 587 B6R0.3 C\C=C(\C)C(=O)O AMY19230 [0,2,0,0,0,0|1,0,1]=4 588 B6R0.3 N#C[C@@H](N)C(N)=O AMY203 [0,2,0,0,0,0|2,0,0]=4 589 B6R0.3 NC(=O)C(N)CO AM806435 [0,2,0,0,0,0|1,1,0]=4 590 B6R0.3 NC(=O)[C@@H](N)CO AM20100594 [0,2,0,0,0,0|1,1,0]=4 591 B6R0.3 NC[C@H](N)C(=O)O AM20080367 [0,2,0,0,0,0|2,0,0]=4 592 B6R0.3 NC[C@H](N)C(=O)O AM20100354 [0,2,0,0,0,0|2,0,0]=4 593 B6R0.3 NC[C@H](N)C(=O)O AM20100470 [0,2,0,0,0,0|2,0,0]=4 594 B6R0.3 NC[C@H](O)C(=O)O AM1113 [0,2,0,0,0,0|1,1,0]=4 595 B6R0.3 NC[C@H](O)C(=O)O AM82574 [0,2,0,0,0,0|1,1,0]=4 596 B6R0.3 NNC(=O)C(F)F AMY7118 [0,2,0,0,0,0|2,0,0]=4 597 B6R0.3 N[C@@H](CCl)C(=O)O AMY22074 [0,2,0,0,0,0|2,0,0]=4 598 B6R0.3 N[C@@H](CCl)C(=O)O AMY22075 [0,2,0,0,0,0|2,0,0]=4 599 B6R0.3 N[C@@H](CO)C(=O)O AM20090412 [0,2,0,0,0,0|1,1,0]=4 600 B6R0.3 N[C@@H](CO)C(=O)O AM20090441 [0,2,0,0,0,0|1,1,0]=4 601 B6R0.3 N[C@@H](CO)C(=O)O AM20100375 [0,2,0,0,0,0|1,1,0]=4 602 B6R0.3 N[C@@H](CS)C(=O)O AM20070682 [0,2,0,0,0,0|1,0,0]=3 603 B6R0.3 N[C@@H](CS)C(=O)O AM81647 [0,2,0,0,0,0|1,0,0]=3 604 B6R0.3 N[C@@H](CS)C(=O)O AM81648 [0,2,0,0,0,0|1,0,0]=3 605 B6R0.3 N[C@@H](CS)C(=O)O AM81649 [0,2,0,0,0,0|1,0,0]=3 606 B6R0.3 N[C@@H](CS)C(=O)O AM81651 [0,2,0,0,0,0|1,0,0]=3 607 B6R0.3 N[C@H](CCl)C(=O)O AMY19767 [0,2,0,0,0,0|2,0,0]=4 608 B6R0.3 O=C(O)C(=O)CBr AM84337 [0,2,0,0,0,0|0,1,1]=4 609 B6R0.3 O=C(O)[C@@H](Br)CBr AM20100466 [0,2,0,0,0,0|2,0,0]=4 610 B6R0.4 C#CCOC(=O)Cl AMY3955 [0,2,0,0,0,0|2,0,0]=4 611 B6R0.4 C#CCOC(C)=O AM90264 [0,2,0,0,0,0|1,0,0]=3 612 B6R0.4 C=CCCC(=O)Cl AMY808 [0,2,0,0,0,0|2,0,0]=4 613 B6R0.4 C=CCCC(=O)O AMY12553 [0,2,0,0,0,0|2,0,0]=4 614 B6R0.4 C=CCCC(C)=O AM84335 [0,2,0,0,0,0|1,0,0]=3 615 B6R0.4 C=CCOC(=O)Cl AMY3928 [0,2,0,0,0,0|2,0,0]=4 616 B6R0.4 C=CCOC(C)=O AMY22115 [0,2,0,0,0,0|1,0,0]=3 617 B6R0.4 C=CNCC(=O)O AMY22733 [0,2,0,0,0,0|2,0,0]=4 618 B6R0.4 CC(=O)NCCN AMY40665 [0,2,0,0,0,0|1,0,0]=3 619 B6R0.4 CCCCC(=O)[O-] AMY026 [0,2,0,0,0,0|2,0,0]=4 620 B6R0.4 CCCOC(=O)Cl AMY3779 [0,2,0,0,0,0|2,0,0]=4 621 B6R0.4 CCOCC(=O)O AMY4062 [0,2,0,0,0,0|1,1,0]=4 622 B6R0.4 CCSCC(=O)O AM20100532 [0,2,0,0,0,0|1,0,0]=3 623 B6R0.4 CNCCC(=O)O AM84855 [0,2,0,0,0,0|2,0,0]=4 624 B6R0.4 COCCC(=O)O AMY2689 [0,2,0,0,0,0|1,1,0]=4 625 B6R0.4 NC(=O)OCCCl AMY19018 [0,2,0,0,0,0|2,0,0]=4 626 B6R0.4 NCCCC(=O)O AM20100372 [0,2,0,0,0,0|2,0,0]=4 627 B6R0.4 NCCCC(N)=O AMY15220 [0,2,0,0,0,0|2,0,0]=4 628 B6R0.4 O=C(Cl)CCCCl AMY25684 [0,2,0,0,0,0|2,0,0]=4 629 B6R0.4 O=C(O)CCCS AM20080221 [0,2,0,0,0,0|1,0,0]=3 630 B6R0.4 O=C(O)\C=C\CBr AMY7050 [0,2,0,0,0,0|2,0,0]=4 631 B6R0.5 CCOS(C)(=O)=O AMY38422 [0,2,0,0,0,0|2,0,0]=4 632 B6R0.5 CS(=O)(=O)CCBr AMY20175 [0,2,0,0,0,0|2,0,0]=4 633 B6R0.5 CS(=O)(=O)CCCl AM803975 [0,2,0,0,0,0|2,0,0]=4 634 B6R0.5 CS(=O)(=O)CCN AM20070694 [0,2,0,0,0,0|2,0,0]=4 635 B6R0.7 CC(=O)C(C)(C)N AM806454 [0,2,0,0,0,0|1,0,0]=3 636 B6R0.7 CC(=O)C(C)(C)O AM84347 [0,2,0,0,0,0|0,1,0]=3 637 B6R0.7 CC(=O)C(F)(F)F AMY3622 [0,2,0,0,0,0|1,0,0]=3 638 B6R0.7 CC(C)(Br)C(=O)Br AM84723 [0,2,0,0,0,0|2,0,0]=4 639 B6R0.7 CC(C)(Br)C(=O)O AM20090161 [0,2,0,0,0,0|2,0,0]=4 640 B6R0.7 CC(C)(Br)C(N)=O AMY7268 [0,2,0,0,0,0|2,0,0]=4 641 B6R0.7 CC(C)(N)C(=O)O AM20100517 [0,2,0,0,0,0|2,0,0]=4 642 B6R0.7 CC(C)(N)C(N)=O AMY20154 [0,2,0,0,0,0|2,0,0]=4 643 B6R0.7 CC(F)(F)C(=O)O AMY1273 [0,2,0,0,0,0|2,0,0]=4 644 B6R0.7 NC(=O)C(F)(F)F AMY3625 [0,2,0,0,0,0|2,0,0]=4 645 B6R0.7 O=C(Cl)C(F)(F)F AMY3623 [0,2,0,0,0,0|2,0,0]=4 646 B6R0.7 O=C(O)C(Br)(Br)Br AMY18080 [0,2,0,0,0,0|2,0,0]=4 647 B6R0.7 O=C(O)C(F)(F)Br AMY6892 [0,2,0,0,0,0|2,0,0]=4 648 B6R0.7 O=C(O)C(F)(F)Cl AMY3628 [0,2,0,0,0,0|2,0,0]=4 649 B6R0.7 O=C(O)C(F)(F)F AM10013 [0,2,0,0,0,0|2,0,0]=4 650 B6R0.7 O=C(O)C(F)(F)F AMY22314 [0,2,0,0,0,0|2,0,0]=4 651 B6R0.7 O=C(O)C(F)(F)F AMY35811 [0,2,0,0,0,0|2,0,0]=4 652 B6R0.7 O=C(O)C(F)(F)F AMY3605 [0,2,0,0,0,0|2,0,0]=4 653 B6R0.7 O=C([O-])C(F)(F)Br AMY6893 [0,2,0,0,0,0|2,0,0]=4 654 B6R0.7 O=C([O-])C(F)(F)Br AMY7112 [0,2,0,0,0,0|2,0,0]=4 655 B6R0.7 O=C([O-])C(F)(F)Cl AMY6799 [0,2,0,0,0,0|2,0,0]=4 656 B6R0.7 O=C([O-])C(F)(F)F AMY11767 [0,2,0,0,0,0|2,0,0]=4 657 B6R0.7 O=C([O-])C(F)(F)F AMY19734 [0,2,0,0,0,0|2,0,0]=4 658 B6R0.7 O=C([O-])C(F)(F)F AMY37341 [0,2,0,0,0,0|2,0,0]=4 659 B4R1.1 C1CNC1 AM20080889 [1,0,0,1,0,0|1,0,1]=4 660 B4R1.1 C1CNC1 AM20090583 [1,0,0,1,0,0|1,0,1]=4 661 B4R1.1 C1COC1 AM20020039 [1,0,0,1,0,0|0,1,1]=4 662 B4R1.2 BrC1CC1 AM90210 [1,0,0,1,0,0|1,0,1]=4 663 B4R1.2 C[C@H]1CO1 AM81470 [1,0,0,1,0,0|0,1,1]=4 664 B4R1.2 C[C@H]1CO1 AM81471 [1,0,0,1,0,0|0,1,1]=4 665 B4R1.2 NC1CC1 AM804333 [1,0,0,1,0,0|1,0,1]=4 666 B4R1.2 OC1CC1 AMY35209 [1,0,0,1,0,0|0,1,1]=4 667 B6R1.2 BrC1=CCCC1 AMY38286 [0,1,0,1,0,0|2,0,0]=4 668 B6R1.2 C=C1CCOC1 AMY6014 [0,1,0,1,0,0|1,1,0]=4 669 B6R1.2 CC1=CCCC1 AMY6023 [0,1,0,1,0,0|2,0,0]=4 670 B6R1.2 CC1=CSC=C1 AMY40151 [0,1,0,1,0,0|1,0,1]=4 671 B6R1.2 CC1=CSC=N1 AM20100646 [0,1,0,1,0,0|1,0,1]=4 672 B6R1.2 CC1=NCCC1 AMY886 [0,1,0,1,0,0|2,0,0]=4 673 B6R1.2 CC1=NCCS1 AMY23228 [0,1,0,1,0,0|1,1,0]=4 674 B6R1.2 N=C1CCCC1 AMY39966 [0,1,0,1,0,0|2,0,0]=4 675 B6R1.2 O=C1C=CCC1 AM61702 [0,1,0,1,0,0|1,0,1]=4 676 B6R1.2 O=C1C=CCO1 AM20100212 [0,1,0,1,0,0|1,0,1]=4 677 B6R1.2 O=C1CC=NN1 AMY11924 [0,1,0,1,0,0|2,0,0]=4 678 B6R1.2 O=C1CCCC1 AMY37126 [0,1,0,1,0,0|1,0,0]=3 679 B6R1.2 O=C1CCCN1 AMY25506 [0,1,0,1,0,0|1,0,0]=3 680 B6R1.2 O=C1CCNC1 AM20120384 [0,1,0,1,0,0|1,0,0]=3 681 B6R1.2 O=C1CCNC1 AMY6183 [0,1,0,1,0,0|1,0,0]=3 682 B6R1.2 O=C1CCNN1 AMY39277 [0,1,0,1,0,0|2,0,0]=4 683 B6R1.2 O=C1CCOC1 AM20090235 [0,1,0,1,0,0|0,1,0]=3 684 B6R1.2 O=C1CCSC1 AMY23378 [0,1,0,1,0,0|0,0,0]=2 685 B6R1.2 O=C1CNCN1 AM84594 [0,1,0,1,0,0|1,0,0]=3 686 B6R1.2 O=C1NCCN1 AM20080146 [0,1,0,1,0,0|2,0,0]=4 687 B6R1.2 O=C1NCCO1 AMY39498 [0,1,0,1,0,0|2,0,0]=4 688 B6R1.2 O[C@H]1CCSC1 AM20090505 [0,1,0,1,0,0|0,0,2]=4 689 B6R1.5 C=C1CC(N)C1 AM84287 [0,1,0,1,0,0|2,0,0]=4 690 B6R1.5 C=C1CC(N)C1 AM84288 [0,1,0,1,0,0|2,0,0]=4 691 B6R1.5 CC1CC(=O)C1 AM806996 [0,1,0,1,0,0|1,0,0]=3 692 B6R1.5 NC1CC(=O)C1 AM20070559 [0,1,0,1,0,0|1,0,0]=3 693 B6R1.5 O=C1CC(O)C1 AMY33736 [0,1,0,1,0,0|0,1,0]=3 694 B6R1.10 O=S1(=O)CCC1 AM20100397 [0,1,0,1,0,0|2,0,0]=4 695 B6R1.11 CC(=O)C1CC1 AM83286 [0,1,0,1,0,0|1,0,0]=3 696 B6R1.11 NC(=O)C1CC1 AM20100524 [0,1,0,1,0,0|2,0,0]=4 697 B6R1.11 NC(=O)[C@@H]1CN1 AMY19258 [0,1,0,1,0,0|2,0,0]=4 698 B6R1.11 O=C(Cl)C1CC1 AMY3975 [0,1,0,1,0,0|2,0,0]=4 699 B6R1.11 O=C(O)C1CC1 AM83282 [0,1,0,1,0,0|2,0,0]=4 700 B6R1.11 O=C([O-])[C@@H]1CO1 AM85800 [0,1,0,1,0,0|1,1,0]=4 701 B6R1.6 O=CC1CCC1 AM90197 [0,1,0,1,0,0|1,0,1]=4 702 B6R1.6 O=CC1COC1 AMY38489 [0,1,0,1,0,0|0,1,1]=4