0 B7R0.9 CC(C)CC(C)(C)O Amb4018559 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.9 CC(C)CP(C)(=O)Cl Amb27882661 [0,0,0,0,0,0|3,0,0]=3 2 B7R0.9 CC(C)CP(N)(N)=S Amb27838317 [0,0,0,0,0,0|3,1,0]=4 3 B7R0.9 CC(C)CS(=O)(=O)Br Amb23555503 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.9 CC(C)CS(=O)(=O)Cl Amb8397044 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.9 CC(C)CS(=O)(=O)F Amb19893332 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.9 CC(C)CS(=O)(=O)O Amb28349282 [0,0,0,0,0,0|2,0,1]=3 7 B7R0.9 CC(C)CS(=O)(=O)[S-] Amb3987906 [0,0,0,0,0,0|2,1,1]=4 8 B7R0.9 CC(C)CS(C)(=N)=O Amb32671042 [0,0,0,0,0,0|4,0,0]=4 9 B7R0.9 CC(C)CS(N)(=O)=O Amb13951979 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.9 CC(C)NS(=O)(=O)Cl Amb8384568 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.9 CC(C)NS(=O)(=O)F Amb26432309 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.9 CC(C)NS(=O)(=O)O Amb28385158 [0,0,0,0,0,0|2,0,1]=3 13 B7R0.9 CC(C)NS(C)(=N)=O Amb35725148 [0,0,0,0,0,0|4,0,0]=4 14 B7R0.9 CC(C)NS(C)(=O)=O Amb33546288 [0,0,0,0,0,0|3,0,1]=4 15 B7R0.9 CC(C)NS(N)(=O)=O Amb33546851 [0,0,0,0,0,0|3,0,1]=4 16 B7R0.9 CC(C)OC(C)(C)C Amb17673679 [0,0,0,0,0,0|4,0,0]=4 17 B7R0.9 CC(C)OP(=O)(O)O Amb22493772 [0,0,0,0,0,0|0,0,0]=0 18 B7R0.9 CC(C)OP(C)(=O)F Amb26612786 [0,0,0,0,0,0|2,0,0]=2 19 B7R0.9 CC(C)OP(C)(=O)O Amb10842159 [0,0,0,0,0,0|1,0,0]=1 20 B7R0.9 CC(C)OS(=O)(=O)Cl Amb27413553 [0,0,0,0,0,0|2,0,1]=3 21 B7R0.9 CC(C)OS(C)(=O)=O Amb8516672 [0,0,0,0,0,0|2,0,1]=3 22 B7R0.9 CC(C)OS(N)(=O)=O Amb33054164 [0,0,0,0,0,0|2,0,1]=3 23 B7R0.9 CC(C)O[Si](C)(C)C Amb22351524 [0,0,0,0,0,0|4,0,0]=4 24 B7R0.9 CC(C)SS(C)(=O)=O Amb28245514 [0,0,0,0,0,0|2,1,1]=4 25 B7R0.9 CC(Cl)OS(=O)(=O)Cl Amb27219186 [0,0,0,0,0,0|3,0,1]=4 26 B7R0.9 CC(Cl)OS(C)(=O)=O Amb28325615 [0,0,0,0,0,0|3,0,1]=4 27 B7R0.9 CC(N)CP(=O)(O)O Amb27592463 [0,0,0,0,0,0|2,0,0]=2 28 B7R0.9 CC(N)OS(=O)(=O)O Amb27168639 [0,0,0,0,0,0|2,0,1]=3 29 B7R0.9 CC(O)CS(=O)(=O)O Amb17593541 [0,0,0,0,0,0|3,0,1]=4 30 B7R0.9 C[C@H](N)CP(=O)(O)O Amb27647907 [0,0,0,0,0,0|2,0,0]=2 31 B7R0.9 C[C@H](N)CS(=O)(=O)O Amb25760668 [0,0,0,0,0,0|3,0,1]=4 32 B7R0.9 NC(=O)OP(=O)(O)O Amb33741702 [0,0,0,0,0,0|2,0,1]=3 33 B7R0.9 O=C(O)CP(=O)(O)O Amb4489433 [0,0,0,0,0,0|3,0,1]=4 34 B6R0.2 CC(=O)CC(C)C Amb4605990 [1,0,0,0,0,0|3,0,0]=4 35 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [1,0,0,0,0,0|2,0,1]=4 36 B6R0.2 CC(=O)NC(C)C Amb3366263 [1,0,0,0,0,0|3,0,0]=4 37 B6R0.2 CC(=O)OC(C)Br Amb19958925 [1,0,0,0,0,0|3,0,0]=4 38 B6R0.2 CC(=O)OC(C)C Amb3940484 [1,0,0,0,0,0|2,0,0]=3 39 B6R0.2 CC(=O)OC(C)Cl Amb24058273 [1,0,0,0,0,0|3,0,0]=4 40 B6R0.2 CC(=O)OC(C)N Amb27184949 [1,0,0,0,0,0|3,0,0]=4 41 B6R0.2 CC(=O)OC(C)O Amb27457187 [1,0,0,0,0,0|3,0,0]=4 42 B6R0.2 CC(=O)O[SiH](C)C Amb2687439 [1,0,0,0,0,0|2,1,0]=4 43 B6R0.2 CC(=S)OC(C)C Amb24697607 [1,0,0,0,0,0|2,1,0]=4 44 B6R0.2 CC(Br)CC(=O)O Amb8517108 [1,0,0,0,0,0|3,0,0]=4 45 B6R0.2 CC(C)=CB(O)O Amb2455988 [1,0,0,0,0,0|2,0,1]=4 46 B6R0.2 CC(C)=CC(=O)O Amb1485519 [1,0,0,0,0,0|2,0,1]=4 47 B6R0.2 CC(C)CB(O)O Amb2447316 [1,0,0,0,0,0|2,0,0]=3 48 B6R0.2 CC(C)CC(=O)Br Amb26486664 [1,0,0,0,0,0|3,0,0]=4 49 B6R0.2 CC(C)CC(=O)Cl Amb2792902 [1,0,0,0,0,0|3,0,0]=4 50 B6R0.2 CC(C)CC(=O)F Amb32667643 [1,0,0,0,0,0|3,0,0]=4 51 B6R0.2 CC(C)CC(=O)O Amb3939848 [1,0,0,0,0,0|2,0,0]=3 52 B6R0.2 CC(C)CC(C)O Amb6608920 [1,0,0,0,0,0|3,0,0]=4 53 B6R0.2 CC(C)CC(N)=O Amb2722931 [1,0,0,0,0,0|3,0,0]=4 54 B6R0.2 CC(C)CC(N)O Amb28383510 [1,0,0,0,0,0|3,0,0]=4 55 B6R0.2 CC(C)CC(O)O Amb27207854 [1,0,0,0,0,0|2,0,0]=3 56 B6R0.2 CC(C)CN(C)O Amb33360311 [1,0,0,0,0,0|2,1,0]=4 57 B6R0.2 CC(C)CS(=O)Cl Amb26409520 [1,0,0,0,0,0|3,0,0]=4 58 B6R0.2 CC(C)CS(=O)[O-] Amb19930010 [1,0,0,0,0,0|2,0,1]=4 59 B6R0.2 CC(C)CS(C)=O Amb27972160 [1,0,0,0,0,0|3,0,0]=4 60 B6R0.2 CC(C)CS(N)=O Amb24527860 [1,0,0,0,0,0|3,0,0]=4 61 B6R0.2 CC(C)C[C@@H](C)O Amb8517525 [1,0,0,0,0,0|3,0,0]=4 62 B6R0.2 CC(C)C[C@H](C)O Amb8517526 [1,0,0,0,0,0|3,0,0]=4 63 B6R0.2 CC(C)C[N+](=O)[O-] Amb17672613 [1,0,0,0,0,0|1,1,1]=4 64 B6R0.2 CC(C)NC(=O)Cl Amb27780560 [1,0,0,0,0,0|3,0,0]=4 65 B6R0.2 CC(C)NC(=O)S Amb27817487 [1,0,0,0,0,0|2,1,0]=4 66 B6R0.2 CC(C)NC(N)=O Amb1104587 [1,0,0,0,0,0|3,0,0]=4 67 B6R0.2 CC(C)NS(C)=O Amb27777975 [1,0,0,0,0,0|3,0,0]=4 68 B6R0.2 CC(C)OB(O)O Amb28410460 [1,0,0,0,0,0|1,0,0]=2 69 B6R0.2 CC(C)OC(=O)Cl Amb3941687 [1,0,0,0,0,0|2,0,0]=3 70 B6R0.2 CC(C)OC(=S)S Amb24465791 [1,0,0,0,0,0|1,2,0]=4 71 B6R0.2 CC(C)OC(=S)[S-] Amb19748282 [1,0,0,0,0,0|1,2,0]=4 72 B6R0.2 CC(C)OC(=S)[S-] Amb534231 [1,0,0,0,0,0|1,2,0]=4 73 B6R0.2 CC(C)OC(C)Cl Amb27650544 [1,0,0,0,0,0|3,0,0]=4 74 B6R0.2 CC(C)OC(N)=O Amb4017684 [1,0,0,0,0,0|2,0,0]=3 75 B6R0.2 CC(C)OC(N)=S Amb25732665 [1,0,0,0,0,0|2,1,0]=4 76 B6R0.2 CC(C)O[PH](=O)S Amb27447273 [1,0,0,0,0,0|0,1,0]=2 77 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [1,0,0,0,0,0|2,1,0]=4 78 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [1,0,0,0,0,0|3,0,0]=4 79 B6R0.2 CC(Cl)OC(=O)Cl Amb6608999 [1,0,0,0,0,0|3,0,0]=4 80 B6R0.2 CC(I)CC(=O)O Amb28398380 [1,0,0,0,0,0|3,0,0]=4 81 B6R0.2 CC(N)CC(=O)O Amb8379759 [1,0,0,0,0,0|3,0,0]=4 82 B6R0.2 CC(O)CC(=O)O Amb8513187 [1,0,0,0,0,0|3,0,0]=4 83 B6R0.2 CC(S)CC(=O)O Amb33538201 [1,0,0,0,0,0|3,0,0]=4 84 B6R0.2 CN(C)CC(=O)O Amb3319051 [1,0,0,0,0,0|3,0,0]=4 85 B6R0.2 CN(C)CC(=O)O Amb3940366 [1,0,0,0,0,0|3,0,0]=4 86 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [1,0,0,0,0,0|3,0,0]=4 87 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [1,0,0,0,0,0|3,0,0]=4 88 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [1,0,0,0,0,0|3,0,0]=4 89 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [1,0,0,0,0,0|3,0,0]=4 90 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [1,0,0,0,0,0|3,0,0]=4 91 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [1,0,0,0,0,0|3,0,0]=4 92 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [1,0,0,0,0,0|3,0,0]=4 93 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [1,0,0,0,0,0|3,0,0]=4 94 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [1,0,0,0,0,0|3,0,0]=4 95 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [1,0,0,0,0,0|3,0,0]=4 96 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [1,0,0,0,0,0|3,0,0]=4 97 B6R0.5 C=CCP(=O)(O)O Amb24120618 [1,0,0,0,0,0|1,0,2]=4 98 B6R0.5 C=COP(=O)(O)O Amb24599401 [1,0,0,0,0,0|0,0,2]=3 99 B6R0.5 CCCP(=O)(O)O Amb22230045 [1,0,0,0,0,0|1,0,0]=2 100 B6R0.5 CCNC(O)(O)O Amb27488723 [1,0,0,0,0,0|2,0,1]=4 101 B6R0.5 CCNS(=O)(=O)O Amb19650770 [1,0,0,0,0,0|2,0,1]=4 102 B6R0.5 CCOCl(=O)(=O)=O Amb27628193 [1,0,0,0,0,0|1,0,2]=4 103 B6R0.5 CCOP(=O)(Cl)Cl Amb4297439 [1,0,0,0,0,0|2,0,0]=3 104 B6R0.5 CCOP(C)(=O)Cl Amb4297391 [1,0,0,0,0,0|2,0,0]=3 105 B6R0.5 CCOP(C)(=O)F Amb4297377 [1,0,0,0,0,0|2,0,0]=3 106 B6R0.5 CCOP(C)(O)=S Amb22366929 [1,0,0,0,0,0|1,1,0]=3 107 B6R0.5 CCOS(=O)(=O)Cl Amb17940890 [1,0,0,0,0,0|2,0,1]=4 108 B6R0.5 CCOS(=O)(=O)[O-] Amb2560788 [1,0,0,0,0,0|1,0,2]=4 109 B6R0.5 CCOS(C)(=O)=O Amb2687884 [1,0,0,0,0,0|2,0,1]=4 110 B6R0.5 CCOS(N)(=O)=O Amb33054149 [1,0,0,0,0,0|2,0,1]=4 111 B6R0.5 CNCP(=O)(O)O Amb589043 [1,0,0,0,0,0|2,0,0]=3 112 B6R0.5 CNCP(C)(=O)O Amb4300777 [1,0,0,0,0,0|3,0,0]=4 113 B6R0.5 N#CCP(=O)(O)O Amb31254352 [1,0,0,0,0,0|2,0,1]=4 114 B6R0.5 NCCP(=O)(O)O Amb4297144 [1,0,0,0,0,0|2,0,0]=3 115 B6R0.5 O=CCP(=O)(O)O Amb27187159 [1,0,0,0,0,0|2,0,1]=4 116 B6R0.5 O=P(O)(O)CCBr Amb8479835 [1,0,0,0,0,0|2,0,0]=3 117 B6R0.5 O=P(O)(O)CCCl Amb6297766 [1,0,0,0,0,0|2,0,0]=3 118 B6R0.5 O=P(O)(O)CCO Amb22388824 [1,0,0,0,0,0|2,0,0]=3 119 B6R0.5 O=P(O)(O)\C=C\Cl Amb27592182 [1,0,0,0,0,0|2,0,1]=4 120 B8R0.24 CC(CN)OS(=O)(=O)O Amb27154843 [0,1,0,0,0,0|1,0,1]=3 121 B8R0.24 CC(CO)OP(=O)(O)O Amb25121032 [0,1,0,0,0,0|0,0,0]=1 122 B8R0.24 CC(CO)OS(C)(=O)=O Amb28454216 [0,1,0,0,0,0|2,0,1]=4 123 B8R0.24 CCC(C)OP(=O)(O)O Amb27202561 [0,1,0,0,0,0|0,0,0]=1 124 B8R0.24 CCC(C)OS(C)(=O)=O Amb22008739 [0,1,0,0,0,0|2,0,1]=4 125 B8R0.24 CCC(C)OS(N)(=O)=O Amb33054746 [0,1,0,0,0,0|2,0,1]=4 126 B8R0.24 CCC(Cl)OS(=O)(=O)O Amb27984818 [0,1,0,0,0,0|2,0,1]=4 127 B8R0.24 CCC(N)CP(=O)(O)O Amb27407104 [0,1,0,0,0,0|2,0,0]=3 128 B8R0.24 CC[C@@H](C)OS(C)(=O)=O Amb24763137 [0,1,0,0,0,0|2,0,1]=4 129 B8R0.24 CC[C@H](C)OS(C)(=O)=O Amb28043087 [0,1,0,0,0,0|2,0,1]=4 130 B8R0.24 CP(=O)(O)C[C@H](O)CN Amb27247309 [0,1,0,0,0,0|3,0,0]=4 131 B8R0.24 C[C@@H](CO)OP(=O)(O)O Amb27956601 [0,1,0,0,0,0|0,0,0]=1 132 B8R0.24 C[C@H](CCl)NP(=O)(Cl)Cl Amb28346691 [0,1,0,0,0,0|3,0,0]=4 133 B8R0.24 NCC(=O)CP(=O)(O)O Amb28141900 [0,1,0,0,0,0|2,0,1]=4 134 B8R0.24 NCC(=O)NP(=O)(O)O Amb27876829 [0,1,0,0,0,0|2,0,1]=4 135 B8R0.24 NCC(=O)OP(=O)(O)O Amb27781513 [0,1,0,0,0,0|1,0,1]=3 136 B8R0.24 O=C(CCl)OP(=O)(O)O Amb27848869 [0,1,0,0,0,0|1,0,1]=3 137 B8R0.24 O=P(O)(O)CC(O)CCl Amb3354883 [0,1,0,0,0,0|2,0,0]=3 138 B8R0.27 CC(=O)C(N)P(=O)(O)O Amb27835752 [0,1,0,0,0,0|2,0,1]=4 139 B8R0.27 CC(C)=C(F)P(=O)(O)O Amb28132465 [0,1,0,0,0,0|1,0,1]=3 140 B8R0.27 CC(C)C(N)P(=O)(O)O Amb2719706 [0,1,0,0,0,0|1,0,0]=2 141 B8R0.27 CC(C)C(N)S(=O)(=O)O Amb25918816 [0,1,0,0,0,0|2,0,1]=4 142 B8R0.27 CC(C)C(O)P(=O)(O)O Amb26927015 [0,1,0,0,0,0|1,0,0]=2 143 B8R0.27 CC(C)C(O)S(=O)(=O)O Amb35753169 [0,1,0,0,0,0|2,0,1]=4 144 B8R0.27 CC(C)[C@@H](N)P(=O)(O)O Amb8517217 [0,1,0,0,0,0|1,0,0]=2 145 B8R0.27 CC(C)[C@H](N)P(=O)(O)O Amb8517216 [0,1,0,0,0,0|1,0,0]=2 146 B8R0.27 CC(N(C)C)P(=O)(O)O Amb27879961 [0,1,0,0,0,0|2,0,0]=3 147 B8R0.27 CC(N)C(C)P(=O)(O)O Amb27423372 [0,1,0,0,0,0|2,0,0]=3 148 B8R0.27 CC(O)C(O)P(=O)(O)O Amb25235589 [0,1,0,0,0,0|2,0,0]=3 149 B8R0.27 C[C@@H](N)[C@@H](O)P(=O)(O)O Amb27813334 [0,1,0,0,0,0|2,0,0]=3 150 B8R0.27 C[C@@H](O)[C@@H](N)P(=O)(O)O Amb28254589 [0,1,0,0,0,0|2,0,0]=3 151 B8R0.27 C[C@H](N)[C@H](O)P(=O)(O)O Amb27244964 [0,1,0,0,0,0|2,0,0]=3 152 B8R0.27 C[C@H](O)[C@H](N)P(=O)(O)O Amb28366442 [0,1,0,0,0,0|2,0,0]=3 153 B8R0.33 CC(C)(C)OP(=O)(O)O Amb27430269 [0,1,0,0,0,0|0,0,0]=1 154 B8R0.33 CC(C)(C)OS(C)(=O)=O Amb25858237 [0,1,0,0,0,0|2,0,1]=4 155 B8R0.33 CC(C)(C)OS(N)(=O)=O Amb33056408 [0,1,0,0,0,0|2,0,1]=4 156 B8R0.33 CC(C)(F)OS(N)(=O)=O Amb33485274 [0,1,0,0,0,0|2,0,1]=4 157 B8R0.33 CC(C)(N)CS(=O)(=O)O Amb24738029 [0,1,0,0,0,0|2,0,1]=4 158 B8R0.33 C[Si](C)(C)OP(=O)(Cl)Cl Amb24442707 [0,1,0,0,0,0|2,1,0]=4 159 B8R0.33 O=P(O)(O)O[Mo](=O)(=O)O Amb34148925 [0,1,0,0,0,0|3,0,0]=4 160 B8R0.34 C=CS(=O)(=O)OC(C)C Amb28042953 [0,1,0,0,0,0|2,0,1]=4 161 B8R0.34 CC(C)CS(=O)(=O)NO Amb24718372 [0,1,0,0,0,0|2,0,1]=4 162 B8R0.34 CC(C)OC(C)(C)C=O Amb28199589 [0,1,0,0,0,0|3,0,0]=4 163 B8R0.34 CC(C)OC(C)(O)CCl Amb27169703 [0,1,0,0,0,0|3,0,0]=4 164 B8R0.34 CC(C)OP(C)(=O)CN Amb27822704 [0,1,0,0,0,0|2,0,0]=3 165 B8R0.34 CCP(=O)(O)OC(C)C Amb25917683 [0,1,0,0,0,0|1,0,0]=2 166 B8R0.34 CCS(=O)(=O)OC(C)C Amb24716869 [0,1,0,0,0,0|2,0,1]=4 167 B8R0.34 COP(C)(=O)OC(C)C Amb27656745 [0,1,0,0,0,0|1,0,0]=2 168 B8R1.21 C[C@H]1O[C@H]1P(=O)(O)O Amb8385971 [0,0,0,1,0,0|2,0,0]=3 169 B8R1.21 O=P(O)(O)C1OC1O Amb27266153 [0,0,0,1,0,0|3,0,0]=4 170 B8R1.21 O=P(O)(O)[C@H]1O[C@H]1O Amb27194681 [0,0,0,1,0,0|3,0,0]=4 171 B8R1.51 CC1CCS(=O)(=O)O1 Amb26382065 [0,0,0,1,0,0|2,0,1]=4 172 B8R1.51 CC1COS(=O)(=O)O1 Amb17772236 [0,0,0,1,0,0|1,0,1]=3 173 B8R1.51 C[C@@H]1COC(C)(C)O1 Amb27768765 [0,0,0,1,0,0|3,0,0]=4 174 B8R1.51 C[C@@H]1COS(=O)(=O)N1 Amb33496149 [0,0,0,1,0,0|2,0,1]=4 175 B8R1.51 C[C@@H]1COS(=O)(=O)O1 Amb22736783 [0,0,0,1,0,0|1,0,1]=3 176 B8R1.51 C[C@H]1COS(=O)(=O)N1 Amb33496148 [0,0,0,1,0,0|2,0,1]=4 177 B8R1.51 C[C@H]1COS(=O)(=O)O1 Amb28120271 [0,0,0,1,0,0|1,0,1]=3 178 B8R1.56 CS(=O)(=O)OC1CC1 Amb22491087 [0,0,0,1,0,0|2,0,1]=4 179 B8R1.56 NS(=O)(=O)OC1CC1 Amb33054170 [0,0,0,1,0,0|2,0,1]=4 180 B6R0.7 CC(=O)P(=O)(O)O Amb25229259 [0,0,0,0,1,0|1,0,1]=3 181 B6R0.7 CC(C)P(=O)(Cl)Cl Amb22047311 [0,0,0,0,1,0|2,0,0]=3 182 B6R0.7 CC(C)P(=O)(O)O Amb4297373 [0,0,0,0,1,0|0,0,0]=1 183 B6R0.7 CC(C)P(=S)(Cl)Cl Amb24588103 [0,0,0,0,1,0|2,1,0]=4 184 B6R0.7 CC(C)S(=N)(N)=O Amb29867355 [0,0,0,0,1,0|3,0,0]=4 185 B6R0.7 CC(C)S(=O)(=O)Cl Amb932841 [0,0,0,0,1,0|2,0,1]=4 186 B6R0.7 CC(C)S(=O)(=O)F Amb10609990 [0,0,0,0,1,0|2,0,1]=4 187 B6R0.7 CC(C)S(=O)(=O)I Amb27753546 [0,0,0,0,1,0|2,0,1]=4 188 B6R0.7 CC(C)S(=O)(=O)O Amb27802966 [0,0,0,0,1,0|1,0,1]=3 189 B6R0.7 CC(C)S(=O)(=O)[O-] Amb25107958 [0,0,0,0,1,0|1,0,2]=4 190 B6R0.7 CC(C)S(C)(=N)=O Amb32671056 [0,0,0,0,1,0|3,0,0]=4 191 B6R0.7 CC(C)S(C)(=O)=O Amb22731818 [0,0,0,0,1,0|2,0,1]=4 192 B6R0.7 CC(C)S(N)(=O)=O Amb10068444 [0,0,0,0,1,0|2,0,1]=4 193 B6R0.7 CC(Cl)S(=O)(=O)O Amb27955272 [0,0,0,0,1,0|2,0,1]=4 194 B6R0.7 C[C@@H](N)P(=O)(O)O Amb546329 [0,0,0,0,1,0|1,0,0]=2 195 B6R0.7 C[C@@H](O)P(=O)(O)O Amb27763847 [0,0,0,0,1,0|1,0,0]=2 196 B6R0.7 C[C@H](N)P(=O)(O)O Amb568738 [0,0,0,0,1,0|1,0,0]=2 197 B6R0.7 C[C@H](O)P(=O)(O)O Amb27987308 [0,0,0,0,1,0|1,0,0]=2 198 B6R0.7 O=P(O)(O)C(Cl)Cl Amb25286944 [0,0,0,0,1,0|2,0,0]=3 199 B8R0.29 C=C(C)CCP(=O)(O)O Amb27163975 [0,0,0,0,0,1|1,0,2]=4 200 B8R0.29 CC(=O)NCP(=O)(O)O Amb26515978 [0,0,0,0,0,1|2,0,1]=4 201 B8R0.29 CC(C)CCS(=O)(=O)O Amb26996755 [0,0,0,0,0,1|2,0,1]=4 202 B8R0.29 CC(C)COP(=O)(O)O Amb25264732 [0,0,0,0,0,1|0,0,0]=1 203 B8R0.29 CC(C)COP(C)(C)=O Amb25042087 [0,0,0,0,0,1|2,0,0]=3 204 B8R0.29 CC(C)COS(C)(=O)=O Amb22388880 [0,0,0,0,0,1|2,0,1]=4 205 B8R0.29 CC(C)COS(N)(=O)=O Amb33054160 [0,0,0,0,0,1|2,0,1]=4 206 B8R0.29 CC(C)NCS(=O)(=O)O Amb27409883 [0,0,0,0,0,1|2,0,1]=4 207 B8R0.29 CC(C)OCC(C)(C)O Amb27838443 [0,0,0,0,0,1|3,0,0]=4 208 B8R0.29 CC(C)ONS(C)(=N)=O Amb35729912 [0,0,0,0,0,1|3,0,0]=4 209 B8R0.29 CC(C)ONS(N)(=O)=O Amb28062210 [0,0,0,0,0,1|2,0,1]=4 210 B8R0.29 CC(N)CCP(=O)(O)O Amb27392223 [0,0,0,0,0,1|2,0,0]=3 211 B8R0.29 CC(O)COP(C)(=O)O Amb28069786 [0,0,0,0,0,1|2,0,0]=3 212 B8R0.29 CC(O)CO[PH](O)(O)O Amb27466492 [0,0,0,0,0,1|1,0,2]=4 213 B8R0.29 CC(O)NCP(=O)(O)O Amb27201283 [0,0,0,0,0,1|2,0,0]=3 214 B8R0.29 CN(C)CCP(=O)(O)O Amb26639131 [0,0,0,0,0,1|2,0,0]=3 215 B8R0.29 C[C@@H](N)COS(=O)(=O)O Amb27598040 [0,0,0,0,0,1|2,0,1]=4 216 B8R0.29 NC(=O)COP(=O)(O)O Amb27760380 [0,0,0,0,0,1|2,0,1]=4 217 B8R0.29 O=C(O)COP(=O)(O)O Amb24442945 [0,0,0,0,0,1|2,0,1]=4 218 B8R0.29 O=P(O)(O)OCC(O)O Amb28315516 [0,0,0,0,0,1|2,0,0]=3 219 B5R0.1 C=COC(C)C Amb22230777 [2,0,0,0,0,0|2,0,0]=4 220 B5R0.1 CC(C)C=C=O Amb27858445 [2,0,0,0,0,0|2,0,0]=4 221 B5R0.1 CC(C)CC=O Amb3939851 [2,0,0,0,0,0|2,0,0]=4 222 B5R0.1 CC(C)CCO Amb4605831 [2,0,0,0,0,0|2,0,0]=4 223 B5R0.1 CC(C)CNO Amb25887512 [2,0,0,0,0,0|1,1,0]=4 224 B5R0.1 CC(C)N=C=O Amb3939055 [2,0,0,0,0,0|2,0,0]=4 225 B5R0.1 CC(C)NC=O Amb4017634 [2,0,0,0,0,0|2,0,0]=4 226 B5R0.1 CC(C)OC=N Amb22337834 [2,0,0,0,0,0|2,0,0]=4 227 B5R0.1 CC(C)OC=O Amb9787311 [2,0,0,0,0,0|1,0,0]=3 228 B5R0.1 CC(C)OCCl Amb33545059 [2,0,0,0,0,0|2,0,0]=4 229 B5R0.1 CC(C)OCN Amb28315690 [2,0,0,0,0,0|2,0,0]=4 230 B5R0.1 CC(C)ON=O Amb17938692 [2,0,0,0,0,0|0,1,0]=3 231 B5R0.1 CC(C)\C=N\O Amb2455920 [2,0,0,0,0,0|1,1,0]=4 232 B5R0.1 CCCB(O)O Amb2447105 [2,0,0,0,0,0|2,0,0]=4 233 B5R0.1 CCCC(=O)O Amb3939012 [2,0,0,0,0,0|2,0,0]=4 234 B5R0.1 CCCC(O)O Amb26364594 [2,0,0,0,0,0|2,0,0]=4 235 B5R0.1 CCOB(O)O Amb27221375 [2,0,0,0,0,0|1,0,0]=3 236 B5R0.1 CCOC(=O)Cl Amb2793045 [2,0,0,0,0,0|2,0,0]=4 237 B5R0.1 CCOC(=O)O Amb8393208 [2,0,0,0,0,0|1,0,0]=3 238 B5R0.1 CCOC(C)=O Amb3940488 [2,0,0,0,0,0|2,0,0]=4 239 B5R0.1 CCOC(C)C Amb22230687 [2,0,0,0,0,0|2,0,0]=4 240 B5R0.1 CCOC(N)=O Amb6608672 [2,0,0,0,0,0|2,0,0]=4 241 B5R0.1 CCOS(=O)Cl Amb25239825 [2,0,0,0,0,0|2,0,0]=4 242 B5R0.1 CCO[N+](=O)[O-] Amb22732543 [2,0,0,0,0,0|0,1,1]=4 243 B5R0.1 CCO[PH](=O)O Amb22360741 [2,0,0,0,0,0|0,0,0]=2 244 B5R0.1 CCO[PH](=O)[O-] Amb22731647 [2,0,0,0,0,0|0,0,1]=3 245 B5R0.1 CCO[Si](=O)O Amb26569259 [2,0,0,0,0,0|1,0,0]=3 246 B5R0.1 NCC[PH](=O)O Amb22168066 [2,0,0,0,0,0|2,0,0]=4 247 B5R0.1 NCC[PH](=O)O Amb35788864 [2,0,0,0,0,0|2,0,0]=4 248 B5R0.4 C=CP(=O)(O)O Amb8395093 [2,0,0,0,0,0|0,0,2]=4 249 B5R0.4 CCP(=O)(Cl)Cl Amb4297380 [2,0,0,0,0,0|2,0,0]=4 250 B5R0.4 CCP(=O)(O)O Amb22043333 [2,0,0,0,0,0|0,0,0]=2 251 B5R0.4 CCP(C)(=O)Cl Amb26008128 [2,0,0,0,0,0|2,0,0]=4 252 B5R0.4 CCP(C)(=O)O Amb25062086 [2,0,0,0,0,0|1,0,0]=3 253 B5R0.4 CCS(=O)(=O)O Amb8516474 [2,0,0,0,0,0|1,0,1]=4 254 B5R0.4 COP(=O)(Cl)Cl Amb8393927 [2,0,0,0,0,0|2,0,0]=4 255 B5R0.4 COP(=O)(O)O Amb25810825 [2,0,0,0,0,0|0,0,0]=2 256 B5R0.4 COP(=O)(S)Cl Amb27626828 [2,0,0,0,0,0|1,1,0]=4 257 B5R0.4 COP(C)(=O)O Amb22230925 [2,0,0,0,0,0|1,0,0]=3 258 B5R0.4 COP(C)(O)=S Amb28322868 [2,0,0,0,0,0|1,1,0]=4 259 B5R0.4 COS(=O)(=O)O Amb17672864 [2,0,0,0,0,0|1,0,1]=4 260 B5R0.4 CP(=O)(O)CCl Amb28072857 [2,0,0,0,0,0|2,0,0]=4 261 B5R0.4 CP(=O)(O)CN Amb27881743 [2,0,0,0,0,0|2,0,0]=4 262 B5R0.4 NCP(=O)(O)O Amb4062871 [2,0,0,0,0,0|1,0,0]=3 263 B5R0.4 NCP(O)(O)=S Amb27413826 [2,0,0,0,0,0|1,1,0]=4 264 B5R0.4 O=P(O)(O)CBr Amb25983646 [2,0,0,0,0,0|1,0,0]=3 265 B5R0.4 O=P(O)(O)CCl Amb17940018 [2,0,0,0,0,0|1,0,0]=3 266 B5R0.4 O=P(O)(O)CO Amb4297374 [2,0,0,0,0,0|1,0,0]=3 267 B7R0.2 C#CC(=O)OC(C)C Amb25345845 [1,1,0,0,0,0|2,0,0]=4 268 B7R0.2 C=CC(=O)OC(C)C Amb22734220 [1,1,0,0,0,0|2,0,0]=4 269 B7R0.2 CC(=O)OC(C)CBr Amb26477506 [1,1,0,0,0,0|2,0,0]=4 270 B7R0.2 CC(=O)OC(C)CN Amb27838841 [1,1,0,0,0,0|2,0,0]=4 271 B7R0.2 CC(C)CC(=O)CO Amb18559774 [1,1,0,0,0,0|2,0,0]=4 272 B7R0.2 CC(C)CC(=O)NO Amb6280209 [1,1,0,0,0,0|2,0,0]=4 273 B7R0.2 CC(C)CC(O)C=O Amb27250174 [1,1,0,0,0,0|2,0,0]=4 274 B7R0.2 CC(C)CC(O)CO Amb24731733 [1,1,0,0,0,0|2,0,0]=4 275 B7R0.2 CC(C)C[C@@H](O)CO Amb27406200 [1,1,0,0,0,0|2,0,0]=4 276 B7R0.2 CC(C)C[C@H](O)CO Amb27432389 [1,1,0,0,0,0|2,0,0]=4 277 B7R0.2 CC(C)NC(=O)CO Amb5798170 [1,1,0,0,0,0|2,0,0]=4 278 B7R0.2 CC(C)NC(=O)NO Amb27838415 [1,1,0,0,0,0|2,0,0]=4 279 B7R0.2 CC(C)NN(O)N=O Amb27423687 [1,1,0,0,0,0|1,1,0]=4 280 B7R0.2 CC(C)OC(=O)C#N Amb27263089 [1,1,0,0,0,0|2,0,0]=4 281 B7R0.2 CC(C)OC(=O)CBr Amb3939972 [1,1,0,0,0,0|2,0,0]=4 282 B7R0.2 CC(C)OC(=O)CCl Amb1153072 [1,1,0,0,0,0|2,0,0]=4 283 B7R0.2 CC(C)OC(=O)CN Amb10807427 [1,1,0,0,0,0|2,0,0]=4 284 B7R0.2 CC(C)OC(=O)CN Amb9289819 [1,1,0,0,0,0|2,0,0]=4 285 B7R0.2 CC(C)OC(=O)CO Amb3941003 [1,1,0,0,0,0|1,0,0]=3 286 B7R0.2 CC(C)OC(=O)CS Amb2698248 [1,1,0,0,0,0|1,1,0]=4 287 B7R0.2 CC(C)OC(=O)NF Amb27165196 [1,1,0,0,0,0|2,0,0]=4 288 B7R0.2 CC(C)OC(=O)NN Amb19516135 [1,1,0,0,0,0|2,0,0]=4 289 B7R0.2 CC(C)OC(C)C=O Amb25243083 [1,1,0,0,0,0|2,0,0]=4 290 B7R0.2 CC(C)OC(N)=S=O Amb27814664 [1,1,0,0,0,0|2,0,0]=4 291 B7R0.2 CC(C)OC(O)CO Amb27761642 [1,1,0,0,0,0|1,0,0]=3 292 B7R0.2 CC(CCl)OC(=O)Cl Amb27482960 [1,1,0,0,0,0|2,0,0]=4 293 B7R0.2 CC(CCl)OC(=O)F Amb27424209 [1,1,0,0,0,0|2,0,0]=4 294 B7R0.2 CC(CF)CC(=O)O Amb25990964 [1,1,0,0,0,0|2,0,0]=4 295 B7R0.2 CC(CN)CB(O)O Amb27166460 [1,1,0,0,0,0|2,0,0]=4 296 B7R0.2 CC(CN)CC(=O)O Amb18124263 [1,1,0,0,0,0|2,0,0]=4 297 B7R0.2 CC(CN)CC(=O)O Amb20669501 [1,1,0,0,0,0|2,0,0]=4 298 B7R0.2 CC(CN)CC(=O)O Amb32752805 [1,1,0,0,0,0|2,0,0]=4 299 B7R0.2 CC(CN)CP(O)O Amb27838320 [1,1,0,0,0,0|1,0,1]=4 300 B7R0.2 CC(CN)O[PH](=O)O Amb28388782 [1,1,0,0,0,0|0,0,0]=2 301 B7R0.2 CC(CO)CC(=O)O Amb18198168 [1,1,0,0,0,0|2,0,0]=4 302 B7R0.2 CC(CO)OC(N)=O Amb26402233 [1,1,0,0,0,0|2,0,0]=4 303 B7R0.2 CC(CO)OP(O)O Amb27982304 [1,1,0,0,0,0|0,0,1]=3 304 B7R0.2 CC(CO)O[N+](=O)[O-] Amb33299443 [1,1,0,0,0,0|0,1,1]=4 305 B7R0.2 CCC(C)CB(O)O Amb27591902 [1,1,0,0,0,0|2,0,0]=4 306 B7R0.2 CCC(C)CC(=O)O Amb2689581 [1,1,0,0,0,0|2,0,0]=4 307 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [1,1,0,0,0,0|2,0,0]=4 308 B7R0.2 CCC(C)O[N+](=O)[O-] Amb25088971 [1,1,0,0,0,0|0,1,1]=4 309 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [1,1,0,0,0,0|2,0,0]=4 310 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [1,1,0,0,0,0|2,0,0]=4 311 B7R0.2 CNC(=O)OC(C)C Amb27838350 [1,1,0,0,0,0|2,0,0]=4 312 B7R0.2 CNC(C)CC(=O)O Amb21959674 [1,1,0,0,0,0|2,0,0]=4 313 B7R0.2 CNC(C)CC(=O)O Amb9398363 [1,1,0,0,0,0|2,0,0]=4 314 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [1,1,0,0,0,0|2,0,0]=4 315 B7R0.2 COC(=O)CC(C)C Amb9241810 [1,1,0,0,0,0|2,0,0]=4 316 B7R0.2 COC(=O)NC(C)C Amb17861698 [1,1,0,0,0,0|2,0,0]=4 317 B7R0.2 COC(=O)OC(C)C Amb22049510 [1,1,0,0,0,0|1,0,0]=3 318 B7R0.2 COC(=O)OC(C)Cl Amb28320721 [1,1,0,0,0,0|2,0,0]=4 319 B7R0.2 COC(=O)OC(C)F Amb28251346 [1,1,0,0,0,0|2,0,0]=4 320 B7R0.2 COC(=O)OC(C)O Amb28207359 [1,1,0,0,0,0|2,0,0]=4 321 B7R0.2 COC(C)CC(=O)O Amb4001695 [1,1,0,0,0,0|2,0,0]=4 322 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [1,1,0,0,0,0|2,0,0]=4 323 B7R0.2 CSC(C)CC(=O)O Amb18967824 [1,1,0,0,0,0|2,0,0]=4 324 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [1,1,0,0,0,0|2,0,0]=4 325 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [1,1,0,0,0,0|2,0,0]=4 326 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [1,1,0,0,0,0|2,0,0]=4 327 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [1,1,0,0,0,0|2,0,0]=4 328 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [1,1,0,0,0,0|2,0,0]=4 329 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [1,1,0,0,0,0|2,0,0]=4 330 B7R0.2 NCC(F)C[PH](=O)O Amb28398603 [1,1,0,0,0,0|2,0,0]=4 331 B7R0.2 NC[C@@H](F)C[PH](=O)O Amb24481490 [1,1,0,0,0,0|2,0,0]=4 332 B7R0.2 NC[C@@H](O)C[PH](=O)O Amb27596096 [1,1,0,0,0,0|2,0,0]=4 333 B7R0.2 NC[C@H](F)C[PH](=O)O Amb27216774 [1,1,0,0,0,0|2,0,0]=4 334 B7R0.16 C=C(C(=O)O)C(C)C Amb17593189 [1,1,0,0,0,0|2,0,0]=4 335 B7R0.16 CC(C)C(=N)C(=O)O Amb28073845 [1,1,0,0,0,0|2,0,0]=4 336 B7R0.16 CC(C)C(=O)C(=O)O Amb6600000 [1,1,0,0,0,0|2,0,0]=4 337 B7R0.16 CC(C)C(Br)C(=O)O Amb9703217 [1,1,0,0,0,0|2,0,0]=4 338 B7R0.16 CC(C)C(C)C(=O)O Amb17087469 [1,1,0,0,0,0|2,0,0]=4 339 B7R0.16 CC(C)C(Cl)C(=O)O Amb6739911 [1,1,0,0,0,0|2,0,0]=4 340 B7R0.16 CC(C)C(F)C(=O)O Amb19957386 [1,1,0,0,0,0|2,0,0]=4 341 B7R0.16 CC(C)C(N)B(O)O Amb24482349 [1,1,0,0,0,0|2,0,0]=4 342 B7R0.16 CC(C)C(N)C(=O)O Amb5718386 [1,1,0,0,0,0|2,0,0]=4 343 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [1,1,0,0,0,0|2,0,0]=4 344 B7R0.16 CC(C)C(O)[PH](=O)O Amb27430184 [1,1,0,0,0,0|1,0,0]=3 345 B7R0.16 CC(C)C(S)C(=O)O Amb18282761 [1,1,0,0,0,0|2,0,0]=4 346 B7R0.16 CC(C)[C@@H](Br)C(=O)O Amb8629113 [1,1,0,0,0,0|2,0,0]=4 347 B7R0.16 CC(C)[C@@H](C)C(=O)O Amb10844600 [1,1,0,0,0,0|2,0,0]=4 348 B7R0.16 CC(C)[C@@H](N)C(=O)O Amb2720566 [1,1,0,0,0,0|2,0,0]=4 349 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [1,1,0,0,0,0|2,0,0]=4 350 B7R0.16 CC(C)[C@H](Br)C(=O)O Amb8629114 [1,1,0,0,0,0|2,0,0]=4 351 B7R0.16 CC(C)[C@H](C)B(O)O Amb27604530 [1,1,0,0,0,0|2,0,0]=4 352 B7R0.16 CC(C)[C@H](C)C(=O)O Amb10844601 [1,1,0,0,0,0|2,0,0]=4 353 B7R0.16 CC(C)[C@H](N)C(=O)O Amb2725465 [1,1,0,0,0,0|2,0,0]=4 354 B7R0.16 CC(C)[C@H](N)[PH](=O)O Amb27814729 [1,1,0,0,0,0|1,0,0]=3 355 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [1,1,0,0,0,0|2,0,0]=4 356 B7R0.8 CCCCP(=O)(O)O Amb22053921 [1,1,0,0,0,0|1,0,0]=3 357 B7R0.8 CCCOP(=O)(O)O Amb27789994 [1,1,0,0,0,0|0,0,0]=2 358 B7R0.8 CCCOP(C)(=O)O Amb24553958 [1,1,0,0,0,0|1,0,0]=3 359 B7R0.8 CCOCP(=O)(Cl)Cl Amb26515772 [1,1,0,0,0,0|2,0,0]=4 360 B7R0.8 CC\C=C\P(=O)(O)O Amb22388769 [1,1,0,0,0,0|1,0,0]=3 361 B7R0.8 CNCCP(=O)(O)O Amb27751957 [1,1,0,0,0,0|1,0,0]=3 362 B7R0.8 CP(=O)(O)CCCN Amb634789 [1,1,0,0,0,0|2,0,0]=4 363 B7R0.8 CP(=O)(O)NCCO Amb27652858 [1,1,0,0,0,0|2,0,0]=4 364 B7R0.8 CP(=O)(O)OCCO Amb27397295 [1,1,0,0,0,0|1,0,0]=3 365 B7R0.8 CP(=O)(O)SCCN Amb27227981 [1,1,0,0,0,0|1,1,0]=4 366 B7R0.8 NCCCP(=O)(O)O Amb2714831 [1,1,0,0,0,0|1,0,0]=3 367 B7R0.8 NCCOP(=O)(O)O Amb3941645 [1,1,0,0,0,0|0,0,0]=2 368 B7R0.8 NCCOS(=O)(=O)O Amb8513052 [1,1,0,0,0,0|1,0,1]=4 369 B7R0.8 NCCO[P-](=O)(=O)O Amb27394652 [1,1,0,0,0,0|0,0,2]=4 370 B7R0.8 NNCOP(=O)(O)O Amb27666230 [1,1,0,0,0,0|1,0,0]=3 371 B7R0.8 O=CCOP(=O)(O)O Amb27169501 [1,1,0,0,0,0|0,0,1]=3 372 B7R0.8 O=P(Cl)(Cl)OCCCl Amb22730024 [1,1,0,0,0,0|2,0,0]=4 373 B7R0.8 O=P(O)(O)CCCCl Amb22388825 [1,1,0,0,0,0|1,0,0]=3 374 B7R0.8 O=P(O)(O)CCCO Amb28207371 [1,1,0,0,0,0|1,0,0]=3 375 B7R0.8 O=P(O)(O)OCCO Amb26068184 [1,1,0,0,0,0|0,0,0]=2 376 B7R0.8 O=S(=O)(O)OCCCl Amb25064355 [1,1,0,0,0,0|1,0,1]=4 377 B7R0.11 CCOC(C)(O)CO Amb25082845 [1,1,0,0,0,0|2,0,0]=4 378 B7R0.11 CCOP(=O)(Cl)CC Amb4297378 [1,1,0,0,0,0|2,0,0]=4 379 B7R0.11 CCOP(=O)(O)CC Amb27246570 [1,1,0,0,0,0|1,0,0]=3 380 B7R0.11 CCOP(=O)(O)CCl Amb27494027 [1,1,0,0,0,0|1,0,0]=3 381 B7R0.11 CCOP(=O)(O)CO Amb28194261 [1,1,0,0,0,0|0,0,0]=2 382 B7R0.11 CCOP(=O)(S)SC Amb28057470 [1,1,0,0,0,0|0,2,0]=4 383 B7R0.11 CCOP(C)(=O)CCl Amb27834305 [1,1,0,0,0,0|2,0,0]=4 384 B7R0.11 CCO[C@](C)(O)CO Amb26515757 [1,1,0,0,0,0|2,0,0]=4 385 B7R0.11 COP(=O)(O)CCN Amb27961159 [1,1,0,0,0,0|2,0,0]=4 386 B7R0.14 C=C(CN)P(=O)(O)O Amb25113500 [1,1,0,0,0,0|2,0,0]=4 387 B7R0.14 CCC(Cl)P(=O)(O)O Amb27657245 [1,1,0,0,0,0|1,0,0]=3 388 B7R0.14 CCC(N)P(C)(=O)O Amb27390481 [1,1,0,0,0,0|2,0,0]=4 389 B7R0.14 CCC(O)P(=O)(O)O Amb24354457 [1,1,0,0,0,0|1,0,0]=3 390 B7R0.14 CC[C@@H](N)P(=O)(O)O Amb8516010 [1,1,0,0,0,0|1,0,0]=3 391 B7R0.14 CC[C@H](N)P(=O)(O)O Amb8517200 [1,1,0,0,0,0|1,0,0]=3 392 B7R0.14 COC(=O)P(=O)(O)O Amb22388745 [1,1,0,0,0,0|2,0,0]=4 393 B7R0.14 NC(CCl)P(=O)(O)O Amb27410198 [1,1,0,0,0,0|2,0,0]=4 394 B7R0.14 NCC(Br)P(=O)(O)O Amb28184523 [1,1,0,0,0,0|2,0,0]=4 395 B7R0.14 NCC(F)P(=O)(O)O Amb28132701 [1,1,0,0,0,0|2,0,0]=4 396 B7R0.14 NCC(N)P(=O)(O)O Amb27839530 [1,1,0,0,0,0|2,0,0]=4 397 B7R0.14 NCC(O)P(=O)(O)O Amb9805623 [1,1,0,0,0,0|2,0,0]=4 398 B7R0.14 NC[C@@H](O)P(=O)(O)O Amb25293388 [1,1,0,0,0,0|2,0,0]=4 399 B7R0.14 N[C@H](CCl)P(=O)(O)O Amb27590220 [1,1,0,0,0,0|2,0,0]=4 400 B7R0.14 O=C(CCl)P(=O)(O)O Amb27196109 [1,1,0,0,0,0|2,0,0]=4 401 B7R0.13 CC(C)C(C)(O)CO Amb26646825 [0,1,0,0,1,0|2,0,0]=4 402 B7R0.13 CC(C)S(=N)(=O)NO Amb35711043 [0,1,0,0,1,0|2,0,0]=4 403 B7R0.13 CC(C)S(=O)(=O)NO Amb26647421 [0,1,0,0,1,0|1,0,1]=4 404 B7R0.13 CC(C)[C@](C)(O)CO Amb27472625 [0,1,0,0,1,0|2,0,0]=4 405 B7R0.13 CCP(=O)(O)C(C)N Amb27167390 [0,1,0,0,1,0|2,0,0]=4 406 B7R0.13 COP(C)(=O)C(C)O Amb27946719 [0,1,0,0,1,0|2,0,0]=4 407 B7R0.17 CC(C)(C)P(=O)(O)O Amb8515591 [0,1,0,0,1,0|0,0,0]=2 408 B7R0.17 CC(C)(C)S(=O)(=O)O Amb33463753 [0,1,0,0,1,0|1,0,1]=4 409 B7R0.17 CC(C)(N)P(=O)(O)O Amb33544940 [0,1,0,0,1,0|0,0,0]=2 410 B7R0.17 O=P(O)(O)C(F)(F)F Amb2691009 [0,1,0,0,1,0|2,0,0]=4 411 B9R0.10 CC(C)CC(N)P(=O)(O)O Amb564159 [0,1,0,0,0,1|1,0,0]=3 412 B9R0.10 CC(C)CC(O)P(=O)(O)O Amb28050623 [0,1,0,0,0,1|1,0,0]=3 413 B9R0.10 CC(C)CC(O)P(C)(=O)O Amb27971788 [0,1,0,0,0,1|2,0,0]=4 414 B9R0.10 CC(C)C[C@@H](N)P(=O)(O)O Amb25992755 [0,1,0,0,0,1|1,0,0]=3 415 B9R0.10 CC(C)C[C@H](N)P(=O)(O)O Amb25889931 [0,1,0,0,0,1|1,0,0]=3 416 B9R0.10 CC(C)C[C@H](O)P(=O)(O)O Amb28126885 [0,1,0,0,0,1|1,0,0]=3 417 B9R0.21 CC(C=O)CCP(=O)(O)O Amb27261915 [0,1,0,0,0,1|1,0,1]=4 418 B9R0.21 CC[C@@H](O)COP(=O)(O)O Amb27765919 [0,1,0,0,0,1|1,0,0]=3 419 B9R0.21 CNC(C)COS(=O)(=O)O Amb27425086 [0,1,0,0,0,1|1,0,1]=4 420 B9R0.21 C[C@@H](C=O)COP(=O)(O)O Amb28253613 [0,1,0,0,0,1|0,0,1]=3 421 B9R0.21 NCC(N)CSP(=O)(O)O Amb27843292 [0,1,0,0,0,1|1,1,0]=4 422 B9R0.21 NC[C@@H](O)CSP(=O)(O)O Amb28064125 [0,1,0,0,0,1|1,1,0]=4 423 B9R0.21 O=CC(Cl)COP(=O)(O)O Amb27246357 [0,1,0,0,0,1|1,0,1]=4 424 B9R0.21 O=CC(O)COP(=O)(O)O Amb17940795 [0,1,0,0,0,1|1,0,1]=4 425 B9R0.21 O=C[C@@H](O)COP(=O)(O)O Amb28049942 [0,1,0,0,0,1|1,0,1]=4 426 B9R0.21 O=C[C@H](O)COP(=O)(O)O Amb26420801 [0,1,0,0,0,1|1,0,1]=4 427 B9R0.21 O=P(O)(O)CCC(O)CO Amb27775417 [0,1,0,0,0,1|2,0,0]=4 428 B9R0.21 O=P(O)(O)NCC(O)CO Amb28318788 [0,1,0,0,0,1|2,0,0]=4 429 B9R0.21 O=P(O)(O)NC[C@@H](O)CO Amb28281932 [0,1,0,0,0,1|2,0,0]=4 430 B9R0.21 O=P(O)(O)OCC(Br)CBr Amb28323206 [0,1,0,0,0,1|1,0,0]=3 431 B9R0.21 O=P(O)(O)OCC(O)CCl Amb27984729 [0,1,0,0,0,1|1,0,0]=3 432 B9R0.21 O=P(O)(O)OCC([O-])CO Amb22235650 [0,1,0,0,0,1|1,0,0]=3 433 B9R0.21 O=P(O)(O)OC[C@@H](O)CO Amb28401034 [0,1,0,0,0,1|1,0,0]=3 434 B9R0.21 O=P(O)(O)OC[C@H](O)CO Amb6600023 [0,1,0,0,0,1|1,0,0]=3 435 B9R0.21 O=P(O)(O)OC[C@H](O)CS Amb27594764 [0,1,0,0,0,1|1,0,0]=3 436 B9R0.21 O=P(O)(O)\C=C\C(O)CO Amb28126858 [0,1,0,0,0,1|2,0,0]=4 437 B9R0.57 CC(C)C(C)OP(C)(=O)O Amb25104688 [0,1,0,0,0,1|1,0,0]=3 438 B9R0.57 CC(C)[C@@H](N)CP(C)(=O)O Amb27476831 [0,1,0,0,0,1|2,0,0]=4 439 B9R0.57 CC(N)C(=O)OP(=O)(O)O Amb27843307 [0,1,0,0,0,1|1,0,0]=3 440 B9R0.57 C[C@@H](N)C(=O)CP(=O)(O)O Amb25689821 [0,1,0,0,0,1|2,0,0]=4 441 B9R0.57 C[C@@H](N)[C@@H](C)OP(=O)(O)O Amb27593196 [0,1,0,0,0,1|1,0,0]=3 442 B9R0.57 C[C@H](N)C(=O)CP(=O)(O)O Amb27862501 [0,1,0,0,0,1|2,0,0]=4 443 B9R0.57 C[C@H](O)[C@@H](O)CP(=O)(O)O Amb28079090 [0,1,0,0,0,1|2,0,0]=4 444 B9R0.64 CCP(C)(=O)OCC(C)C Amb25322695 [0,1,0,0,0,1|2,0,0]=4 445 B9R0.64 COP(=O)(O)COC(C)=O Amb27493526 [0,1,0,0,0,1|1,0,1]=4 446 B9R0.64 COP(C)(=O)OCC(C)O Amb27982260 [0,1,0,0,0,1|2,0,0]=4 447 B9R0.77 CC(C)(C)COP(=O)(O)O Amb27489865 [0,1,0,0,0,1|0,0,0]=2 448 B9R0.77 CC(C)(C)NCP(=O)(O)O Amb27778513 [0,1,0,0,0,1|1,0,0]=3 449 B9R0.77 O=P(O)(O)OCC(Cl)(Cl)Cl Amb22733929 [0,1,0,0,0,1|2,0,0]=4 450 B9R0.22 CCC(C)OP(=O)(O)CCl Amb27955194 [0,2,0,0,0,0|1,0,0]=3 451 B9R0.22 COP(=O)(O)OC(=O)CN Amb27617112 [0,2,0,0,0,0|1,0,1]=4 452 B9R0.25 CCC(C)C(N)P(=O)(O)O Amb8516014 [0,2,0,0,0,0|1,0,0]=3 453 B9R0.25 CCC(O)C(S)P(=O)(O)O Amb28050574 [0,2,0,0,0,0|2,0,0]=4 454 B9R0.25 CC[C@H](C)[C@@H](N)P(=O)(O)O Amb27615025 [0,2,0,0,0,0|1,0,0]=3 455 B9R0.30 COP(=O)(O)NC(C)(C)C Amb28248132 [0,2,0,0,0,0|1,0,0]=3 456 B9R0.44 CCCC(C)OP(=O)(O)O Amb25366416 [0,2,0,0,0,0|0,0,0]=2 457 B9R0.44 CCNC(C)CP(=O)(O)O Amb27402609 [0,2,0,0,0,0|1,0,0]=3 458 B9R0.44 CN(CCO)CP(=O)(O)O Amb24557213 [0,2,0,0,0,0|2,0,0]=4 459 B9R0.52 CCC(CO)NP(C)(=O)O Amb28207154 [0,2,0,0,0,0|2,0,0]=4 460 B9R0.52 NCC(CF)OP(=O)(O)O Amb27878525 [0,2,0,0,0,0|0,0,0]=2 461 B9R0.52 O=P(O)(O)OC(CCl)CCl Amb28250758 [0,2,0,0,0,0|0,0,0]=2 462 B9R0.52 O=P(O)(O)OC(CF)CCl Amb28128390 [0,2,0,0,0,0|0,0,0]=2 463 B9R0.52 O=P(O)(O)OC(C[O-])C[O-] Amb22728939 [0,2,0,0,0,0|0,0,0]=2 464 B9R0.52 O=P([O-])(O)OC(CO)CO Amb22051651 [0,2,0,0,0,0|0,0,1]=3 465 B9R0.52 O=P([O-])([O-])OC(CO)CO Amb9825420 [0,2,0,0,0,0|0,0,2]=4 466 B9R0.52 O=S(=O)(O)OC(CCl)CCl Amb27646431 [0,2,0,0,0,0|1,0,1]=4 467 B9R0.32 CC(C)C(N)P(=O)(O)CCl Amb28385579 [0,2,0,0,0,0|2,0,0]=4 468 B9R0.32 CCP(=O)(O)C(N)C(C)C Amb27265835 [0,2,0,0,0,0|2,0,0]=4 469 B9R0.32 COP(=O)(O)C(N)C(C)C Amb27596865 [0,2,0,0,0,0|1,0,0]=3 470 B9R0.49 CC(C)(C)C(N)P(=O)(O)O Amb1150406 [0,2,0,0,0,0|1,0,0]=3 471 B9R0.49 CC(C)(C)C(O)P(=O)(O)O Amb28453473 [0,2,0,0,0,0|1,0,0]=3 472 B9R0.49 CC(C)(S)[C@@H](N)P(=O)(O)O Amb27476157 [0,2,0,0,0,0|1,0,0]=3 473 B9R0.49 CC(C)(S)[C@H](N)P(=O)(O)O Amb27598044 [0,2,0,0,0,0|1,0,0]=3 474 B9R0.72 CC(C)C(CO)P(=O)(O)O Amb27256538 [0,2,0,0,0,0|1,0,0]=3 475 B9R0.80 CC(C)C(C)(N)P(=O)(O)O Amb8516018 [0,2,0,0,0,0|1,0,0]=3 476 B9R0.80 CC(N)C(C)(O)P(=O)(O)O Amb27409912 [0,2,0,0,0,0|2,0,0]=4 477 B9R0.80 CC(O)C(C)(N)P(=O)(O)O Amb27667950 [0,2,0,0,0,0|2,0,0]=4 478 B9R0.11 CC(C)OP(=O)(O)C(N)=O Amb28325677 [0,2,0,0,0,0|0,0,1]=3 479 B9R0.58 CC(C)OP(=O)(O)CCN Amb27229942 [0,2,0,0,0,0|1,0,0]=3 480 B9R0.58 CC(C)OP(C)(=O)CC=O Amb28076982 [0,2,0,0,0,0|1,0,1]=4 481 B9R0.58 CC(C)OP(C)(=O)\C=C\O Amb28069714 [0,2,0,0,0,0|1,0,0]=3 482 B9R0.63 C=C(C)OP(=O)(OC)OC Amb22047339 [0,2,0,0,0,0|0,0,2]=4 483 B9R0.63 CC(C)OC(C)(CO)CO Amb27472539 [0,2,0,0,0,0|2,0,0]=4 484 B9R0.63 CCP(=O)(CO)OC(C)C Amb27755502 [0,2,0,0,0,0|1,0,0]=3 485 B9R0.63 COP(=O)(C[C@@H](C)O)OC Amb27400046 [0,2,0,0,0,0|2,0,0]=4 486 B9R0.63 COP(=O)(C[C@H](C)O)OC Amb27436809 [0,2,0,0,0,0|2,0,0]=4 487 B9R0.63 COP(=O)(OC)OC(C)C Amb28292919 [0,2,0,0,0,0|0,0,0]=2 488 B9R0.63 CO[P@](=O)(CO)OC(C)C Amb27835856 [0,2,0,0,0,0|0,0,0]=2 489 B7R1.2 CC1CCC(=O)O1 Amb6298321 [1,0,0,1,0,0|2,0,0]=4 490 B7R1.2 CC1CNC(=O)O1 Amb19651732 [1,0,0,1,0,0|2,0,0]=4 491 B7R1.2 CC1COC(=O)C1 Amb22231914 [1,0,0,1,0,0|2,0,0]=4 492 B7R1.2 CC1COC(=O)N1 Amb19517037 [1,0,0,1,0,0|2,0,0]=4 493 B7R1.2 CC1COC(=O)O1 Amb8513300 [1,0,0,1,0,0|1,0,0]=3 494 B7R1.2 CC1COC(C)O1 Amb24074042 [1,0,0,1,0,0|2,0,0]=4 495 B7R1.2 CC1COC(O)C1 Amb28050442 [1,0,0,1,0,0|2,0,0]=4 496 B7R1.2 CC1COS(=O)O1 Amb22346070 [1,0,0,1,0,0|1,0,0]=3 497 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [1,0,0,1,0,0|2,0,0]=4 498 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [1,0,0,1,0,0|2,0,0]=4 499 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [1,0,0,1,0,0|2,0,0]=4 500 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [1,0,0,1,0,0|2,0,0]=4 501 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [1,0,0,1,0,0|1,0,0]=3 502 B7R1.2 C[C@@H]1COC(O)C1 Amb27399504 [1,0,0,1,0,0|2,0,0]=4 503 B7R1.2 C[C@@H]1COS(=O)O1 Amb27979548 [1,0,0,1,0,0|1,0,0]=3 504 B7R1.2 C[C@@H]1CO[C@@H](O)C1 Amb27422487 [1,0,0,1,0,0|2,0,0]=4 505 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [1,0,0,1,0,0|2,0,0]=4 506 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [1,0,0,1,0,0|2,0,0]=4 507 B7R1.2 C[C@H]1COC(=O)N1 Amb8391158 [1,0,0,1,0,0|2,0,0]=4 508 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [1,0,0,1,0,0|1,0,0]=3 509 B7R1.2 O=C1OCC(Cl)O1 Amb10842117 [1,0,0,1,0,0|2,0,0]=4 510 B7R1.2 O=C1OCC(F)O1 Amb10841016 [1,0,0,1,0,0|2,0,0]=4 511 B7R1.12 CC1CC1C(=O)O Amb9703126 [1,0,0,1,0,0|2,0,0]=4 512 B7R1.12 C[C@@H]1C[C@@H]1B(O)O Amb24329037 [1,0,0,1,0,0|2,0,0]=4 513 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [1,0,0,1,0,0|2,0,0]=4 514 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [1,0,0,1,0,0|2,0,0]=4 515 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [1,0,0,1,0,0|2,0,0]=4 516 B7R1.12 C[C@H]1C[C@H]1B(O)O Amb24515113 [1,0,0,1,0,0|2,0,0]=4 517 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|2,0,0]=4 518 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [1,0,0,1,0,0|2,0,0]=4 519 B7R1.20 NC(=O)OC1CC1 Amb27265645 [1,0,0,1,0,0|2,0,0]=4 520 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [1,0,0,1,0,0|2,0,0]=4 521 B7R1.20 O=C(O)CC1CC1 Amb2686657 [1,0,0,1,0,0|2,0,0]=4 522 B7R1.14 CP1(=O)OCCO1 Amb27781737 [1,0,0,1,0,0|1,0,0]=3 523 B7R1.14 O=P1(Cl)OCCO1 Amb8515778 [1,0,0,1,0,0|1,0,0]=3 524 B7R1.14 O=P1([O-])OCCO1 Amb32653504 [1,0,0,1,0,0|0,0,1]=3 525 B7R1.14 O=S1(=O)OCCO1 Amb15691656 [1,0,0,1,0,0|1,0,1]=4 526 B9R1.10 CC1COS(=O)(=O)OC1 Amb33456745 [0,0,0,1,0,1|1,0,1]=4 527 B9R1.10 O=P1(O)OCC(O)CO1 Amb27852722 [0,0,0,1,0,1|1,0,0]=3 528 B9R1.146 CC1(C)C=CP(=O)(O)O1 Amb2780620 [0,0,0,1,0,1|1,0,0]=3 529 B9R1.36 CC1OP(=O)(Cl)OC1C Amb26885575 [0,1,0,1,0,0|1,0,0]=3 530 B9R1.36 CC1OS(=O)(=O)OC1C Amb27956510 [0,1,0,1,0,0|1,0,1]=4 531 B9R1.36 C[C@H]1OP(=O)(Cl)O[C@@H]1C Amb22350643 [0,1,0,1,0,0|1,0,0]=3 532 B9R1.66 CC1CCOP(=O)(O)O1 Amb27493323 [0,1,0,1,0,0|0,0,0]=2 533 B9R1.66 CC1CCOS(=O)(=O)O1 Amb25111500 [0,1,0,1,0,0|1,0,1]=4 534 B9R1.133 CCC1COS(=O)(=O)O1 Amb28280910 [0,1,0,1,0,0|1,0,1]=4 535 B9R1.133 O=P1(O)CC(CO)CO1 Amb27588943 [0,1,0,1,0,0|1,0,0]=3 536 B9R1.133 O=P1(O)CCC(CO)C1 Amb27853831 [0,1,0,1,0,0|2,0,0]=4 537 B9R1.133 O=P1(O)OCC(CO)O1 Amb28315433 [0,1,0,1,0,0|0,0,0]=2 538 B9R1.133 OC[C@@H]1C[OH+][B-](O)(O)O1 Amb27768698 [0,1,0,1,0,0|1,0,1]=4 539 B9R1.65 CC1CC1(N)P(=O)(O)O Amb27185735 [0,1,0,1,0,0|1,0,0]=3 540 B9R1.38 CC1C[C@@H](N)P(=O)(O)O1 Amb27230015 [0,1,0,1,0,0|1,0,0]=3 541 B9R1.125 CC1COP(=O)(CCl)O1 Amb27407522 [0,1,0,1,0,0|1,0,0]=3 542 B9R1.156 COP(=O)(O)C1OC1C Amb28070968 [0,1,0,1,0,0|2,0,0]=4 543 B9R1.156 COP(=O)(O)[C@H]1O[C@@H]1C Amb27421989 [0,1,0,1,0,0|2,0,0]=4 544 B5R0.5 CC(=O)C(C)C Amb4605987 [1,0,0,0,1,0|2,0,0]=4 545 B5R0.5 CC(Br)C(=O)O Amb2795764 [1,0,0,0,1,0|2,0,0]=4 546 B5R0.5 CC(C)B(O)O Amb2447044 [1,0,0,0,1,0|1,0,0]=3 547 B5R0.5 CC(C)C(=O)Br Amb22731066 [1,0,0,0,1,0|2,0,0]=4 548 B5R0.5 CC(C)C(=O)Cl Amb3939052 [1,0,0,0,1,0|2,0,0]=4 549 B5R0.5 CC(C)C(=O)F Amb25848493 [1,0,0,0,1,0|2,0,0]=4 550 B5R0.5 CC(C)C(=O)I Amb26992316 [1,0,0,0,1,0|2,0,0]=4 551 B5R0.5 CC(C)C(=O)O Amb3939822 [1,0,0,0,1,0|1,0,0]=3 552 B5R0.5 CC(C)C(=O)S Amb33482574 [1,0,0,0,1,0|1,1,0]=4 553 B5R0.5 CC(C)C(C)O Amb9748261 [1,0,0,0,1,0|2,0,0]=4 554 B5R0.5 CC(C)C(N)=O Amb1153145 [1,0,0,0,1,0|2,0,0]=4 555 B5R0.5 CC(C)N(=O)=O Amb8395293 [1,0,0,0,1,0|0,1,1]=4 556 B5R0.5 CC(C)N(=O)O Amb33789630 [1,0,0,0,1,0|0,1,0]=3 557 B5R0.5 CC(C)S(=O)Cl Amb27859539 [1,0,0,0,1,0|2,0,0]=4 558 B5R0.5 CC(C)S(=O)O Amb27245066 [1,0,0,0,1,0|1,0,0]=3 559 B5R0.5 CC(C)S(=O)[O-] Amb19929129 [1,0,0,0,1,0|1,0,1]=4 560 B5R0.5 CC(C)S(N)=O Amb25675545 [1,0,0,0,1,0|2,0,0]=4 561 B5R0.5 CC(C)[C@@H](C)O Amb13952942 [1,0,0,0,1,0|2,0,0]=4 562 B5R0.5 CC(C)[C@H](C)O Amb6366846 [1,0,0,0,1,0|2,0,0]=4 563 B5R0.5 CC(C)[N+](=O)[O-] Amb6608812 [1,0,0,0,1,0|0,1,1]=4 564 B5R0.5 CC(Cl)B(O)O Amb28076848 [1,0,0,0,1,0|2,0,0]=4 565 B5R0.5 CC(Cl)C(=O)O Amb3940363 [1,0,0,0,1,0|2,0,0]=4 566 B5R0.5 CC(Cl)S(=O)O Amb27983761 [1,0,0,0,1,0|2,0,0]=4 567 B5R0.5 CC(F)C(=O)O Amb10605770 [1,0,0,0,1,0|2,0,0]=4 568 B5R0.5 CC(I)C(=O)O Amb26450528 [1,0,0,0,1,0|2,0,0]=4 569 B5R0.5 CC(N)B(O)O Amb25844423 [1,0,0,0,1,0|2,0,0]=4 570 B5R0.5 CC(N)C(=O)O Amb32724352 [1,0,0,0,1,0|2,0,0]=4 571 B5R0.5 CC(N)C(=O)O Amb5716847 [1,0,0,0,1,0|2,0,0]=4 572 B5R0.5 CC(O)C(=O)O Amb9703100 [1,0,0,0,1,0|2,0,0]=4 573 B5R0.5 CC(S)C(=O)O Amb6608753 [1,0,0,0,1,0|2,0,0]=4 574 B5R0.5 CN(C)C(=O)O Amb22348477 [1,0,0,0,1,0|2,0,0]=4 575 B5R0.5 C[C@@H](Br)C(=O)O Amb8515030 [1,0,0,0,1,0|2,0,0]=4 576 B5R0.5 C[C@@H](Cl)C(=O)O Amb2725594 [1,0,0,0,1,0|2,0,0]=4 577 B5R0.5 C[C@@H](I)C(=O)O Amb27878762 [1,0,0,0,1,0|2,0,0]=4 578 B5R0.5 C[C@@H](N)B(O)O Amb27662188 [1,0,0,0,1,0|2,0,0]=4 579 B5R0.5 C[C@@H](N)C(=O)O Amb3940457 [1,0,0,0,1,0|2,0,0]=4 580 B5R0.5 C[C@@H](O)C(=O)O Amb6600026 [1,0,0,0,1,0|2,0,0]=4 581 B5R0.5 C[C@H](Br)C(=O)O Amb8515029 [1,0,0,0,1,0|2,0,0]=4 582 B5R0.5 C[C@H](Cl)C(=O)O Amb17776586 [1,0,0,0,1,0|2,0,0]=4 583 B5R0.5 C[C@H](F)C(=O)O Amb27216697 [1,0,0,0,1,0|2,0,0]=4 584 B5R0.5 C[C@H](N)C(=O)O Amb33780861 [1,0,0,0,1,0|2,0,0]=4 585 B5R0.5 C[C@H](N)C(=O)O Amb6298336 [1,0,0,0,1,0|2,0,0]=4 586 B5R0.5 C[C@H](O)C(=O)O Amb8386374 [1,0,0,0,1,0|2,0,0]=4 587 B5R0.5 C[C@H](O)C(O)O Amb27394850 [1,0,0,0,1,0|2,0,0]=4 588 B5R0.5 C[C@H](S)C(=O)O Amb25147510 [1,0,0,0,1,0|2,0,0]=4 589 B7R0.6 CC(=O)COC(C)C Amb9665256 [1,0,0,0,0,1|2,0,0]=4 590 B7R0.6 CC(C)C#CC(=O)O Amb33544341 [1,0,0,0,0,1|2,0,0]=4 591 B7R0.6 CC(C)CCB(O)O Amb13890540 [1,0,0,0,0,1|2,0,0]=4 592 B7R0.6 CC(C)CCC(=O)O Amb1153016 [1,0,0,0,0,1|2,0,0]=4 593 B7R0.6 CC(C)COC(=O)Cl Amb3940231 [1,0,0,0,0,1|2,0,0]=4 594 B7R0.6 CC(C)COC(N)=O Amb4020010 [1,0,0,0,0,1|2,0,0]=4 595 B7R0.6 CC(C)COC(O)O Amb28120630 [1,0,0,0,0,1|1,0,0]=3 596 B7R0.6 CC(C)CON(=O)O Amb33780821 [1,0,0,0,0,1|0,1,0]=3 597 B7R0.6 CC(C)CO[N+](=O)[O-] Amb22348027 [1,0,0,0,0,1|0,1,1]=4 598 B7R0.6 CC(C)CO[PH](=O)O Amb27252350 [1,0,0,0,0,1|0,0,0]=2 599 B7R0.6 CC(C)NCC(=O)O Amb2372347 [1,0,0,0,0,1|2,0,0]=4 600 B7R0.6 CC(C)NCC(=O)O Amb6892753 [1,0,0,0,0,1|2,0,0]=4 601 B7R0.6 CC(C)OCB(O)O Amb28058696 [1,0,0,0,0,1|1,0,0]=3 602 B7R0.6 CC(C)OCC(=O)Cl Amb28041673 [1,0,0,0,0,1|2,0,0]=4 603 B7R0.6 CC(C)OCC(=O)O Amb6275796 [1,0,0,0,0,1|1,0,0]=3 604 B7R0.6 CC(C)OCC(N)=O Amb26515707 [1,0,0,0,0,1|2,0,0]=4 605 B7R0.6 CC(C)OC[C@@H](C)O Amb24689920 [1,0,0,0,0,1|2,0,0]=4 606 B7R0.6 CC(C)OC[C@H](C)O Amb24449028 [1,0,0,0,0,1|2,0,0]=4 607 B7R0.6 CC(C)ONC(N)=O Amb2899784 [1,0,0,0,0,1|2,0,0]=4 608 B7R0.6 CC(C)SCC(=O)O Amb1128460 [1,0,0,0,0,1|1,1,0]=4 609 B7R0.6 CC(C)\C=C\B(O)O Amb27149192 [1,0,0,0,0,1|2,0,0]=4 610 B7R0.6 CC(C)\C=C\C(=O)O Amb8517064 [1,0,0,0,0,1|2,0,0]=4 611 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [1,0,0,0,0,1|2,0,0]=4 612 B7R0.6 CC(O)COB(O)O Amb28206200 [1,0,0,0,0,1|2,0,0]=4 613 B7R0.6 CN(C)OCC(=O)O Amb28120004 [1,0,0,0,0,1|2,0,0]=4 614 B9R0.56 CC(C)NCCP(=O)(O)O Amb27490847 [0,0,0,0,0,2|1,0,0]=3 615 B9R0.56 CC(N)CCCP(=O)(O)O Amb27232848 [0,0,0,0,0,2|2,0,0]=4 616 B9R0.56 CC(O)CCOP(=O)(O)O Amb27617038 [0,0,0,0,0,2|1,0,0]=3 617 B9R0.56 CN(C)CCOP(=O)(O)O Amb28341982 [0,0,0,0,0,2|1,0,0]=3