0 B9R1.34 CC1CC(Br)CC(C)C1 Amb25147183 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.34 CC1CC(Cl)CC(C)C1 Amb24370181 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.34 CC1CC(Cl)CC(C)O1 Amb24479940 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.34 CC1CC(I)CC(C)C1 Amb25147177 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.34 CC1CC(N)CC(C)C1 Amb19514974 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.34 CC1CC(N)CC(C)N1 Amb23535949 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.34 CC1CC(N)CC(C)O1 Amb22059487 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.34 CC1CC(O)CC(C)C1 Amb19514923 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.34 CC1CC(O)CC(C)N1 Amb22899513 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.34 CC1CC(O)CC(C)O1 Amb19892414 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.34 CC1CC(S)CC(C)C1 Amb24539821 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.34 CC1CC(S)CC(C)O1 Amb25276017 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.34 CC1CN(N)CC(C)O1 Amb18062022 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.34 CC1C[C@@H](O)CC(O)O1 Amb24474122 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.34 CC1NC(C)CC(C)=N1 Amb25131654 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.34 CC1NC(C)N=C(C)N1 Amb25145986 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.34 CC1NC(C)SC(C)N1 Amb24476947 [0,0,0,0,0,0|2,1,0]=3 17 B9R1.34 CC1N[C@H](C)C[C@@H](C)N1 Amb24517413 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.34 CC1OC(C)CC(=O)C1 Amb10072038 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.34 CC1SC(C)N=C(S1)C Amb15691678 [0,0,0,0,0,0|1,2,1]=4 20 B9R1.34 CN1CC(C)NC(C)C1 Amb18063106 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.34 CN1C[C@@H](C)NC(C)C1 Amb18832589 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.34 CN1C[C@H](C)NC(C)C1 Amb25737048 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.34 CN1C[C@H](C)N[C@H](C)C1 Amb24411460 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)O1 Amb24056554 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.34 C[C@@H]1CC(=O)C[C@H](C)O1 Amb24620055 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.34 C[C@@H]1CC(O)C[C@@H](C)N1 Amb24580385 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.34 C[C@@H]1CC(O)C[C@H](C)N1 Amb25147213 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.34 C[C@@H]1CN(N)C[C@@H](C)O1 Amb24101033 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.34 C[C@@H]1C[C@@H](C)C[C@H](C)C1 Amb22800007 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.34 C[C@@H]1C[C@H](C)C[C@H](C)C1 Amb24099375 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.34 C[C@@H]1C[C@H](C)NC(C)=N1 Amb25229063 [0,0,0,0,0,0|3,0,1]=4 32 B9R1.34 C[C@@H]1C[C@H](C)N[C@H](C)C1 Amb25145967 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.34 C[C@@H]1C[C@H](N)CC(O)O1 Amb25293804 [0,0,0,0,0,0|4,0,0]=4 34 B9R1.34 C[C@@H]1C[C@H](N)C[C@H](C)C1 Amb25230869 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.34 C[C@@H]1C[C@H](O)C[C@H](C)C1 Amb25791561 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.34 C[C@@H]1N[C@H](C)N[C@H](C)N1 Amb25146109 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.34 C[C@H]1CC(=O)C[C@H](C)O1 Amb22737479 [0,0,0,0,0,0|3,0,1]=4 38 B9R1.34 C[C@H]1CC(N)C[C@H](C)C1 Amb24649036 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.34 C[C@H]1CC(O)C[C@H](C)C1 Amb24099374 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.34 C[C@H]1CC(O)C[C@H](C)O1 Amb25317612 [0,0,0,0,0,0|3,0,0]=3 41 B9R1.34 C[C@H]1CC(O)O[C@@H](C)C1 Amb24675283 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.34 C[C@H]1C[C@@H](O)C[C@@H](O)O1 Amb25234831 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.34 C[C@H]1C[C@H](O)C[C@@H](C)C1 Amb24431909 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.34 C[C@H]1N[C@@H](C)C[C@@H](C)N1 Amb24452622 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.34 C[C@H]1O[C@@H](O)C[C@@H](C)O1 Amb24733316 [0,0,0,0,0,0|2,0,0]=2 46 B9R1.34 C[C@H]1S[C@@H](C)N[C@@H](C)S1 Amb24478700 [0,0,0,0,0,0|1,2,0]=3 47 B9R1.34 C[SiH]1O[SiH](C)O[SiH](C)O1 Amb22757052 [0,0,0,0,0,0|0,3,0]=3 48 B9R1.34 C[b]1o[b](C)o[b](C)o1 Amb22732918 [0,0,0,0,0,0|3,0,0]=3 49 B8R1.4 CC1CC(Br)CCO1 Amb25367234 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.4 CC1CC(Br)OCC1 Amb24433110 [1,0,0,0,0,0|3,0,0]=4 51 B8R1.4 CC1CC(C)CCC1 Amb22228339 [1,0,0,0,0,0|3,0,0]=4 52 B8R1.4 CC1CC(C)NCC1 Amb19957920 [1,0,0,0,0,0|3,0,0]=4 53 B8R1.4 CC1CC(Cl)OCC1 Amb24693934 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.4 CC1CC(N)CCO1 Amb22059408 [1,0,0,0,0,0|3,0,0]=4 55 B8R1.4 CC1CC(O)CCO1 Amb22757197 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.4 CC1CCCC(Cl)O1 Amb25258362 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.4 CC1CCNC(C)S1 Amb24452780 [1,0,0,0,0,0|2,1,0]=4 58 B8R1.4 CC1CCOB(O)O1 Amb24079673 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.4 CC1CN(C)CCO1 Amb22754927 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.4 CC1CNCC(C)O1 Amb22754920 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.4 CC1OCCC(C)=C1 Amb17689157 [1,0,0,0,0,0|2,0,1]=4 62 B8R1.4 C[C@@H]1CCCC(C)N1 Amb25779036 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.4 C[C@@H]1CCCC(O)O1 Amb25680618 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.4 C[C@@H]1CCC[C@@H](O)O1 Amb25345132 [1,0,0,0,0,0|3,0,0]=4 65 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22745550 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22748718 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.4 C[C@@H]1C[C@@H](Br)CCO1 Amb25281129 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.4 C[C@@H]1C[C@@H](C)CCC1 Amb22800215 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.4 C[C@@H]1C[C@@H](O)CCO1 Amb22753040 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.4 C[C@@H]1C[C@H](C)NCC1 Amb22748742 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.4 C[C@@H]1C[C@H](C)NCN1 Amb24550324 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.4 C[C@@H]1C[C@H](Cl)OCC1 Amb24513485 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.4 C[C@@H]1C[C@H](N)CCO1 Amb24575458 [1,0,0,0,0,0|3,0,0]=4 74 B8R1.4 C[C@@H]1C[C@H](O)CCO1 Amb22746391 [1,0,0,0,0,0|3,0,0]=4 75 B8R1.4 C[C@H]1CC(O)OCC1 Amb25810643 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.4 C[C@H]1CCC[C@@H](O)O1 Amb25175369 [1,0,0,0,0,0|3,0,0]=4 77 B8R1.4 C[C@H]1CN(C)CCO1 Amb25162545 [1,0,0,0,0,0|3,0,0]=4 78 B8R1.4 C[C@H]1CNC[C@H](C)O1 Amb22406103 [1,0,0,0,0,0|3,0,0]=4 79 B8R1.4 C[C@H]1C[C@@H](C)NCC1 Amb24603758 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.4 C[C@H]1C[C@@H](C)NCO1 Amb24515076 [1,0,0,0,0,0|2,0,0]=3 81 B8R1.4 C[C@H]1C[C@H](C)CCC1 Amb25101983 [1,0,0,0,0,0|3,0,0]=4 82 B8R1.4 C[C@H]1C[C@H](C)NCN1 Amb25324438 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.8 CC1C=C(C)CC(CO)O1 Amb24588412 [0,1,0,0,0,0|2,0,1]=4 84 B10R1.8 CC1CC(C)=CC(CO)O1 Amb25698639 [0,1,0,0,0,0|2,0,1]=4 85 B10R1.8 CC1CC(CBr)CC(C)C1 Amb24571977 [0,1,0,0,0,0|3,0,0]=4 86 B10R1.8 CC1CC(CBr)CC(C)O1 Amb25064954 [0,1,0,0,0,0|2,0,0]=3 87 B10R1.8 CC1CC(CC(C)O1)C=O Amb25128909 [0,1,0,0,0,0|2,0,1]=4 88 B10R1.8 CC1CC(CC(C)O1)NN Amb25774156 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.8 CC1CC(CC(O)O1)OC Amb24455382 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.8 CC1CC(CCl)CC(C)O1 Amb25145651 [0,1,0,0,0,0|2,0,0]=3 91 B10R1.8 CC1CC(CI)CC(C)O1 Amb25311535 [0,1,0,0,0,0|2,0,0]=3 92 B10R1.8 CC1CC(CN)CC(C)C1 Amb25274571 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.8 CC1CC(CN)NC(C)C1 Amb25204912 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.8 CC1CC(CO)CC(C)N1 Amb23535940 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.8 CC1CC(N)CC(O1)OC Amb25268181 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.8 CC1CC(O)OC(CC)O1 Amb25044661 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.8 CC1CN(C)CC(CBr)O1 Amb24454251 [0,1,0,0,0,0|3,0,0]=4 98 B10R1.8 CC1CN(C)CC(CCl)O1 Amb24480999 [0,1,0,0,0,0|3,0,0]=4 99 B10R1.8 CC1CN(C)CC(CN)O1 Amb18063827 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.8 CC1CN(C)CC(CO)O1 Amb25765682 [0,1,0,0,0,0|3,0,0]=4 101 B10R1.8 CCC1CC(C)NC(C)C1 Amb25839023 [0,1,0,0,0,0|3,0,0]=4 102 B10R1.8 CCC1OC(C)OC(C)O1 Amb22229595 [0,1,0,0,0,0|0,0,0]=1 103 B10R1.8 CNC1CC(C)OC(C)C1 Amb25853611 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.8 C[C@@H]1CC(C[C@H](C)O1)C#N Amb25289312 [0,1,0,0,0,0|2,0,1]=4 105 B10R1.8 C[C@@H]1C[C@H](O)C[C@H](CC)O1 Amb24569348 [0,1,0,0,0,0|3,0,0]=4 106 B10R1.8 C[C@@H]1C[C@H](O)C[C@H](CO)O1 Amb25271409 [0,1,0,0,0,0|3,0,0]=4 107 B10R1.8 C[C@@H]1C[C@H](O)C[C@H](O1)OC Amb24748314 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.8 C[C@H]1CC(C)=C[C@@H](CO)O1 Amb24520384 [0,1,0,0,0,0|2,0,1]=4 109 B10R1.8 C[C@H]1C[C@@H](CO)O[C@@H](C)C1 Amb25177055 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.8 C[C@H]1C[C@@H](N)C[C@@H](O1)OC Amb24547860 [0,1,0,0,0,0|3,0,0]=4 111 B10R1.8 C[C@H]1C[C@@H](O)C[C@@H](CC)O1 Amb25175552 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.8 C[C@H]1C[C@@H](O)C[C@@H](CO)O1 Amb25206365 [0,1,0,0,0,0|3,0,0]=4 113 B10R1.8 C[C@H]1C[C@H](C)OC(CCl)O1 Amb24515092 [0,1,0,0,0,0|1,0,0]=2 114 B10R1.8 C[C@H]1C[C@H](C)SC(CO)S1 Amb24515379 [0,1,0,0,0,0|1,2,0]=4 115 B10R1.22 CC1C(Br)CC(C)OC1C Amb24639031 [0,1,0,0,0,0|3,0,0]=4 116 B10R1.22 CC1C(C)NC(C)OC1C Amb25185309 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.22 CC1CC(C)C(=O)C(C)C1 Amb24478165 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.22 CC1CC(C)C(Cl)C(C)C1 Amb24382639 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.22 CC1CC(C)C(N)C(C)C1 Amb24447398 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.22 CC1C[C@H](C)C(O)[C@H](C)C1 Amb25829319 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.22 CC1OC(C)C(Cl)C(C)O1 Amb25803523 [0,1,0,0,0,0|1,0,0]=2 122 B10R1.22 CC1[C@H](Cl)C[C@H](C)O[C@H]1C Amb25232610 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.22 C[C@@H]1OS(=O)O[C@H](C)[C@@H]1Cl Amb24482272 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.22 C[C@@H]1O[C@@H](C)[C@H](Cl)[C@H](C)O1 Amb24595760 [0,1,0,0,0,0|1,0,0]=2 125 B10R1.22 C[C@@H]1O[C@H](C)C[C@@H](O)[C@H]1O Amb25205018 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.22 C[C@@H]1O[C@H](C)C[C@H](O)[C@H]1O Amb24733378 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.22 C[C@H]1C[C@@H](C)[C@H](O)[C@@H](C)C1 Amb25264300 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.22 C[C@H]1O[C@@H](C)[C@H](Cl)[C@@H](C)O1 Amb25241539 [0,1,0,0,0,0|1,0,0]=2 129 B10R1.329 CC1(C)CC(C)CC(C)C1 Amb22227676 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.329 CC1(C)C[C@@H](C)C[C@@H](C)C1 Amb22800757 [0,1,0,0,0,0|3,0,0]=4 131 B10R1.329 CC1(C)C[C@@H](C)C[C@H](C)C1 Amb22231648 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.329 CC1(C)C[C@H](C)C[C@@H](C)C1 Amb25163880 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.329 CC1(N)CC(C)CC(C)C1 Amb24633178 [0,1,0,0,0,0|3,0,0]=4 134 B10R1.329 CC1(N)C[C@H](C)C[C@@H](C)C1 Amb25381490 [0,1,0,0,0,0|3,0,0]=4 135 B10R1.329 CC1(N)C[C@H](C)C[C@H](C)C1 Amb24416628 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.329 CC1CC(C)(C)OB(O)O1 Amb24100825 [0,1,0,0,0,0|3,0,0]=4 137 B10R1.329 CC1CC(Cl)CC(C)(C)O1 Amb25061229 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.329 CC1CC(O)CC(C)(C)O1 Amb24431823 [0,1,0,0,0,0|3,0,0]=4 139 B10R1.329 CC1CC(O)OC(C)(C)O1 Amb24481248 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.329 CC1NC(C)(C)CC(C)O1 Amb25147259 [0,1,0,0,0,0|2,0,0]=3 141 B10R1.329 C[C@@H]1C[C@@H](O)CC(C)(O)O1 Amb25206728 [0,1,0,0,0,0|3,0,0]=4 142 B10R1.329 C[C@@H]1C[C@H](C)NC(C)(C)O1 Amb25338638 [0,1,0,0,0,0|2,0,0]=3 143 B10R1.329 C[C@@H]1N[C@H](C)CC(C)(C)O1 Amb24515005 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.329 C[C@]1(N)C[C@H](C)C[C@H](C)C1 Amb24745617 [0,1,0,0,0,0|3,0,0]=4 145 B8R0.5 CC(C)CC(C)CCC Amb22228271 [0,0,1,0,0,0|3,0,0]=4 146 B8R0.5 CC(C)OC(C)CNC Amb19024882 [0,0,1,0,0,0|3,0,0]=4 147 B8R0.5 CC(C)SC(C)CCC Amb24376116 [0,0,1,0,0,0|2,1,0]=4 148 B8R0.5 CC(CCN)CC(C)O Amb25064091 [0,0,1,0,0,0|3,0,0]=4 149 B8R0.5 CC(O)CC(N)CCC Amb24477692 [0,0,1,0,0,0|3,0,0]=4 150 B8R0.5 CC(O)CC(O)OCC Amb25734373 [0,0,1,0,0,0|2,0,0]=3 151 B8R0.5 CC(O)CC(S)CCC Amb24379900 [0,0,1,0,0,0|3,0,0]=4 152 B8R0.5 CC(OC=C)OC(C)O Amb24623774 [0,0,1,0,0,0|0,0,2]=3 153 B8R0.5 CC(OCC)OC(C)Cl Amb25774989 [0,0,1,0,0,0|1,0,0]=2 154 B8R0.5 CCCC(C)CC(C)Cl Amb25823700 [0,0,1,0,0,0|3,0,0]=4 155 B8R0.5 CCCC(C)CC(C)N Amb19026129 [0,0,1,0,0,0|3,0,0]=4 156 B8R0.5 CCCC(C)CC(C)O Amb22229840 [0,0,1,0,0,0|2,0,0]=3 157 B8R0.5 CCCC(C)OC(C)=O Amb22732559 [0,0,1,0,0,0|1,0,2]=4 158 B8R0.5 CCCN(C)C[C@@H](C)O Amb24394137 [0,0,1,0,0,0|3,0,0]=4 159 B8R0.5 CCCN(C)C[C@H](C)O Amb24502341 [0,0,1,0,0,0|3,0,0]=4 160 B8R0.5 CCCN(CC(O)C)C Amb17334132 [0,0,1,0,0,0|3,0,0]=4 161 B8R0.5 CCNC(C)CC(C)Br Amb24589023 [0,0,1,0,0,0|3,0,0]=4 162 B8R0.5 CCNC(C)CC(C)Cl Amb24481697 [0,0,1,0,0,0|3,0,0]=4 163 B8R0.5 CCNC(C)CC(C)O Amb25836121 [0,0,1,0,0,0|2,0,0]=3 164 B8R0.5 CCOC(=O)OC(C)C Amb24596469 [0,0,1,0,0,0|2,0,1]=4 165 B8R0.5 CCOC(=O)OC(C)F Amb25173938 [0,0,1,0,0,0|2,0,1]=4 166 B8R0.5 CCOC(Br)OC(C)=O Amb24425527 [0,0,1,0,0,0|1,0,2]=4 167 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [0,0,1,0,0,0|1,0,2]=4 168 B8R0.5 CCOC(C)CN(C)C Amb24620141 [0,0,1,0,0,0|3,0,0]=4 169 B8R0.5 CCOC(C)OC(C)=O Amb17689197 [0,0,1,0,0,0|0,0,2]=3 170 B8R0.5 CCO[C@H](C)CC(O)=O Amb24395833 [0,0,1,0,0,0|2,0,1]=4 171 B8R0.5 CCO[C@H](C)C[C@@H](C)O Amb24466310 [0,0,1,0,0,0|1,0,0]=2 172 B8R0.5 C[C@@H](O)C[C@@H](S)CCC Amb25107605 [0,0,1,0,0,0|3,0,0]=4 173 B8R0.5 C[C@H](O)C[C@H](O)CCC Amb25272245 [0,0,1,0,0,0|3,0,0]=4 174 B8R0.5 C\C=C\C(C)CC(C)O Amb25136258 [0,0,1,0,0,0|2,0,1]=4 175 B10R2.71 CC1CC2CC(CC2)N1 Amb25146114 [0,0,0,1,0,0|3,0,0]=4 176 B10R2.71 CC1CC2CCC(C1)N2 Amb23598232 [0,0,0,1,0,0|3,0,0]=4 177 B10R2.71 NC1CC2CCC(C1)O2 Amb23439385 [0,0,0,1,0,0|3,0,0]=4 178 B10R2.71 NC1CC2CCC(C1)O2 Amb24480354 [0,0,0,1,0,0|3,0,0]=4 179 B10R2.71 N[C@@H]1C[C@H]2CC[C@@H](C1)O2 Amb23439386 [0,0,0,1,0,0|3,0,0]=4 180 B10R2.71 OC1CC2CCC(C1)O2 Amb22365313 [0,0,0,1,0,0|3,0,0]=4 181 B10R2.71 O[C@@H]1C[C@@H]2CC[C@H](C1)O2 Amb24183499 [0,0,0,1,0,0|3,0,0]=4 182 B10R2.71 O[C@@H]1C[C@H]2CC[C@@H](C1)O2 Amb24183471 [0,0,0,1,0,0|3,0,0]=4 183 B10R2.294 CC1N2C(C)NC(C)N21 Amb25214663 [0,0,0,1,0,0|3,0,0]=4 184 B10R2.294 CC1N2[C@H](C)N[C@@H](C)N21 Amb24514910 [0,0,0,1,0,0|3,0,0]=4 185 B10R2.294 C[C@@H]1N2[C@@H](C)N[C@@H](C)N21 Amb24539952 [0,0,0,1,0,0|3,0,0]=4 186 B10R2.294 C[C@H]1N2[C@@H](C)N[C@@H](C)N21 Amb25768613 [0,0,0,1,0,0|3,0,0]=4 187 B10R2.343 CC1OC(C)CC2OC12 Amb24595726 [0,0,0,1,0,0|3,0,0]=4 188 B8R1.18 CC1CC(C)C(O)C1 Amb17674171 [0,0,0,0,1,0|3,0,0]=4 189 B8R1.18 CC1CC(C)OC1O Amb25226270 [0,0,0,0,1,0|2,0,0]=3 190 B8R1.18 CC1CC(Cl)C(O)O1 Amb25124830 [0,0,0,0,1,0|3,0,0]=4 191 B8R1.18 CC1CN(C)OC1O Amb25129773 [0,0,0,0,1,0|3,0,0]=4 192 B8R1.18 CC1C[C@@H](C)[C@H](C)C1 Amb24099376 [0,0,0,0,1,0|2,0,0]=3 193 B8R1.18 CC1NC(C)CC1C Amb25327752 [0,0,0,0,1,0|2,0,0]=3 194 B8R1.18 CC1NC(C)CC1O Amb23453938 [0,0,0,0,1,0|3,0,0]=4 195 B8R1.18 CC1OC(=O)NC1C Amb25747248 [0,0,0,0,1,0|2,0,1]=4 196 B8R1.18 CC1OC(C)CC1=C Amb24516040 [0,0,0,0,1,0|1,0,2]=4 197 B8R1.18 CC1OC(C)CC1Cl Amb24699077 [0,0,0,0,1,0|2,0,0]=3 198 B8R1.18 CC1OC(C)CC1N Amb24619349 [0,0,0,0,1,0|2,0,0]=3 199 B8R1.18 CC1OC(C)CC1O Amb25238640 [0,0,0,0,1,0|2,0,0]=3 200 B8R1.18 CC1OC(C)CC1S Amb22234723 [0,0,0,0,1,0|2,0,0]=3 201 B8R1.18 CC1OC(C)N=C1C Amb20242408 [0,0,0,0,1,0|1,0,1]=3 202 B8R1.18 CC1OC(N)=NC1C Amb24452888 [0,0,0,0,1,0|2,0,1]=4 203 B8R1.18 CC1OC(O)CC1O Amb25696669 [0,0,0,0,1,0|3,0,0]=4 204 B8R1.18 CC1SC(C)=NC1C Amb24395336 [0,0,0,0,1,0|1,1,1]=4 205 B8R1.18 C[C@@H]1C[C@H](Cl)[C@@H](O)O1 Amb24739817 [0,0,0,0,1,0|3,0,0]=4 206 B8R1.18 C[C@@H]1OC(=N)N[C@@H]1C Amb24523145 [0,0,0,0,1,0|2,0,1]=4 207 B8R1.18 C[C@@H]1OC(=O)C[C@H]1C Amb24583426 [0,0,0,0,1,0|2,0,1]=4 208 B8R1.18 C[C@@H]1OC(=O)N[C@@H]1C Amb24601098 [0,0,0,0,1,0|2,0,1]=4 209 B8R1.18 C[C@@H]1OC(=O)N[C@H]1C Amb24516825 [0,0,0,0,1,0|2,0,1]=4 210 B8R1.18 C[C@@H]1OC(=S)N[C@H]1C Amb24746694 [0,0,0,0,1,0|2,0,1]=4 211 B8R1.18 C[C@@H]1OC(C)C[C@H]1O Amb25176118 [0,0,0,0,1,0|2,0,0]=3 212 B8R1.18 C[C@@H]1OC(O)C[C@H]1O Amb25177050 [0,0,0,0,1,0|3,0,0]=4 213 B8R1.18 C[C@@H]1O[C@@H](O)C[C@H]1C Amb24597062 [0,0,0,0,1,0|2,0,0]=3 214 B8R1.18 C[C@H]1OC(=O)C[C@@H]1C Amb25245321 [0,0,0,0,1,0|2,0,1]=4 215 B8R1.18 C[C@H]1OC(C)C[C@H]1O Amb24588218 [0,0,0,0,1,0|2,0,0]=3 216 B8R1.18 C[C@H]1OC(O)C[C@@H]1C Amb24616560 [0,0,0,0,1,0|2,0,0]=3 217 B8R1.18 C[C@H]1O[C@H](C)CC1=O Amb25744762 [0,0,0,0,1,0|2,0,1]=4 218 B10R1.330 CC1CC(C)NC(C)CO1 Amb24649556 [0,0,0,0,0,1|2,0,0]=3 219 B10R1.330 CC1CNC(C)CC(C)O1 Amb24588000 [0,0,0,0,0,1|2,0,0]=3 220 B7R0.2 CC(C)CC(C)CC Amb22228298 [1,0,1,0,0,0|2,0,0]=4 221 B7R0.2 CC(C)N[C@@H](C)CC Amb24639587 [1,0,1,0,0,0|2,0,0]=4 222 B7R0.2 CC(C)OC(C)CCl Amb25073252 [1,0,1,0,0,0|2,0,0]=4 223 B7R0.2 CC(C)OC(C)CN Amb18992799 [1,0,1,0,0,0|2,0,0]=4 224 B7R0.2 CC(C)OC(C)CO Amb22733844 [1,0,1,0,0,0|2,0,0]=4 225 B7R0.2 CC(C)OC(O)CC Amb24457780 [1,0,1,0,0,0|2,0,0]=4 226 B7R0.2 CC(C)SC(C)CC Amb24673493 [1,0,1,0,0,0|1,1,0]=4 227 B7R0.2 CC(CC(C)O)OC Amb22757067 [1,0,1,0,0,0|1,0,0]=3 228 B7R0.2 CC(CC)OC(Cl)Cl Amb24483280 [1,0,1,0,0,0|2,0,0]=4 229 B7R0.2 CC(CN)CC(C)O Amb19337142 [1,0,1,0,0,0|2,0,0]=4 230 B7R0.2 CC(C[C@@H](C)N)OC Amb24690074 [1,0,1,0,0,0|2,0,0]=4 231 B7R0.2 CC(O)CC(C)CO Amb25262806 [1,0,1,0,0,0|2,0,0]=4 232 B7R0.2 CCC(=O)OC(C)O Amb25234635 [1,0,1,0,0,0|1,0,1]=4 233 B7R0.2 CCC(C)CC(C)Br Amb24757470 [1,0,1,0,0,0|2,0,0]=4 234 B7R0.2 CCC(CC(N)C)C Amb10069423 [1,0,1,0,0,0|2,0,0]=4 235 B7R0.2 CCN(CC(O)C)C Amb17334070 [1,0,1,0,0,0|2,0,0]=4 236 B7R0.2 CC[C@H](C)CC(C)N Amb25062813 [1,0,1,0,0,0|2,0,0]=4 237 B7R0.2 COC(C)=CC(C)O Amb25769416 [1,0,1,0,0,0|1,0,1]=4 238 B7R0.2 CON(C)CC(C)O Amb25285671 [1,0,1,0,0,0|2,0,0]=4 239 B7R0.2 C[C@@H](C[C@@H](C)Cl)OC Amb25690472 [1,0,1,0,0,0|2,0,0]=4 240 B7R0.2 C[C@@H](C[C@@H](C)O)NC Amb24505242 [1,0,1,0,0,0|2,0,0]=4 241 B7R0.2 C[C@@H](C[C@H](C)O)NC Amb25324434 [1,0,1,0,0,0|2,0,0]=4 242 B7R0.2 C[C@@H](O)C[C@H](C)CO Amb24642405 [1,0,1,0,0,0|2,0,0]=4 243 B7R0.2 C[C@H](C[C@H](C)Cl)OC Amb24634248 [1,0,1,0,0,0|2,0,0]=4 244 B7R0.2 C[C@H](C[C@H](C)O)OC Amb24733201 [1,0,1,0,0,0|1,0,0]=3 245 B7R0.2 C[C@H](O)C[C@@H](C)CO Amb25845280 [1,0,1,0,0,0|2,0,0]=4 246 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [1,0,1,0,0,0|2,0,0]=4 247 B7R0.4 CCCCNC(C)O Amb24715795 [1,0,1,0,0,0|2,0,0]=4 248 B7R0.4 CCCCOC(C)Br Amb17689407 [1,0,1,0,0,0|2,0,0]=4 249 B7R0.4 CCCCOC(C)Cl Amb17689402 [1,0,1,0,0,0|2,0,0]=4 250 B7R0.4 CCNCC[C@H](C)O Amb25757479 [1,0,1,0,0,0|2,0,0]=4 251 B7R0.4 CCOCC[C@@H](C)N Amb25744371 [1,0,1,0,0,0|2,0,0]=4 252 B7R0.4 CCOCC[C@@H](C)O Amb24524285 [1,0,1,0,0,0|1,0,0]=3 253 B7R0.4 CCOCC[C@H](C)N Amb24439507 [1,0,1,0,0,0|2,0,0]=4 254 B7R0.4 CCOCOC(C)=O Amb25191864 [1,0,1,0,0,0|0,0,2]=4 255 B7R0.4 CCON=CC(C)O Amb24694308 [1,0,1,0,0,0|2,0,0]=4 256 B7R0.4 CCONC[C@@H](C)O Amb24526714 [1,0,1,0,0,0|2,0,0]=4 257 B7R0.4 CCO\N=C/C(C)O Amb24738508 [1,0,1,0,0,0|2,0,0]=4 258 B7R0.7 CC(CCC)CCC Amb22229829 [1,0,1,0,0,0|2,0,0]=4 259 B7R0.7 CCCC(C)CCO Amb22733616 [1,0,1,0,0,0|2,0,0]=4 260 B7R0.7 CCCC(C)OCCl Amb24648760 [1,0,1,0,0,0|2,0,0]=4 261 B7R0.7 CCC[C@@H](C)CCO Amb24351627 [1,0,1,0,0,0|2,0,0]=4 262 B7R0.7 CCNC(C)CCC Amb22586730 [1,0,1,0,0,0|2,0,0]=4 263 B7R0.7 CCN[C@@H](C)CCO Amb24333122 [1,0,1,0,0,0|2,0,0]=4 264 B7R0.7 CCOC(=C)OCC Amb10604188 [1,0,1,0,0,0|0,0,2]=4 265 B7R0.7 CCOC(C)CCC Amb22733741 [1,0,1,0,0,0|1,0,0]=3 266 B7R0.7 CCOC(C)CCCl Amb24472887 [1,0,1,0,0,0|2,0,0]=4 267 B7R0.7 CCOC(Cl)CCC Amb24334118 [1,0,1,0,0,0|2,0,0]=4 268 B7R0.7 CCOP(O)OCC Amb17938598 [1,0,1,0,0,0|2,0,0]=4 269 B7R0.7 CCOP([O-])OCC Amb22230549 [1,0,1,0,0,0|2,0,0]=4 270 B7R0.7 CCO[C@@H](C)CCO Amb24619159 [1,0,1,0,0,0|1,0,0]=3 271 B7R0.7 CCO[C@H](C)CCO Amb25065482 [1,0,1,0,0,0|1,0,0]=3 272 B7R0.7 CNCC(OCC)C Amb10608191 [1,0,1,0,0,0|2,0,0]=4 273 B7R0.7 C[C+](OCC)OCC Amb25365007 [1,0,1,0,0,0|0,0,1]=3 274 B7R0.7 [13CH3][13CH2]O[13C](=O)O[13CH2][13CH3] Amb22354006 [1,0,1,0,0,0|1,0,1]=4 275 B7R1.3 CB1OCCCO1 Amb25273130 [2,0,0,0,0,0|2,0,0]=4 276 B7R1.3 CC1CCOCC1 Amb22043825 [2,0,0,0,0,0|2,0,0]=4 277 B7R1.3 CC1CCOCO1 Amb17776591 [2,0,0,0,0,0|1,0,0]=3 278 B7R1.3 CC1NCCCO1 Amb17506191 [2,0,0,0,0,0|2,0,0]=4 279 B7R1.3 OC1OCCCO1 Amb24736493 [2,0,0,0,0,0|2,0,0]=4 280 B9R0.4 CC(C)CC(C)OCCO Amb25060341 [0,1,1,0,0,0|2,0,0]=4 281 B9R0.4 CC(C)CC(C)OCCS Amb24523158 [0,1,1,0,0,0|2,0,0]=4 282 B9R0.4 CC(C)N[C@@H](C)COCC Amb24619454 [0,1,1,0,0,0|2,0,0]=4 283 B9R0.4 CC(C)OC(C)OCCCl Amb25808584 [0,1,1,0,0,0|1,0,0]=3 284 B9R0.4 CC(CC(C)O)NCCN Amb25361586 [0,1,1,0,0,0|2,0,0]=4 285 B9R0.4 CC(CC(C)O)OCC=C Amb25072425 [0,1,1,0,0,0|1,0,1]=4 286 B9R0.4 CC(CCSC)CC(C)O Amb25662534 [0,1,1,0,0,0|2,0,0]=4 287 B9R0.4 CC(OCCCl)OC(C)=O Amb24480651 [0,1,1,0,0,0|0,0,2]=4 288 B9R0.4 CCCNC(C)CC(C)O Amb24365066 [0,1,1,0,0,0|2,0,0]=4 289 B9R0.4 CCCOC(C)CC(C)N Amb25206456 [0,1,1,0,0,0|2,0,0]=4 290 B9R0.4 CCCOC(C)CC(C)O Amb24423186 [0,1,1,0,0,0|1,0,0]=3 291 B9R0.4 CCOCC(C)=CC(C)O Amb24570119 [0,1,1,0,0,0|1,0,1]=4 292 B9R0.4 CCOCC(C)OC(C)=O Amb22732225 [0,1,1,0,0,0|0,0,2]=4 293 B9R0.4 CCOC[C@@H](C)OC(C)=O Amb24369884 [0,1,1,0,0,0|0,0,2]=4 294 B9R0.4 COCOC(C)CC(C)O Amb25721585 [0,1,1,0,0,0|1,0,0]=3 295 B9R0.4 C[C@H](C[C@@H](C)O)OCC=C Amb24475147 [0,1,1,0,0,0|1,0,1]=4 296 B9R0.4 NCCOC(OC(C)C)C Amb17593675 [0,1,1,0,0,0|1,0,0]=3 297 B9R0.6 CC(C)C(=O)C(C)OCC Amb25115276 [0,1,1,0,0,0|2,0,0]=4 298 B9R0.6 CC(O)C(Cl)C(O)OCC Amb24482463 [0,1,1,0,0,0|2,0,0]=4 299 B9R0.6 CCCC(C)C(=O)C(C)O Amb24480566 [0,1,1,0,0,0|2,0,0]=4 300 B9R0.6 CCOC(C)C(C)C(C)O Amb25846233 [0,1,1,0,0,0|1,0,0]=3 301 B9R0.6 CCON(C)C(=O)[C@@H](C)O Amb25192559 [0,1,1,0,0,0|2,0,0]=4 302 B9R0.14 CC(C)CC(CBr)OCC Amb24558296 [0,1,1,0,0,0|2,0,0]=4 303 B9R0.14 CC(C)CC(CCl)OCC Amb25077193 [0,1,1,0,0,0|2,0,0]=4 304 B9R0.14 CC(C)CC(CN)OCC Amb24663898 [0,1,1,0,0,0|2,0,0]=4 305 B9R0.14 CC(C)OC(CBr)OCC Amb24424013 [0,1,1,0,0,0|1,0,0]=3 306 B9R0.14 CC(C)OC(CCl)OCC Amb25132119 [0,1,1,0,0,0|1,0,0]=3 307 B9R0.14 CC(O)CC(CCC)SC Amb25723606 [0,1,1,0,0,0|2,0,0]=4 308 B9R0.14 CC(O)CC(CO)CCC Amb25847449 [0,1,1,0,0,0|2,0,0]=4 309 B9R0.14 CCOC(CBr)OC(C)=O Amb25141497 [0,1,1,0,0,0|0,0,2]=4 310 B9R0.14 CCOC(CCl)OC(C)=O Amb25129465 [0,1,1,0,0,0|0,0,2]=4 311 B9R0.23 CC(C)OC(C)C(N)CC Amb25090614 [0,1,1,0,0,0|2,0,0]=4 312 B9R0.23 CCC(O)C(C)CC(C)O Amb24529317 [0,1,1,0,0,0|2,0,0]=4 313 B9R0.34 CC(CC(O)C=C)OCC Amb24466149 [0,1,1,0,0,0|1,0,1]=4 314 B9R0.34 CC(CC(O)CC)OCC Amb25284250 [0,1,1,0,0,0|1,0,0]=3 315 B9R0.34 CC(CCC)CC(O)CCl Amb24418324 [0,1,1,0,0,0|2,0,0]=4 316 B9R0.34 CC(CCC)CC(O)CN Amb24718688 [0,1,1,0,0,0|2,0,0]=4 317 B9R0.34 CCCC(C)C[C@@H](C)CO Amb24588411 [0,1,1,0,0,0|2,0,0]=4 318 B9R0.34 CCCC(C)OC(C)CN Amb24559051 [0,1,1,0,0,0|2,0,0]=4 319 B9R0.34 CCCC(C)SC(C)CO Amb25172867 [0,1,1,0,0,0|1,1,0]=4 320 B9R0.34 CCC[C@H](C)C[C@H](C)CO Amb25781733 [0,1,1,0,0,0|2,0,0]=4 321 B9R0.34 CCNC(C)CC(C)OC Amb24720976 [0,1,1,0,0,0|2,0,0]=4 322 B9R0.34 CCOC(=O)O[C@H](C)CO Amb24625151 [0,1,1,0,0,0|1,0,1]=4 323 B9R0.34 CCOC(C)CC(C)NC Amb24625119 [0,1,1,0,0,0|2,0,0]=4 324 B9R0.34 CCOC(C)OC(=C)CCl Amb24480385 [0,1,1,0,0,0|1,0,1]=4 325 B9R0.34 CCOC(C)OC(=O)CCl Amb24480498 [0,1,1,0,0,0|0,0,2]=4 326 B9R0.34 CCOC(C)O[C@@H](C)C=O Amb24441499 [0,1,1,0,0,0|0,0,1]=3 327 B9R0.34 CCOC(C)O[C@@H](C)CO Amb25084384 [0,1,1,0,0,0|0,0,0]=2 328 B9R0.34 CCOC(C)O[C@H](C)CO Amb22363059 [0,1,1,0,0,0|0,0,0]=2 329 B9R0.34 COC(C)OC(C)CCO Amb25692891 [0,1,1,0,0,0|2,0,0]=4 330 B9R0.34 CO[C@H](C)O[C@H](C)CCO Amb25345926 [0,1,1,0,0,0|2,0,0]=4 331 B9R0.44 CCNC(C)CC(C)(C)O Amb24724931 [0,1,1,0,0,0|2,0,0]=4 332 B9R0.53 CB(OC(C)C)OC(C)C Amb22338755 [0,1,1,0,0,0|2,0,0]=4 333 B9R0.53 CC(C)CC(C)CC(C)O Amb24271139 [0,1,1,0,0,0|2,0,0]=4 334 B9R0.53 CC(C)NC(C)CC(C)O Amb24587728 [0,1,1,0,0,0|2,0,0]=4 335 B9R0.53 CC(C)N[C@H](C)C[C@@H](C)O Amb24695074 [0,1,1,0,0,0|2,0,0]=4 336 B9R0.53 CC(C)N[C@H](C)C[C@H](C)O Amb24742191 [0,1,1,0,0,0|2,0,0]=4 337 B9R0.53 CC(C)OP(=O)OC(C)O Amb25296432 [0,1,1,0,0,0|2,0,0]=4 338 B9R0.53 CC(CC(C)O)OC(C)=C Amb24463537 [0,1,1,0,0,0|1,0,1]=4 339 B9R0.53 C[C@@H](C[C@@H](C)O)OC(C)=O Amb25722158 [0,1,1,0,0,0|1,0,1]=4 340 B9R0.53 C[C@H](C[C@@H](C)O)OC(C)=O Amb24386965 [0,1,1,0,0,0|1,0,1]=4 341 B9R0.53 C[C@H](C[C@H](C)O)OC(C)=O Amb24474272 [0,1,1,0,0,0|1,0,1]=4 342 B9R0.58 CCNC(C)(C)CC(C)O Amb25147347 [0,1,1,0,0,0|2,0,0]=4 343 B9R0.58 CCOC(C)(C)CC(C)O Amb24686645 [0,1,1,0,0,0|1,0,0]=3 344 B9R1.2 CC1CC(C=O)OCO1 Amb25362501 [1,1,0,0,0,0|1,0,1]=4 345 B9R1.2 CC1CC(CCO1)CN Amb22059410 [1,1,0,0,0,0|2,0,0]=4 346 B9R1.2 CC1CC(CCO1)CO Amb24679585 [1,1,0,0,0,0|2,0,0]=4 347 B9R1.2 CC1CC(CO)OCC1 Amb24412052 [1,1,0,0,0,0|2,0,0]=4 348 B9R1.2 CC1CC(CO)OCO1 Amb24520489 [1,1,0,0,0,0|1,0,0]=3 349 B9R1.2 CC1CCCC(CO)O1 Amb25085302 [1,1,0,0,0,0|2,0,0]=4 350 B9R1.2 CC1CCOC(C#C)O1 Amb24682901 [1,1,0,0,0,0|1,0,1]=4 351 B9R1.2 CC1CCOC(C1)NC Amb24666173 [1,1,0,0,0,0|2,0,0]=4 352 B9R1.2 CC1CCOC(CBr)O1 Amb25684844 [1,1,0,0,0,0|1,0,0]=3 353 B9R1.2 CC1OC(CCO1)C=O Amb25273118 [1,1,0,0,0,0|1,0,1]=4 354 B9R1.2 CC1OC(CO)CCO1 Amb24619171 [1,1,0,0,0,0|1,0,0]=3 355 B9R1.2 CC1O[C@H](CO)CCO1 Amb25052164 [1,1,0,0,0,0|1,0,0]=3 356 B9R1.2 C[C@@H]1CCO[C@H](C1)NC Amb25174867 [1,1,0,0,0,0|2,0,0]=4 357 B9R1.2 C[C@@H]1CCO[C@H](CCl)O1 Amb24616640 [1,1,0,0,0,0|1,0,0]=3 358 B9R1.2 C[C@@H]1C[C@H](CO)OCC1 Amb24630517 [1,1,0,0,0,0|2,0,0]=4 359 B9R1.2 C[C@H]1CCC[C@@H](CO)O1 Amb25259234 [1,1,0,0,0,0|2,0,0]=4 360 B9R1.2 C[C@H]1CCO[C@@H](C#C)O1 Amb25248581 [1,1,0,0,0,0|1,0,1]=4 361 B9R1.2 C[C@H]1CCO[C@H](C1)NC Amb25174873 [1,1,0,0,0,0|2,0,0]=4 362 B9R1.3 CC1CCOC(C)C1=O Amb25834282 [1,1,0,0,0,0|2,0,0]=4 363 B9R1.3 CC1CCOC(C)C1O Amb24428158 [1,1,0,0,0,0|2,0,0]=4 364 B9R1.3 C[C@@H]1OCO[C@@H](C)C1Cl Amb25233425 [1,1,0,0,0,0|1,0,0]=3 365 B9R1.3 C[C@H]1OCO[C@@H](C)[C@@H]1Cl Amb25138652 [1,1,0,0,0,0|1,0,0]=3 366 B9R1.66 CC1CC(C)(Cl)CCO1 Amb24552336 [1,1,0,0,0,0|2,0,0]=4 367 B9R1.66 CC1CCCC(C)(C)O1 Amb24477890 [1,1,0,0,0,0|2,0,0]=4 368 B9R1.66 CC1CCOC(C)(N)O1 Amb25222720 [1,1,0,0,0,0|1,0,0]=3 369 B9R1.66 CC1OCCC(C)(C)S1 Amb24664513 [1,1,0,0,0,0|1,1,0]=4 370 B9R1.69 CC1CCC(O)C(C)O1 Amb25842535 [1,1,0,0,0,0|2,0,0]=4 371 B9R1.69 C[C@@H]1CC[C@@H](N)[C@H](C)O1 Amb24514973 [1,1,0,0,0,0|2,0,0]=4 372 B9R1.22 CC1CC(C)NC1CO Amb24562309 [0,1,0,0,1,0|2,0,0]=4 373 B9R1.22 CC1CC(CC)C(O)O1 Amb25065208 [0,1,0,0,1,0|2,0,0]=4 374 B9R1.22 CC1CC(CO)C(C)C1 Amb25246590 [0,1,0,0,1,0|2,0,0]=4 375 B9R1.22 CC1CC(O)C(CO)O1 Amb24379808 [0,1,0,0,1,0|2,0,0]=4 376 B9R1.22 CC1NC(C)CC1CN Amb25321281 [0,1,0,0,1,0|2,0,0]=4 377 B9R1.22 CC1OC(C)CC1CO Amb25286847 [0,1,0,0,1,0|1,0,0]=3 378 B9R1.22 CC1OC(C)CC1NC Amb25204035 [0,1,0,0,1,0|1,0,0]=3 379 B9R1.22 CC1OC(C)CC1NN Amb25354071 [0,1,0,0,1,0|2,0,0]=4 380 B9R1.22 CC1OC(CBr)C(C)O1 Amb25123682 [0,1,0,0,1,0|0,0,0]=2 381 B9R1.22 C[C@@H]1CC(O)O[C@@H]1CC Amb25343890 [0,1,0,0,1,0|2,0,0]=4 382 B9R1.22 C[C@@H]1C[C@H](O)[C@H](CBr)O1 Amb24670452 [0,1,0,0,1,0|2,0,0]=4 383 B9R1.22 C[C@H]1C[C@@H](O)[C@H](CBr)O1 Amb24744758 [0,1,0,0,1,0|2,0,0]=4 384 B9R1.22 C[C@H]1O[C@@H](CCl)C(=O)O1 Amb24517406 [0,1,0,0,1,0|1,0,1]=4 385 B9R1.23 CC1CC(CC)OC1O Amb24685732 [0,1,0,0,1,0|2,0,0]=4 386 B9R1.23 CC1OC(C#C)OC1C Amb24670469 [0,1,0,0,1,0|0,0,1]=3 387 B9R1.23 CC1OC(CC1O)OC Amb25043763 [0,1,0,0,1,0|2,0,0]=4 388 B9R1.23 CC1OC(CN)CC1O Amb24443726 [0,1,0,0,1,0|2,0,0]=4 389 B9R1.23 CCB1OC(C)C(C)O1 Amb24441137 [0,1,0,0,1,0|1,0,0]=3 390 B9R1.23 CCC1OC(C)C(C)O1 Amb24753179 [0,1,0,0,1,0|0,0,0]=2 391 B9R1.23 CC[C@H]1OC([C@@H](C1)C)C Amb10604665 [0,1,0,0,1,0|1,0,0]=3 392 B9R1.23 C[C@@H]1OC(CBr)O[C@@H]1C Amb24607359 [0,1,0,0,1,0|0,0,0]=2 393 B9R1.23 C[C@@H]1OC(CCl)O[C@@H]1C Amb25236653 [0,1,0,0,1,0|0,0,0]=2 394 B9R1.23 C[C@@H]1OC(CCl)O[C@H]1C Amb24515090 [0,1,0,0,1,0|0,0,0]=2 395 B9R1.23 C[C@@H]1O[C@@H](CBr)C[C@@H]1O Amb25348225 [0,1,0,0,1,0|2,0,0]=4 396 B9R1.23 C[C@@H]1O[C@@H](C[C@H]1O)CO Amb25175404 [0,1,0,0,1,0|2,0,0]=4 397 B9R1.23 C[C@@H]1O[C@H](C[C@@H]1O)CO Amb25177058 [0,1,0,0,1,0|2,0,0]=4 398 B9R1.23 C[C@H]1OC(C#C)O[C@@H]1C Amb25213003 [0,1,0,0,1,0|0,0,1]=3 399 B9R1.23 C[C@H]1OC(C=O)O[C@@H]1C Amb25257842 [0,1,0,0,1,0|0,0,1]=3 400 B9R1.23 C[C@H]1OC(C[C@@H]1O)OC Amb24748393 [0,1,0,0,1,0|2,0,0]=4 401 B9R1.23 C[C@H]1O[C@@H](CBr)C[C@@H]1O Amb25173073 [0,1,0,0,1,0|2,0,0]=4 402 B9R1.23 C[C@H]1O[C@@H](C[C@H]1O)CO Amb24630775 [0,1,0,0,1,0|2,0,0]=4 403 B9R1.36 CC1(C)CC(C)C(C)C1 Amb22227642 [0,1,0,0,1,0|2,0,0]=4 404 B9R1.36 CC1(C)C[C@H](C)[C@H](C)C1 Amb22230277 [0,1,0,0,1,0|2,0,0]=4 405 B9R1.36 CC1(N)CC(C)C(C)C1 Amb25300378 [0,1,0,0,1,0|2,0,0]=4 406 B9R1.36 CC1(N)C[C@H](C)[C@H](C)C1 Amb24681209 [0,1,0,0,1,0|2,0,0]=4 407 B9R1.36 CC1(O)CC(C)C(C)C1 Amb24477851 [0,1,0,0,1,0|2,0,0]=4 408 B9R1.36 CC1CC(C)(C)OC1O Amb25214654 [0,1,0,0,1,0|2,0,0]=4 409 B9R1.36 CC1OP(O)(=O)OC1C Amb25195066 [0,1,0,0,1,0|2,0,0]=4 410 B9R1.36 C[C@@H]1OC(C)(C)C[C@H]1O Amb24515424 [0,1,0,0,1,0|2,0,0]=4 411 B9R1.36 C[C@@H]1OC(C)(C)OC1O Amb25832658 [0,1,0,0,1,0|1,0,0]=3 412 B9R1.36 C[C@@H]1OP(=O)(Cl)O[C@H]1C Amb22801716 [0,1,0,0,1,0|2,0,0]=4 413 B9R1.36 C[C@@H]1OS(=O)(=O)O[C@@H]1C Amb24733568 [0,1,0,0,1,0|2,0,0]=4 414 B9R1.36 C[C@H]1OC(C)(C)C[C@@H]1O Amb24734144 [0,1,0,0,1,0|2,0,0]=4 415 B9R1.36 C[C@H]1OP(=O)(Cl)O[C@@H]1C Amb22350643 [0,1,0,0,1,0|2,0,0]=4 416 B9R1.37 CC1C(C)CC(C)C1C Amb24584907 [0,1,0,0,1,0|2,0,0]=4 417 B9R1.37 CC1C(C)OC(Br)C1C Amb25091152 [0,1,0,0,1,0|2,0,0]=4 418 B9R1.37 CC1C(C)OC(C)C1C Amb25331035 [0,1,0,0,1,0|1,0,0]=3 419 B9R1.37 CC1C(C)[CH-]C(C)C1C Amb22336678 [0,1,0,0,1,0|2,0,0]=4 420 B9R1.37 CC1C(O)OC(C)C1Br Amb24443823 [0,1,0,0,1,0|2,0,0]=4 421 B9R1.37 CC1C(O)OC(C)C1O Amb25854123 [0,1,0,0,1,0|2,0,0]=4 422 B9R1.37 C[C@@H]1[C@@H](O)C(O)O[C@H]1C Amb25317570 [0,1,0,0,1,0|2,0,0]=4 423 B9R1.37 C[C@H]1O[C@@H](C)[C@H](O)[C@@H]1O Amb25296286 [0,1,0,0,1,0|2,0,0]=4 424 B9R1.37 C[C@H]1[C@@H](O)C(O)O[C@@H]1C Amb24576631 [0,1,0,0,1,0|2,0,0]=4 425 B9R1.38 CC1CC(C)(C)C(O)O1 Amb24532920 [0,1,0,0,1,0|2,0,0]=4 426 B9R1.38 CC1CC(O)OC1(C)C Amb25271492 [0,1,0,0,1,0|2,0,0]=4 427 B9R1.38 CC1OC(C)CC1(C)O Amb25251325 [0,1,0,0,1,0|1,0,0]=3 428 B11R1.678 CC1OC(C)CC(C)NC1C Amb25098759 [0,1,0,0,0,1|2,0,0]=4 429 B11R1.952 CC1CC(C)OCC(CO)O1 Amb25097793 [0,1,0,0,0,1|1,0,0]=3 430 B11R1.952 C[C@@H]1C[C@@H](C)OC[C@@H](CO)O1 Amb24515381 [0,1,0,0,0,1|1,0,0]=3 431 B11R1.983 CC1CCC(C)OC(CCl)O1 Amb24487911 [0,1,0,0,0,1|1,0,0]=3 432 B11R1.8 CC1OC(CC)C(C)C(O)O1 Amb25709570 [0,2,0,0,0,0|2,0,0]=4 433 B11R1.9 CC1CC(CN)CC(O1)OC Amb24484600 [0,2,0,0,0,0|2,0,0]=4 434 B11R1.9 CC1OC(CC)OC(CC)O1 Amb22228332 [0,2,0,0,0,0|0,0,0]=2 435 B11R1.9 C[C@H]1C[C@H](C[C@H](CO)O1)OC Amb24618703 [0,2,0,0,0,0|2,0,0]=4 436 B11R1.10 CC1CC(C)(C)NC(CO)O1 Amb25738574 [0,2,0,0,0,0|2,0,0]=4 437 B11R1.10 CC1CC(C=O)OC(C)(C)O1 Amb25046686 [0,2,0,0,0,0|1,0,1]=4 438 B11R1.10 COB1OC(C)CC(C)(C)O1 Amb25064759 [0,2,0,0,0,0|2,0,0]=4 439 B11R1.34 CC1CC(C)OC(CCCl)O1 Amb25233432 [0,2,0,0,0,0|1,0,0]=3 440 B11R1.34 CC1CC(CC=O)CC(C)O1 Amb24610152 [0,2,0,0,0,0|2,0,0]=4 441 B11R1.34 CC1CC(CCN)CC(C)O1 Amb25211220 [0,2,0,0,0,0|2,0,0]=4 442 B11R1.34 CONC1CC(C)OC(C)C1 Amb25268820 [0,2,0,0,0,0|2,0,0]=4 443 B11R1.34 C[C@@H]1CC(CC=O)C[C@H](C)O1 Amb24596798 [0,2,0,0,0,0|2,0,0]=4 444 B11R1.34 C[C@@H]1C[C@@H](C)OC(CC=O)O1 Amb24513236 [0,2,0,0,0,0|1,0,0]=3 445 B11R1.74 CC(=O)C1CC(C)OC(C)C1 Amb24737093 [0,2,0,0,0,0|2,0,0]=4 446 B11R1.74 CC(Br)C1CC(C)OC(C)C1 Amb24467470 [0,2,0,0,0,0|2,0,0]=4 447 B11R1.74 CC(C)C1OC(C)OC(C)O1 Amb25241730 [0,2,0,0,0,0|0,0,0]=2 448 B11R1.74 CC(Cl)C1CC(C)OC(C)C1 Amb24572413 [0,2,0,0,0,0|2,0,0]=4 449 B11R1.74 CC(N)C1CC(C)OC(C)C1 Amb24737090 [0,2,0,0,0,0|2,0,0]=4 450 B11R1.74 CC(O)C1CC(C)OC(C)C1 Amb25768370 [0,2,0,0,0,0|2,0,0]=4 451 B11R1.74 CC1CC(C)OC(O1)C(O)=O Amb24443567 [0,2,0,0,0,0|1,0,1]=4 452 B11R1.74 C[C@@H]1C[C@@H](C)OC(O1)C(O)=O Amb25232587 [0,2,0,0,0,0|1,0,1]=4 453 B11R1.74 C[C@@H]1C[C@H](C)O[C@H](O1)C(Cl)Cl Amb24595785 [0,2,0,0,0,0|1,0,0]=3 454 B11R1.74 C[C@H]1C[C@H](C)OC(O1)C(Cl)Cl Amb24595325 [0,2,0,0,0,0|1,0,0]=3 455 B11R1.1180 CC1(CCl)O[C@@H](C)C[C@@H](C)O1 Amb25765779 [0,2,0,0,0,0|1,0,0]=3 456 B11R1.1180 CC1CC(C)OP(=O)(CN)O1 Amb25688654 [0,2,0,0,0,0|2,0,0]=4 457 B11R1.1180 CC1CC(N)(CC(C)O1)CN Amb25298242 [0,2,0,0,0,0|2,0,0]=4 458 B11R1.325 CC1OC(C)C[C@@](C)(O)[C@H]1O Amb24515372 [0,2,0,0,0,0|2,0,0]=4 459 B11R1.553 CC1OC(C)OC(P1(=S)O)C Amb10571034 [0,2,0,0,0,0|1,0,0]=3 460 B11R1.1361 CC1(C)O[C@H](C)C(=O)[C@H](C)O1 Amb25151461 [0,2,0,0,0,0|1,0,0]=3 461 B11R1.1361 CC1C(C)NC(C)(C)OC1C Amb24677864 [0,2,0,0,0,0|2,0,0]=4 462 B11R1.1362 CC1(C)NC(C)(C)CC(C)O1 Amb25840424 [0,2,0,0,0,0|2,0,0]=4 463 B9R1.7 CC1CC(CN1)OCC Amb23453872 [0,0,1,1,0,0|2,0,0]=4 464 B9R1.7 CC1OC(CO1)CNC Amb24585045 [0,0,1,1,0,0|2,0,0]=4 465 B9R1.7 CCCC1CCC(O)C1 Amb24554977 [0,0,1,1,0,0|2,0,0]=4 466 B9R1.7 CCOC1C=CC(O)O1 Amb25317644 [0,0,1,1,0,0|0,0,2]=4 467 B9R1.7 CCOC1CC(O)CO1 Amb24481757 [0,0,1,1,0,0|2,0,0]=4 468 B9R1.7 CCOC1CCC(=O)O1 Amb24117269 [0,0,1,1,0,0|0,0,2]=4 469 B9R1.7 CCOC1CCC(O)C1 Amb24642566 [0,0,1,1,0,0|1,0,0]=3 470 B9R1.7 CCO[C@@H]1CC[C@H](O)C1 Amb25175111 [0,0,1,1,0,0|1,0,0]=3 471 B9R1.13 CC(=O)OC1CCCO1 Amb22270198 [0,0,1,1,0,0|0,0,2]=4 472 B9R1.13 CC(CC1CCCO1)N Amb13952622 [0,0,1,1,0,0|2,0,0]=4 473 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [0,0,1,1,0,0|2,0,0]=4 474 B9R1.13 CC(O)CC1CCCS1 Amb25206716 [0,0,1,1,0,0|1,1,0]=4 475 B9R1.13 CC(O)CC1OCCO1 Amb24543557 [0,0,1,1,0,0|2,0,0]=4 476 B9R1.13 CC(O)C[C@@H]1CCCN1 Amb25027963 [0,0,1,1,0,0|2,0,0]=4 477 B9R1.13 C[C@@H](N)CC1CCCO1 Amb25048917 [0,0,1,1,0,0|2,0,0]=4 478 B9R1.13 C[C@H](O)CC1CCCO1 Amb24735204 [0,0,1,1,0,0|1,0,0]=3 479 B9R1.13 C[C@H](O)C[C@@H]1CCCO1 Amb25176662 [0,0,1,1,0,0|1,0,0]=3 480 B9R1.41 CC1CCCC1[C@H](C)O Amb24738206 [0,0,1,1,0,0|2,0,0]=4 481 B9R1.48 CC1CCCCC(O)O1 Amb24752219 [0,0,1,1,0,0|1,0,0]=3 482 B9R1.48 C[C@@H]1C[C@@H](O)CCCC1 Amb24593171 [0,0,1,1,0,0|2,0,0]=4 483 B9R1.48 C[C@H]1C[C@@H](O)CCCC1 Amb25221381 [0,0,1,1,0,0|2,0,0]=4 484 B9R1.75 CC(CCC)CC1CO1 Amb25769573 [0,0,1,1,0,0|2,0,0]=4 485 B9R1.86 CC(O)CC1CC1CC Amb24356232 [0,0,1,1,0,0|2,0,0]=4 486 B9R1.86 C[C@@H](O)C[C@@H]1C[C@@H]1CC Amb25204804 [0,0,1,1,0,0|2,0,0]=4 487 B9R1.136 CCOC1CC(C)(O)C1 Amb24451317 [0,0,1,1,0,0|1,0,0]=3 488 B9R1.137 CC(CC(C)O)C1CC1 Amb25117501 [0,0,1,1,0,0|2,0,0]=4 489 B9R1.183 CCCC(C)C1OC1C Amb24596468 [0,0,1,1,0,0|2,0,0]=4 490 B9R2.13 CC12CCCC1(C)O2 Amb24602744 [1,0,0,1,0,0|2,0,0]=4 491 B9R2.68 C1CCC2CCC1O2 Amb22364980 [1,0,0,1,0,0|2,0,0]=4 492 B11R2.466 CC1CC2(CO2)CC(C)O1 Amb25211534 [0,1,0,1,0,0|2,0,0]=4 493 B11R2.1053 CC12OC1(C)CC(C)C2=O Amb25827329 [0,1,0,1,0,0|2,0,0]=4 494 B7R0.5 CC#CC(C)C(C)O Amb25145304 [0,0,1,0,1,0|1,0,1]=4 495 B7R0.5 CC(C)C(Cl)OCC Amb24633921 [0,0,1,0,1,0|2,0,0]=4 496 B7R0.5 CC(CCC)C(O)O Amb25380752 [0,0,1,0,1,0|2,0,0]=4 497 B7R0.5 CC(CNC)C(C)O Amb25809434 [0,0,1,0,1,0|2,0,0]=4 498 B7R0.5 CC(COC)C(C)O Amb24746662 [0,0,1,0,1,0|2,0,0]=4 499 B7R0.5 CC(NCC)C(C)S Amb18124385 [0,0,1,0,1,0|1,1,0]=4 500 B7R0.5 CC(NOC)C(C)O Amb25832401 [0,0,1,0,1,0|2,0,0]=4 501 B7R0.5 CC(O)C(C)CCN Amb18202662 [0,0,1,0,1,0|2,0,0]=4 502 B7R0.5 CC(O)C(Cl)CCC Amb25700952 [0,0,1,0,1,0|2,0,0]=4 503 B7R0.5 CC(O)C(N)CCC Amb24656798 [0,0,1,0,1,0|2,0,0]=4 504 B7R0.5 CC(O)C(O)OCC Amb25746147 [0,0,1,0,1,0|1,0,0]=3 505 B7R0.5 CC(O)[C@@H](C)CCO Amb24431016 [0,0,1,0,1,0|2,0,0]=4 506 B7R0.5 CC(OCC)C(C)Br Amb25189040 [0,0,1,0,1,0|1,0,0]=3 507 B7R0.5 CC(OCC)C(C)Cl Amb24652554 [0,0,1,0,1,0|1,0,0]=3 508 B7R0.5 CC(OCC)C(C)N Amb18291405 [0,0,1,0,1,0|1,0,0]=3 509 B7R0.5 CC(OCC)C(Cl)Cl Amb25232998 [0,0,1,0,1,0|2,0,0]=4 510 B7R0.5 CC(OCC)[C@H](C)N Amb25857133 [0,0,1,0,1,0|1,0,0]=3 511 B7R0.5 CC(SCC)C(C)Br Amb24481528 [0,0,1,0,1,0|1,1,0]=4 512 B7R0.5 CC(SCC)C(C)O Amb25741148 [0,0,1,0,1,0|0,1,0]=3 513 B7R0.5 CCC=C(C)C(C)O Amb22229370 [0,0,1,0,1,0|1,0,1]=4 514 B7R0.5 CCCC(C)C(C)Br Amb18184253 [0,0,1,0,1,0|2,0,0]=4 515 B7R0.5 CCCC(C)C(C)Cl Amb25074279 [0,0,1,0,1,0|2,0,0]=4 516 B7R0.5 CCCC(C)C(C)N Amb18289572 [0,0,1,0,1,0|2,0,0]=4 517 B7R0.5 CCC[C@@H](C)[C@@H](C)N Amb25843225 [0,0,1,0,1,0|2,0,0]=4 518 B7R0.5 CCC[C@@H](C)[C@H](C)N Amb24392737 [0,0,1,0,1,0|2,0,0]=4 519 B7R0.5 CCC[C@H](C)C(C)O Amb25662135 [0,0,1,0,1,0|1,0,0]=3 520 B7R0.5 CCC[C@H](C)[C@H](C)N Amb24460677 [0,0,1,0,1,0|2,0,0]=4 521 B7R0.5 CCNC(C(C)C)C Amb13951376 [0,0,1,0,1,0|2,0,0]=4 522 B7R0.5 CCOC(=C)C(C)O Amb25716098 [0,0,1,0,1,0|0,0,2]=4 523 B7R0.5 CCOC(=N)C(O)C Amb17593213 [0,0,1,0,1,0|1,0,1]=4 524 B7R0.5 CCOC(=O)[C@H](O)C Amb17614096 [0,0,1,0,1,0|1,0,1]=4 525 B7R0.5 CCOP(=O)C(C)O Amb24647262 [0,0,1,0,1,0|2,0,0]=4 526 B7R0.5 CCO[C@H](C)C(O)=O Amb24660035 [0,0,1,0,1,0|1,0,1]=4 527 B7R0.5 CC\C=C(\C)/C(C)O Amb25290807 [0,0,1,0,1,0|1,0,1]=4 528 B7R0.5 CSSC(C)C(C)O Amb25138491 [0,0,1,0,1,0|1,1,0]=4 529 B7R0.5 C[C@@H](O)[C@@H](C)CCO Amb24475865 [0,0,1,0,1,0|2,0,0]=4 530 B7R0.5 C[C@@H](O)[C@@H](O)CCC Amb25686304 [0,0,1,0,1,0|2,0,0]=4 531 B7R0.5 C[C@@H](O)[C@H](C)CCO Amb25206314 [0,0,1,0,1,0|2,0,0]=4 532 B7R0.5 C[C@@H](O)[C@H](N)CCC Amb25328641 [0,0,1,0,1,0|2,0,0]=4 533 B7R0.5 C[C@H](NCC)[C@@H](C)N Amb24469967 [0,0,1,0,1,0|2,0,0]=4 534 B7R0.5 C[C@H](NCC)[C@@H](C)O Amb25805873 [0,0,1,0,1,0|1,0,0]=3 535 B7R0.5 C[C@H](NCC)[C@H](C)O Amb24559757 [0,0,1,0,1,0|1,0,0]=3 536 B7R0.5 C[C@H](O)[C@@H](Cl)CCC Amb25111275 [0,0,1,0,1,0|2,0,0]=4 537 B7R0.5 C[C@H](O)[C@H](C)CCO Amb25143027 [0,0,1,0,1,0|2,0,0]=4 538 B7R0.5 C[C@H](O)[C@H](N)CCC Amb24604367 [0,0,1,0,1,0|2,0,0]=4 539 B7R0.5 C[C@H](O)[C@H](O)CCC Amb24671438 [0,0,1,0,1,0|2,0,0]=4 540 B7R0.5 C\C=C\[C@@H](C)[C@H](C)O Amb25056250 [0,0,1,0,1,0|1,0,1]=4 541 B7R1.2 CC1BC(C)CC1 Amb25760363 [1,0,0,0,1,0|2,0,0]=4 542 B7R1.2 CC1CC(Br)CO1 Amb25108601 [1,0,0,0,1,0|2,0,0]=4 543 B7R1.2 CC1CCC(C)N1 Amb20626165 [1,0,0,0,1,0|2,0,0]=4 544 B7R1.2 CC1CCC(O)O1 Amb22295909 [1,0,0,0,1,0|2,0,0]=4 545 B7R1.2 CC1CCC(O1)C Amb10602551 [1,0,0,0,1,0|1,0,0]=3 546 B7R1.2 CC1CN=C(C)O1 Amb25360042 [1,0,0,0,1,0|1,0,1]=4 547 B7R1.2 CC1CNC(C)C1 Amb19335336 [1,0,0,0,1,0|2,0,0]=4 548 B7R1.2 CC1COC(O)O1 Amb25204639 [1,0,0,0,1,0|1,0,0]=3 549 B7R1.2 CC1COS(=O)O1 Amb22346070 [1,0,0,0,1,0|2,0,0]=4 550 B7R1.2 CC1NCC(C)N1 Amb24562553 [1,0,0,0,1,0|2,0,0]=4 551 B7R1.2 CC1NCC(C)S1 Amb24480614 [1,0,0,0,1,0|1,1,0]=4 552 B7R1.2 CC1NCC(C1)C Amb17593077 [1,0,0,0,1,0|2,0,0]=4 553 B7R1.2 CC1NCC(O1)C Amb17506157 [1,0,0,0,1,0|1,0,0]=3 554 B7R1.2 CC1OCC(C)O1 Amb24074042 [1,0,0,0,1,0|0,0,0]=2 555 B7R1.2 CC1OCC(N1)C Amb17506156 [1,0,0,0,1,0|1,0,0]=3 556 B7R1.2 C[C@@H]1CC(O)OC1 Amb25795468 [1,0,0,0,1,0|2,0,0]=4 557 B7R1.2 C[C@@H]1CCC(O)O1 Amb25369337 [1,0,0,0,1,0|2,0,0]=4 558 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb22366804 [1,0,0,0,1,0|2,0,0]=4 559 B7R1.2 C[C@@H]1CC[C@@H](N1)C Amb10567751 [1,0,0,0,1,0|2,0,0]=4 560 B7R1.2 C[C@@H]1CC[C@@H](O)O1 Amb25176141 [1,0,0,0,1,0|2,0,0]=4 561 B7R1.2 C[C@@H]1CC[C@H](C)N1 Amb24681649 [1,0,0,0,1,0|2,0,0]=4 562 B7R1.2 C[C@@H]1CC[C@H](C)O1 Amb22799402 [1,0,0,0,1,0|1,0,0]=3 563 B7R1.2 C[C@@H]1CC[C@H](N1)C Amb17613372 [1,0,0,0,1,0|2,0,0]=4 564 B7R1.2 C[C@@H]1CC[C@H](O)O1 Amb25175220 [1,0,0,0,1,0|2,0,0]=4 565 B7R1.2 C[C@@H]1CN[C@@H](C)C1 Amb25026729 [1,0,0,0,1,0|2,0,0]=4 566 B7R1.2 C[C@@H]1CN[C@H](C)C1 Amb18195964 [1,0,0,0,1,0|2,0,0]=4 567 B7R1.2 C[C@@H]1COC(C)=N1 Amb24480955 [1,0,0,0,1,0|1,0,1]=4 568 B7R1.2 C[C@@H]1C[C@@H](C)CC1 Amb22747863 [1,0,0,0,1,0|2,0,0]=4 569 B7R1.2 C[C@@H]1C[C@H](C)CC1 Amb22230412 [1,0,0,0,1,0|2,0,0]=4 570 B7R1.2 C[C@@H]1N[C@@H](C)CO1 Amb25366562 [1,0,0,0,1,0|1,0,0]=3 571 B7R1.2 C[C@H]1CCC(C)N1 Amb25147635 [1,0,0,0,1,0|2,0,0]=4 572 B7R1.2 C[C@H]1CCC(O)O1 Amb25796315 [1,0,0,0,1,0|2,0,0]=4 573 B7R1.2 C[C@H]1CC[C@H](C)O1 Amb25810674 [1,0,0,0,1,0|1,0,0]=3 574 B7R1.2 C[C@H]1C[C@H](C)CC1 Amb25176920 [1,0,0,0,1,0|2,0,0]=4 575 B7R1.2 C[C@H]1C[C@H](O)CO1 Amb25212245 [1,0,0,0,1,0|2,0,0]=4 576 B7R1.4 CC1CCNC1C Amb18277375 [1,0,0,0,1,0|2,0,0]=4 577 B7R1.4 CC1CCNC1C Amb20623813 [1,0,0,0,1,0|2,0,0]=4 578 B7R1.4 CC1OCCC1Br Amb25073861 [1,0,0,0,1,0|2,0,0]=4 579 B7R1.4 CC1OCCC1Cl Amb24470094 [1,0,0,0,1,0|2,0,0]=4 580 B7R1.4 CC1OCCC1I Amb25840995 [1,0,0,0,1,0|2,0,0]=4 581 B7R1.4 CC1OCCC1N Amb22058722 [1,0,0,0,1,0|2,0,0]=4 582 B7R1.4 CC1SCNC1C Amb25833302 [1,0,0,0,1,0|1,1,0]=4 583 B7R1.4 C[C@@H]1CCC[C@@H]1C Amb22230410 [1,0,0,0,1,0|2,0,0]=4 584 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [1,0,0,0,1,0|2,0,0]=4 585 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [1,0,0,0,1,0|2,0,0]=4 586 B7R1.4 C[C@@H]1CCN[C@H]1C Amb24515067 [1,0,0,0,1,0|2,0,0]=4 587 B7R1.4 C[C@@H]1NCN[C@H]1C Amb25367908 [1,0,0,0,1,0|2,0,0]=4 588 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [1,0,0,0,1,0|2,0,0]=4 589 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [1,0,0,0,1,0|2,0,0]=4 590 B7R1.4 C[C@@H]1OCC[C@H]1O Amb24624737 [1,0,0,0,1,0|2,0,0]=4 591 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [1,0,0,0,1,0|2,0,0]=4 592 B7R1.4 C[C@H]1OCC[C@@H]1N Amb24515056 [1,0,0,0,1,0|2,0,0]=4 593 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [1,0,0,0,1,0|2,0,0]=4 594 B7R1.4 Cl[C@@H]1OCO[C@H]1Cl Amb24711721 [1,0,0,0,1,0|2,0,0]=4 595 B7R1.15 CC1C(Br)CC1C Amb24718623 [0,0,0,0,2,0|2,0,0]=4 596 B7R1.15 CC1C(Cl)CC1C Amb24352196 [0,0,0,0,2,0|2,0,0]=4 597 B7R1.15 CC1C(N)CC1C Amb25770629 [0,0,0,0,2,0|2,0,0]=4 598 B7R1.15 CC1C(S)CC1C Amb24718624 [0,0,0,0,2,0|2,0,0]=4 599 B7R1.15 CN1C(C)CC1C Amb25810646 [0,0,0,0,2,0|2,0,0]=4 600 B9R0.48 CC(CNC)OCC(C)O Amb24644350 [0,0,1,0,0,1|2,0,0]=4 601 B9R0.48 CCCC(C)OCC(C)O Amb24504646 [0,0,1,0,0,1|1,0,0]=3 602 B9R0.48 CCCC(C)OC[C@@H](C)O Amb24441315 [0,0,1,0,0,1|1,0,0]=3 603 B9R0.48 CCC[C@@H](C)CCC(C)O Amb25806670 [0,0,1,0,0,1|2,0,0]=4 604 B9R0.48 CCOC(=O)OC[C@@H](C)O Amb24583968 [0,0,1,0,0,1|1,0,1]=4 605 B9R0.48 CCOC(C)OCC(C)=O Amb24752470 [0,0,1,0,0,1|0,0,2]=4 606 B9R0.48 COCC(C)OCC(C)O Amb24064024 [0,0,1,0,0,1|2,0,0]=4 607 B9R0.48 COCC(C)OC[C@@H](C)O Amb25145657 [0,0,1,0,0,1|2,0,0]=4 608 B9R0.48 COCC(C)OC[C@H](C)O Amb24465390 [0,0,1,0,0,1|2,0,0]=4