0 B13R0.2 C=CCCCCCCCC(=O)OCC Amb30666619 [0,0,0,0,0,0|0,0,2]=2 1 B13R0.2 C=COC(=O)CCCCCCCCC Amb17672564 [0,0,0,0,0,0|0,0,2]=2 2 B13R0.2 CCCCCCCCCC(=O)CCC Amb9031610 [0,0,0,0,0,0|1,0,0]=1 3 B13R0.2 CCCCCCCCCC(=O)OCCl Amb31282507 [0,0,0,0,0,0|1,0,0]=1 4 B13R0.2 CCCCCCCCCC(=O)OCI Amb32410583 [0,0,0,0,0,0|1,0,0]=1 5 B13R0.2 CCCCCCCCCC(C)CCO Amb33321507 [0,0,0,0,0,0|3,0,1]=4 6 B13R0.2 CCCCCCCCCC(O)CCO Amb24081769 [0,0,0,0,0,0|2,0,2]=4 7 B13R0.2 CCCCCCCCNC(=O)CC#N Amb1103425 [0,0,0,0,0,0|3,0,1]=4 8 B13R0.2 CCCCCCCCNC(=O)CCCl Amb17327381 [0,0,0,0,0,0|3,0,0]=3 9 B13R0.2 CCCCCCCCNC(=O)CNC Amb24115165 [0,0,0,0,0,0|3,0,0]=3 10 B13R0.2 CCCCCCCCOC(=O)CC#N Amb16232993 [0,0,0,0,0,0|3,0,1]=4 11 B13R0.2 CCCCCCNCCC(=O)OCC Amb18334458 [0,0,0,0,0,0|1,0,0]=1 12 B13R0.2 CCCCC\C=C/C=C/C(=O)OCC Amb8514985 [0,0,0,0,0,0|0,0,4]=4 13 B13R0.2 CCCCOCCCNC(=O)CCBr Amb17326501 [0,0,0,0,0,0|4,0,0]=4 14 B13R0.2 CCCCOCCCNC(=O)CCCl Amb17329188 [0,0,0,0,0,0|4,0,0]=4 15 B13R0.2 CCCCOCCCNC(=O)CNC Amb24115104 [0,0,0,0,0,0|4,0,0]=4 16 B13R0.2 CCOC(=O)C#CCCOCCOC Amb33168696 [0,0,0,0,0,0|2,0,2]=4 17 B13R0.2 CCOC(=O)CCCCCCCC=O Amb30666661 [0,0,0,0,0,0|1,0,1]=2 18 B13R0.2 CCOC(=O)CCCCCCCCBr Amb21520303 [0,0,0,0,0,0|1,0,0]=1 19 B13R0.2 CCOC(=O)CCCCCCN=[N+]=[N-] Amb8386700 [0,0,0,0,0,0|3,0,0]=3 20 B13R0.2 CCOCCCNCCC(=O)OCC Amb9024081 [0,0,0,0,0,0|2,0,0]=2 21 B12R0.1 C=CCCCCCCC(=O)OCC Amb6298913 [1,0,0,0,0,0|0,0,2]=3 22 B12R0.1 CCCCCCCCC(=O)OCC Amb8515442 [1,0,0,0,0,0|0,0,0]=1 23 B12R0.1 CCCCCCCCC(=O)OCCl Amb32414071 [1,0,0,0,0,0|1,0,0]=2 24 B12R0.1 CCCCCCCCC(O)CCC Amb9787107 [1,0,0,0,0,0|1,0,2]=4 25 B12R0.1 CCCCCCCNC(=O)CCCl Amb3365413 [1,0,0,0,0,0|3,0,0]=4 26 B12R0.1 CCCCCCCNC(=O)CNC Amb20141923 [1,0,0,0,0,0|3,0,0]=4 27 B12R0.1 CCCCCNCCC(=O)OCC Amb9024160 [1,0,0,0,0,0|1,0,0]=2 28 B12R0.1 CCCCOCCOC(=O)CCC Amb9787610 [1,0,0,0,0,0|3,0,0]=4 29 B12R0.1 CCCNCCCOC(=O)CCC Amb18266004 [1,0,0,0,0,0|3,0,0]=4 30 B12R0.1 CCNC(=O)CCOCCOCC Amb32651490 [1,0,0,0,0,0|3,0,0]=4 31 B12R0.1 CCOC(=O)CCCCCCCBr Amb10604167 [1,0,0,0,0,0|1,0,0]=2 32 B12R0.1 CCOC(=O)CCCCCCCCl Amb22002672 [1,0,0,0,0,0|1,0,0]=2 33 B12R0.1 CCOC(=O)CCCCCCCI Amb32410617 [1,0,0,0,0,0|1,0,0]=2 34 B12R0.1 CCOC(=O)CCCCCCCN Amb19375589 [1,0,0,0,0,0|1,0,0]=2 35 B12R0.1 CCOC(=O)CCCCCCCN Amb33309141 [1,0,0,0,0,0|1,0,0]=2 36 B12R0.1 CCOC(=O)CCCCCCCO Amb32662870 [1,0,0,0,0,0|1,0,0]=2 37 B12R0.1 CCOC(=O)CCCCCN=C=O Amb3939387 [1,0,0,0,0,0|2,0,1]=4 38 B12R0.1 CCOC(=O)CCCCCN=[N+]=[N-] Amb33512720 [1,0,0,0,0,0|3,0,0]=4 39 B12R0.1 CCOC(=O)CCNCCCOC Amb9024208 [1,0,0,0,0,0|2,0,0]=3 40 B12R0.1 CCOCCNCCC(=O)OCC Amb9454393 [1,0,0,0,0,0|2,0,0]=3 41 B12R0.5 CCCCCCCCCC#CCO Amb2609119 [1,0,0,0,0,0|2,0,1]=4 42 B12R0.5 CCCCCCCCCCCCBr Amb6891945 [1,0,0,0,0,0|2,0,1]=4 43 B12R0.5 CCCCCCCCCCCCC Amb29471649 [1,0,0,0,0,0|1,0,1]=3 44 B12R0.5 CCCCCCCCCCCCC Amb8513362 [1,0,0,0,0,0|1,0,1]=3 45 B12R0.5 CCCCCCCCCCCCCl Amb4008392 [1,0,0,0,0,0|2,0,1]=4 46 B12R0.5 CCCCCCCCCCCCI Amb3940281 [1,0,0,0,0,0|2,0,1]=4 47 B12R0.5 CCCCCCCCCCCCN Amb3940463 [1,0,0,0,0,0|2,0,1]=4 48 B12R0.5 CCCCCCCCCCCCO Amb2721434 [1,0,0,0,0,0|2,0,1]=4 49 B12R0.5 CCCCCCCCCCCC[NH3+] Amb22049481 [1,0,0,0,0,0|2,0,1]=4 50 B12R0.5 CCCCCCCCCCCNC Amb32676722 [1,0,0,0,0,0|2,0,1]=4 51 B12R0.5 CCCCCCCCCCCNC Amb9787074 [1,0,0,0,0,0|2,0,1]=4 52 B12R0.5 CCCCCCCCCNCCC Amb7794670 [1,0,0,0,0,0|2,0,0]=3 53 B12R0.5 CCCCCCCCCSCCN Amb7794936 [1,0,0,0,0,0|3,0,0]=4 54 B12R0.5 CCCCCCCCCSCCO Amb7968787 [1,0,0,0,0,0|3,0,0]=4 55 B12R0.5 CCCCCCCNCCCCC Amb7761456 [1,0,0,0,0,0|2,0,1]=4 56 B12R0.5 CCCCCCNCCCCCC Amb3938960 [1,0,0,0,0,0|2,0,1]=4 57 B12R0.5 CCCCCCOCCCCCC Amb9787554 [1,0,0,0,0,0|2,0,1]=4 58 B12R0.5 CCCCCCSCCCCCC Amb8513185 [1,0,0,0,0,0|2,0,1]=4 59 B12R0.5 CCOCCCCCCCCCBr Amb33719481 [1,0,0,0,0,0|1,0,1]=3 60 B12R0.5 CCOCCCCCCCCCO Amb22233218 [1,0,0,0,0,0|1,0,1]=3 61 B12R0.248 C=CC(=O)NCCCCCCCC Amb28556071 [1,0,0,0,0,0|1,0,2]=4 62 B12R0.248 C=CC(=O)OCCCCCCCC Amb2778626 [1,0,0,0,0,0|1,0,2]=4 63 B12R0.248 C=CCCCCCCCC(=O)OC Amb533244 [1,0,0,0,0,0|0,0,2]=3 64 B12R0.248 CCCCCCCCCC(=O)NN Amb6530432 [1,0,0,0,0,0|2,0,0]=3 65 B12R0.248 CCCCCCCCCC(=O)NO Amb33548521 [1,0,0,0,0,0|2,0,0]=3 66 B12R0.248 CCCCCCCCCC(=O)OC Amb4378003 [1,0,0,0,0,0|0,0,0]=1 67 B12R0.248 CCCCCCCCNC(=O)CBr Amb17329848 [1,0,0,0,0,0|2,0,0]=3 68 B12R0.248 CCCCCCCCNC(=O)CCl Amb9786173 [1,0,0,0,0,0|2,0,0]=3 69 B12R0.248 CCCCCCCCNC(=O)CN Amb24115163 [1,0,0,0,0,0|2,0,0]=3 70 B12R0.248 CCCCCCCCOC(=O)CN Amb2688623 [1,0,0,0,0,0|2,0,0]=3 71 B12R0.248 CCCCCCCCOC(=O)C[NH3+] Amb22049491 [1,0,0,0,0,0|2,0,0]=3 72 B12R0.248 CCCCC\C=C/CCC(=O)OC Amb24093816 [1,0,0,0,0,0|0,0,2]=3 73 B12R0.248 CCCCOCCCNC(=O)CBr Amb17329849 [1,0,0,0,0,0|3,0,0]=4 74 B12R0.248 CCCCOCCCNC(=O)CN Amb24115103 [1,0,0,0,0,0|3,0,0]=4 75 B12R0.248 CCNCCOCCCC(=O)OC Amb18107249 [1,0,0,0,0,0|2,0,0]=3 76 B12R0.248 COC(=O)CCCCCCCC=O Amb8391799 [1,0,0,0,0,0|1,0,1]=3 77 B12R0.248 COC(=O)CCCCCCCCBr Amb34913614 [1,0,0,0,0,0|1,0,0]=2 78 B12R0.248 COC(=O)CCCCCCCCO Amb17616943 [1,0,0,0,0,0|1,0,0]=2 79 B12R0.248 COC(=O)CCCCCCN=[N+]=[N-] Amb33711870 [1,0,0,0,0,0|3,0,0]=4 80 B12R0.248 COC(=O)CCCSCCCCN Amb17500973 [1,0,0,0,0,0|2,0,0]=3 81 B12R0.248 COCCCCCNCC(=O)OC Amb33133279 [1,0,0,0,0,0|2,0,0]=3 82 B14R0.1 CCCC(=O)CCCCCC(=O)OCC Amb6305824 [0,1,0,0,0,0|0,0,1]=2 83 B14R0.1 CCOC(=O)CCCSCC(=O)OCC Amb2724532 [0,1,0,0,0,0|2,0,1]=4 84 B14R0.73 CCCCCCCC(=O)CC(=O)OCC Amb8397160 [0,1,0,0,0,0|0,0,1]=2 85 B14R0.73 CCCCCCC\C(C)=C\C(=O)OCC Amb33493097 [0,1,0,0,0,0|0,0,2]=3 86 B14R0.83 CCCCCCCCC(Br)C(=O)OCC Amb3940568 [0,1,0,0,0,0|0,0,0]=1 87 B14R0.163 CCCCC(=O)CCCCC(=O)OCC Amb6305813 [0,1,0,0,0,0|0,0,1]=2 88 B14R0.199 CCOC(=O)CCN(C)CCCCCO Amb32662838 [0,1,0,0,0,0|2,0,0]=3 89 B14R0.391 CCCCCCCCOC(=O)CC(C)=O Amb9787149 [0,1,0,0,0,0|2,0,1]=4 90 B14R0.393 CCCCCCCCCCC(=O)CCC Amb9031611 [0,1,0,0,0,0|1,0,0]=2 91 B14R0.393 CCCCCCCCCCC(=O)OCC Amb8513621 [0,1,0,0,0,0|0,0,0]=1 92 B14R0.393 CCCCCCCCCCC(O)CCC Amb24099722 [0,1,0,0,0,0|1,0,2]=4 93 B14R0.393 CCCCCCCCCCS(=O)CCO Amb1039004 [0,1,0,0,0,0|3,0,0]=4 94 B14R0.393 CCCCCCCCCNC(=O)CC#N Amb6531689 [0,1,0,0,0,0|2,0,1]=4 95 B14R0.393 CCCCCCCNCCC(=O)NCC Amb20171956 [0,1,0,0,0,0|1,0,0]=2 96 B14R0.393 CCCCCCCNCCC(=O)OCC Amb20171955 [0,1,0,0,0,0|0,0,0]=1 97 B14R0.393 CCOC(=O)CCCCCCCCCBr Amb21945748 [0,1,0,0,0,0|0,0,0]=1 98 B14R0.393 CCOC(=O)CCCCCCCCCN Amb33804740 [0,1,0,0,0,0|0,0,0]=1 99 B14R0.393 CCOC(=O)CCCCCCCN=C=O Amb32665818 [0,1,0,0,0,0|1,0,1]=3 100 B14R0.393 CCOC(=O)CCCCCCCN=C=S Amb33471719 [0,1,0,0,0,0|1,0,1]=3 101 B14R0.432 CCOC(=O)CCNCCCOC(C)C Amb18095496 [0,1,0,0,0,0|2,0,0]=3 102 B14R0.493 CCCCCCCCCC(=O)OCCCl Amb9789396 [0,1,0,0,0,0|0,0,0]=1 103 B14R0.493 CCCCCCCCNC(=O)CCCCl Amb17329587 [0,1,0,0,0,0|2,0,0]=3 104 B14R0.493 CCCCOCCCNC(=O)CCCCl Amb17333547 [0,1,0,0,0,0|3,0,0]=4 105 B14R0.1390 CCCCCCCCCS(=O)(=O)CCN Amb9765802 [0,1,0,0,0,0|3,0,0]=4 106 B14R0.2432 CCCCCC(=O)CCCC(=O)OCC Amb6305817 [0,1,0,0,0,0|0,0,1]=2 107 B14R1.26 CCCCCCCC1CCCC(=O)O1 Amb767091 [0,0,0,1,0,0|2,0,0]=3 108 B14R1.26 N#CCCCCCC1CCCC(=O)C1 Amb6302010 [0,0,0,1,0,0|2,0,1]=4 109 B14R1.40 CCCCCCCCCC1OCCO1 Amb8383458 [0,0,0,1,0,0|0,0,2]=3 110 B14R1.216 CCCCCCCCC1CCCC1=O Amb6337658 [0,0,0,1,0,0|1,0,0]=2 111 B14R1.216 CCCCCCCCN1CCCC1=O Amb8629204 [0,0,0,1,0,0|2,0,0]=3 112 B14R1.263 C#CCN1CCCCC1C(=O)OCC Amb32672110 [0,0,0,1,0,0|1,0,2]=4 113 B14R1.263 CCCC(=O)N1CCCCC1CCBr Amb17103919 [0,0,0,1,0,0|3,0,0]=4 114 B14R1.263 CCCC(=O)N1CCCCC1CCCl Amb17103646 [0,0,0,1,0,0|3,0,0]=4 115 B14R1.263 CCCC(=O)N1CCCCC1CCN Amb17046294 [0,0,0,1,0,0|3,0,0]=4 116 B14R1.263 CCCC(=O)N1CCCCC1CCO Amb5797558 [0,0,0,1,0,0|3,0,0]=4 117 B14R1.263 CCNC(=O)N1CCCCC1CCO Amb13883048 [0,0,0,1,0,0|3,0,0]=4 118 B14R1.263 CCOC(=O)C1CCCN=C1OCC Amb23451800 [0,0,0,1,0,0|2,0,1]=4 119 B14R1.342 O=C1CCCCCCCC(O)CCC1 Amb27593957 [0,0,0,1,0,0|2,0,0]=3 120 B14R1.520 CCOC(=O)CCCC1CCNCC1 Amb19944566 [0,0,0,1,0,0|1,0,0]=2 121 B14R1.520 CCOC(=O)CCCN1CCCCC1 Amb24066207 [0,0,0,1,0,0|1,0,0]=2 122 B14R1.520 CCOC(=O)CCNC1CCCCC1 Amb4058925 [0,0,0,1,0,0|1,0,0]=2 123 B14R1.520 CCOC(=O)\C=C\CN1CCCCC1 Amb33228409 [0,0,0,1,0,0|1,0,2]=4 124 B14R1.520 O=C(CCBr)NCCC1CCCCC1 Amb17324809 [0,0,0,1,0,0|3,0,0]=4 125 B14R1.597 CC1CCCCCC1NC(=O)CCN Amb27228752 [0,0,0,1,0,0|3,0,0]=4 126 B14R1.597 CC1CCCCCC1NC(=O)OCCl Amb30032558 [0,0,0,1,0,0|2,0,0]=3 127 B14R1.597 CCCC(=O)N[C@@H]1CCCCC[C@H]1N Amb27945081 [0,0,0,1,0,0|3,0,0]=4 128 B14R1.597 CCNC(=O)OC1CCCCCC1N Amb28409558 [0,0,0,1,0,0|3,0,0]=4 129 B14R1.597 CCNC(=S)NC1CCCCCC1C Amb27653903 [0,0,0,1,0,0|2,1,0]=4 130 B14R1.597 CCOC(=O)CC1CCCCCC1N Amb32863514 [0,0,0,1,0,0|1,0,0]=2 131 B14R1.597 CCOC(=O)CC1CCCCNC1=O Amb28653363 [0,0,0,1,0,0|2,0,1]=4 132 B14R1.597 CCOC(=O)CN1CCCCCC1=O Amb417361 [0,0,0,1,0,0|2,0,1]=4 133 B14R1.597 CCOC(=O)NC1CCCCCC1N Amb27750592 [0,0,0,1,0,0|2,0,0]=3 134 B14R1.597 CCOC(=O)NC1CCCCCC1O Amb27877235 [0,0,0,1,0,0|2,0,0]=3 135 B14R1.597 O=C(NC1CCCCCC1O)OCCl Amb29885454 [0,0,0,1,0,0|3,0,0]=4 136 B14R1.598 CCCC(=O)NCC1CCNCC1C Amb33039787 [0,0,0,1,0,0|3,0,0]=4 137 B14R1.598 CCNC(=O)NCC1CCCCC1C Amb28454961 [0,0,0,1,0,0|2,0,0]=3 138 B14R1.598 CCNC(=O)NCC1CCNCC1C Amb27877246 [0,0,0,1,0,0|3,0,0]=4 139 B14R1.598 CCOC(=O)C#CC1CCCCC1O Amb28248789 [0,0,0,1,0,0|1,0,2]=4 140 B14R1.598 CCOC(=O)C#CC1CCCCN1C Amb33168718 [0,0,0,1,0,0|1,0,2]=4 141 B14R1.598 CCOC(=O)C#CC1CCNCC1C Amb33168730 [0,0,0,1,0,0|1,0,2]=4 142 B14R1.598 CCOC(=O)CCC1CCCCC1N Amb33738316 [0,0,0,1,0,0|1,0,0]=2 143 B14R1.598 CCOC(=O)CCC1CCNCC1C Amb33731804 [0,0,0,1,0,0|1,0,0]=2 144 B14R1.598 CCOC(=O)CCN1CCCCC1C Amb8867155 [0,0,0,1,0,0|1,0,0]=2 145 B14R1.598 CCOC(=O)CCN1CCNCC1C Amb33744702 [0,0,0,1,0,0|2,0,0]=3 146 B14R1.598 CCOC(=O)COC1CCCCC1C Amb9206375 [0,0,0,1,0,0|1,0,0]=2 147 B14R1.609 CCNC(=O)CCNCC1CCCO1 Amb18332897 [0,0,0,1,0,0|3,0,0]=4 148 B14R1.609 CCOC(=O)CCNCC1CCCO1 Amb9024180 [0,0,0,1,0,0|2,0,0]=3 149 B14R1.619 CCCC(=O)N1CCCCCC1CN Amb33038729 [0,0,0,1,0,0|3,0,0]=4 150 B14R1.619 CCNC(=N)N1CCCCCC1CC Amb27628940 [0,0,0,1,0,0|3,0,0]=4 151 B14R1.619 CCNC(=O)N1CCCCCC1CN Amb24728029 [0,0,0,1,0,0|3,0,0]=4 152 B14R1.619 CCNC(=O)N1CCCCCC1CO Amb27462851 [0,0,0,1,0,0|3,0,0]=4 153 B14R1.622 CCCS(=O)C1CCCCCCC1N Amb27753894 [0,0,0,1,0,0|3,0,0]=4 154 B14R1.622 CCOC(=O)C1=C(N)CCCCCC1 Amb25780686 [0,0,0,1,0,0|1,0,2]=4 155 B14R1.622 CCOC(=O)C1CCCCCCC1=O Amb6357165 [0,0,0,1,0,0|1,0,1]=3 156 B14R1.622 CCOC(=O)C1CCCCCCC1N Amb27794781 [0,0,0,1,0,0|1,0,0]=2 157 B14R1.622 CCOC(=O)[C@@H]1CCC=CCC[C@@H]1N Amb25226839 [0,0,0,1,0,0|1,0,2]=4 158 B14R1.622 CCOC(=O)[C@@H]1CCC=CCC[C@@H]1N Amb33620408 [0,0,0,1,0,0|1,0,2]=4 159 B14R1.622 CCOC(=O)[C@@H]1CCCCCC[C@@H]1N Amb25911912 [0,0,0,1,0,0|1,0,0]=2 160 B14R1.622 CCOC(=O)[C@H]1CCCCCC[C@H]1N Amb28141861 [0,0,0,1,0,0|1,0,0]=2 161 B14R1.838 [N-]=[N+]=C1CCCCCCCCCC1=O Amb17595121 [0,0,0,1,0,0|3,0,0]=4 162 B14R1.947 CCOC(=O)C#CC1CCNC1CC Amb33168775 [0,0,0,1,0,0|1,0,2]=4 163 B14R1.948 CCCC(=O)NCC[C@@H]1CNC[C@H]1C Amb32696183 [0,0,0,1,0,0|3,0,0]=4 164 B14R1.948 CCNC(=O)NCC[C@@H]1CNC[C@H]1C Amb32696208 [0,0,0,1,0,0|3,0,0]=4 165 B14R1.965 CCCC(=O)NC1CNCCC1CC Amb32677501 [0,0,0,1,0,0|3,0,0]=4 166 B14R1.965 CCNC(=N)NC1CCCCC1CC Amb19066590 [0,0,0,1,0,0|3,0,0]=4 167 B14R1.965 CCOC(=O)CN1CCCCC1CC Amb8873238 [0,0,0,1,0,0|1,0,0]=2 168 B14R1.965 CCOC(=O)\C=C1\CCCCC1CC Amb33468699 [0,0,0,1,0,0|0,0,2]=3 169 B14R1.965 CCOC(=O)\C=C1\CCCCC1OC Amb33493146 [0,0,0,1,0,0|1,0,2]=4 170 B14R1.965 C\C=C\C(=O)NC1CCCCC1CC Amb27602025 [0,0,0,1,0,0|2,0,1]=4 171 B14R1.4408 O=C1C=CCCCCCCCCCC1 Amb25793577 [0,0,0,1,0,0|1,0,1]=3 172 B14R1.4408 O=C1C=CCCCCCCCCCN1 Amb24404897 [0,0,0,1,0,0|1,0,2]=4 173 B14R1.4408 O=C1CCCCC=CCCCCCN1 Amb27841100 [0,0,0,1,0,0|1,0,2]=4 174 B14R1.4408 O=C1CCCCCCCCC=CCN1 Amb27859494 [0,0,0,1,0,0|1,0,2]=4 175 B14R1.4408 O=C1CCCCCCCCCCCN1 Amb9825846 [0,0,0,1,0,0|1,0,0]=2 176 B14R1.4408 O=C1CCCCCCCCCCCO1 Amb9825923 [0,0,0,1,0,0|0,0,0]=1 177 B14R1.4408 O=C1CCCCCCCCNCCO1 Amb28187014 [0,0,0,1,0,0|1,0,0]=2 178 B14R1.4408 O=C1CCCCCCCNCCCO1 Amb27746900 [0,0,0,1,0,0|1,0,0]=2 179 B14R1.4408 O=C1NCCCCCCCCCCN1 Amb28130432 [0,0,0,1,0,0|2,0,0]=3 180 B14R1.4408 O=C1OCCCCCCCCCCO1 Amb24459843 [0,0,0,1,0,0|1,0,0]=2 181 B14R1.4408 OC1CCCCCCCCCCCC1 Amb27598545 [0,0,0,1,0,0|1,0,2]=4 182 B14R1.4408 SC1=NCCCCCCCCCCN1 Amb28074045 [0,0,0,1,0,0|2,1,0]=4 183 B14R1.7119 CCNC(=S)N1CCCCCCCC1 Amb28282882 [0,0,0,1,0,0|2,1,0]=4 184 B14R1.7119 O=C(CCS)N1CCCCCCCC1 Amb28399490 [0,0,0,1,0,0|3,0,0]=4 185 B14R1.7119 O=C(OCCl)N1CCCCCCCC1 Amb29886207 [0,0,0,1,0,0|2,0,0]=3 186 B14R1.7146 CCCC(=O)NCC1CCCCCN1 Amb33038737 [0,0,0,1,0,0|3,0,0]=4 187 B14R1.7146 CCCC(=O)NCC1CCCCNC1 Amb33229314 [0,0,0,1,0,0|3,0,0]=4 188 B14R1.7146 CCNC(=N)NCC1CCCCCC1 Amb27983876 [0,0,0,1,0,0|3,0,0]=4 189 B14R1.7146 CCNC(=O)NCC1CCCCCN1 Amb33038762 [0,0,0,1,0,0|3,0,0]=4 190 B14R1.7146 CCNC(=O)NCC1CCCCNC1 Amb26558155 [0,0,0,1,0,0|3,0,0]=4 191 B14R1.7146 CCNC(=O)NCC1CCCSCC1 Amb30030721 [0,0,0,1,0,0|3,0,0]=4 192 B14R1.7146 CCNC(=S)NCC1CCCCCC1 Amb28193225 [0,0,0,1,0,0|2,1,0]=4 193 B14R1.7146 CCOC(=O)C#CC1CCCCCC1 Amb33168666 [0,0,0,1,0,0|0,0,2]=3 194 B14R1.7146 CCOC(=O)C#CC1CCCCCN1 Amb33168693 [0,0,0,1,0,0|1,0,2]=4 195 B14R1.7146 CCOC(=O)CCN1CCCCCC1 Amb843108 [0,0,0,1,0,0|1,0,0]=2 196 B14R1.7146 CCOC(=O)CNC1=NCCCCC1 Amb19651174 [0,0,0,1,0,0|2,0,1]=4 197 B14R1.7146 CCOC(=O)CNC1=NCCCCC1 Amb22046568 [0,0,0,1,0,0|2,0,1]=4 198 B14R1.7146 C\C=C\C(=O)NCC1CCCCCC1 Amb27444273 [0,0,0,1,0,0|2,0,1]=4 199 B14R1.7343 CCCC(=O)NC1CCCCCCC1 Amb3364282 [0,0,0,1,0,0|2,0,0]=3 200 B14R1.7343 CCCC(=O)NC1CCCCCNC1 Amb32659968 [0,0,0,1,0,0|3,0,0]=4 201 B14R1.7343 CCNC(=S)NC1CCCCCCC1 Amb4773271 [0,0,0,1,0,0|2,1,0]=4 202 B14R1.7343 CCOC(=O)C=C1CCCCCCC1 Amb22230459 [0,0,0,1,0,0|0,0,2]=3 203 B14R1.7343 CCOC(=O)CC1CCCCCCN1 Amb33356221 [0,0,0,1,0,0|1,0,0]=2 204 B14R1.7343 CCOC(=O)CN1CCCCCCC1 Amb7761443 [0,0,0,1,0,0|1,0,0]=2 205 B14R1.7343 CCOC(=O)NC1CCCCCCC1 Amb3367085 [0,0,0,1,0,0|1,0,0]=2 206 B14R1.7343 O=C(CCCl)NC1CCCCCCC1 Amb6243926 [0,0,0,1,0,0|3,0,0]=4 207 B14R1.7343 O=C(NC1CCCCCCC1)OCCl Amb30032561 [0,0,0,1,0,0|2,0,0]=3 208 B11R0.3 CCCCCCCCCCCBr Amb8514664 [2,0,0,0,0,0|1,0,1]=4 209 B11R0.3 CCCCCCCCCCCC Amb8513157 [2,0,0,0,0,0|0,0,1]=3 210 B11R0.3 CCCCCCCCCCCCl Amb9787117 [2,0,0,0,0,0|1,0,1]=4 211 B11R0.3 CCCCCCCCCCCN Amb3941511 [2,0,0,0,0,0|1,0,1]=4 212 B11R0.3 CCCCCCCCCCCO Amb6646062 [2,0,0,0,0,0|1,0,1]=4 213 B11R0.3 CCCCCCCCCCNC Amb33934687 [2,0,0,0,0,0|1,0,1]=4 214 B11R0.3 CCCCCCCCCCNC Amb9787067 [2,0,0,0,0,0|1,0,1]=4 215 B11R0.3 CCCCCCCCCNCC Amb7761767 [2,0,0,0,0,0|1,0,0]=3 216 B11R0.3 CCCCCCCC\C=C\CO Amb22052644 [2,0,0,0,0,0|1,0,1]=4 217 B11R0.3 CCCCCCCNCCCC Amb4313708 [2,0,0,0,0,0|1,0,1]=4 218 B11R0.3 CCCCCCNCCCCC Amb6656070 [2,0,0,0,0,0|1,0,1]=4 219 B11R0.3 CCCCCCNCCCOC Amb7760836 [2,0,0,0,0,0|1,0,1]=4 220 B11R0.3 CCCCNCCCCCOC Amb33133268 [2,0,0,0,0,0|1,0,1]=4 221 B11R0.3 CCNCCCCCCNCC Amb22733571 [2,0,0,0,0,0|2,0,0]=4 222 B11R0.3 CCSCCCCCCSCC Amb9786285 [2,0,0,0,0,0|1,1,0]=4 223 B11R0.3 C\C=C\CCCCCCCCO Amb22641580 [2,0,0,0,0,0|1,0,1]=4 224 B11R0.4 C=CCCCCCC(=O)OCC Amb6298912 [2,0,0,0,0,0|0,0,2]=4 225 B11R0.4 C=COC(=O)CCCCCCC Amb17672562 [2,0,0,0,0,0|0,0,2]=4 226 B11R0.4 CCCCCC#CC(=O)OCC Amb2721498 [2,0,0,0,0,0|0,0,2]=4 227 B11R0.4 CCCCCCCC(=O)OCC Amb6608755 [2,0,0,0,0,0|0,0,0]=2 228 B11R0.4 CCCCCCNC(=O)CCC Amb17855601 [2,0,0,0,0,0|2,0,0]=4 229 B11R0.4 CCCCCCOC(=O)OCCl Amb32413740 [2,0,0,0,0,0|2,0,0]=4 230 B11R0.4 CCCCC\C=C\C(=O)OCC Amb33986022 [2,0,0,0,0,0|0,0,2]=4 231 B11R0.4 CCCCNCCC(=O)OCC Amb9024194 [2,0,0,0,0,0|1,0,0]=3 232 B11R0.4 CCCCSCCC(=O)OCC Amb1032991 [2,0,0,0,0,0|1,0,0]=3 233 B11R0.4 CCOC(=O)CCCCCC=O Amb8471024 [2,0,0,0,0,0|1,0,1]=4 234 B11R0.4 CCOC(=O)CCCCCCBr Amb2778976 [2,0,0,0,0,0|1,0,0]=3 235 B11R0.4 CCOC(=O)CCCCCCI Amb32410628 [2,0,0,0,0,0|1,0,0]=3 236 B11R0.4 CCOC(=O)CCCCCCN Amb7772452 [2,0,0,0,0,0|1,0,0]=3 237 B11R0.4 CCOC(=O)CCCCCCN Amb8396796 [2,0,0,0,0,0|1,0,0]=3 238 B11R0.4 CCOC(=O)CCCCCNC Amb32666565 [2,0,0,0,0,0|1,0,0]=3 239 B11R0.4 CCOC(=O)CCCCCNC Amb32666566 [2,0,0,0,0,0|1,0,0]=3 240 B11R0.4 CCOC(=O)CCNCCCO Amb9243305 [2,0,0,0,0,0|2,0,0]=4 241 B11R0.4 CCOC(=O)CCNCCOC Amb9024155 [2,0,0,0,0,0|2,0,0]=4 242 B11R0.4 CCOC(=O)CCOCCCN Amb18111491 [2,0,0,0,0,0|2,0,0]=4 243 B11R0.4 CCOC(=O)CCOCCNC Amb18111839 [2,0,0,0,0,0|2,0,0]=4 244 B11R0.4 CCOC(=O)CCSCCCN Amb33802453 [2,0,0,0,0,0|2,0,0]=4 245 B11R0.4 CCOC(=O)NCCCCCN Amb24103492 [2,0,0,0,0,0|2,0,0]=4 246 B11R0.4 CCOC(=O)NCCCCCO Amb13883047 [2,0,0,0,0,0|2,0,0]=4 247 B11R0.4 CCOCCOCC(=O)OCC Amb9206357 [2,0,0,0,0,0|2,0,0]=4 248 B11R0.40 CCCCCCC#CC(=O)OC Amb2725482 [2,0,0,0,0,0|0,0,2]=4 249 B11R0.40 CCCCCCCCC(=O)CC Amb9024774 [2,0,0,0,0,0|0,0,0]=2 250 B11R0.40 CCCCCCCCC(=O)NN Amb6544507 [2,0,0,0,0,0|2,0,0]=4 251 B11R0.40 CCCCCCCCC(=O)OC Amb8517582 [2,0,0,0,0,0|0,0,0]=2 252 B11R0.40 CCCCCCCNC(=O)CBr Amb17323631 [2,0,0,0,0,0|2,0,0]=4 253 B11R0.40 CCCCCCCNC(=O)CCl Amb17329833 [2,0,0,0,0,0|2,0,0]=4 254 B11R0.40 CCCCCCCNC(=O)CN Amb24115161 [2,0,0,0,0,0|2,0,0]=4 255 B11R0.40 CCCCCCCOC(=O)CC Amb9787227 [2,0,0,0,0,0|1,0,0]=3 256 B11R0.40 CCCCCCCOC(=O)CCl Amb9787570 [2,0,0,0,0,0|2,0,0]=4 257 B11R0.40 CCCCCCCOC(=O)CS Amb9786410 [2,0,0,0,0,0|2,0,0]=4 258 B11R0.40 CCCCCC\C=C\C(=O)OC Amb33513079 [2,0,0,0,0,0|0,0,2]=4 259 B11R0.40 CCCNCCCOC(=O)CC Amb18263176 [2,0,0,0,0,0|2,0,0]=4 260 B11R0.40 CCCSSCCCC(=O)OC Amb33040840 [2,0,0,0,0,0|2,0,0]=4 261 B11R0.40 CNCCOCCCC(=O)OC Amb18624289 [2,0,0,0,0,0|2,0,0]=4 262 B11R0.40 COC(=O)CCCCCCCBr Amb24063235 [2,0,0,0,0,0|1,0,0]=3 263 B11R0.40 COC(=O)CCCCCCCN Amb20669115 [2,0,0,0,0,0|1,0,0]=3 264 B11R0.40 COC(=O)CCCCCCCN Amb24331924 [2,0,0,0,0,0|1,0,0]=3 265 B11R0.40 COC(=O)CCCOCCCN Amb18111569 [2,0,0,0,0,0|2,0,0]=4 266 B11R0.40 COC(=O)CCCSCCCN Amb17500720 [2,0,0,0,0,0|2,0,0]=4 267 B11R0.40 COC(=O)CCCSCCCO Amb17502861 [2,0,0,0,0,0|2,0,0]=4 268 B11R0.40 COC(=O)NCCCCCCO Amb24095886 [2,0,0,0,0,0|2,0,0]=4 269 B11R0.148 C#CCCCCCCCC(=O)O Amb22388895 [2,0,0,0,0,0|0,0,2]=4 270 B11R0.148 C=C(Br)CCCCCCCCC Amb6298936 [2,0,0,0,0,0|1,0,1]=4 271 B11R0.148 C=C(C)CCCCCCCCC Amb6298942 [2,0,0,0,0,0|1,0,0]=3 272 B11R0.148 C=C(Cl)CCCCCCCCC Amb6298930 [2,0,0,0,0,0|1,0,1]=4 273 B11R0.148 C=CCCCCCCCC(=O)O Amb2686677 [2,0,0,0,0,0|0,0,2]=4 274 B11R0.148 CCCCCCCCCC(=O)Cl Amb8513576 [2,0,0,0,0,0|1,0,0]=3 275 B11R0.148 CCCCCCCCCC(=O)O Amb5718031 [2,0,0,0,0,0|0,0,0]=2 276 B11R0.148 CCCCCCCCCC(C)=O Amb6307417 [2,0,0,0,0,0|0,0,0]=2 277 B11R0.148 CCCCCCCCCC(C)C Amb22043228 [2,0,0,0,0,0|1,0,1]=4 278 B11R0.148 CCCCCCCCCC(C)N Amb6366423 [2,0,0,0,0,0|1,0,1]=4 279 B11R0.148 CCCCCCCCCC(N)=O Amb6366435 [2,0,0,0,0,0|1,0,0]=3 280 B11R0.148 CCCCCCCCCC(N)=S Amb7794719 [2,0,0,0,0,0|1,1,0]=4 281 B11R0.148 CCCCCCCCCS(=O)Cl Amb32720537 [2,0,0,0,0,0|2,0,0]=4 282 B11R0.148 CCCCCCCCCS(=O)[O-] Amb32755589 [2,0,0,0,0,0|1,0,1]=4 283 B11R0.148 CCCCCCCCCS(N)=O Amb32720538 [2,0,0,0,0,0|2,0,0]=4 284 B11R0.148 CCCCCCCCNC(C)=O Amb33551736 [2,0,0,0,0,0|1,0,0]=3 285 B11R0.148 CCCCCCCCOC(=O)Cl Amb8515453 [2,0,0,0,0,0|2,0,0]=4 286 B11R0.148 CCCCCCCCOC(C)=O Amb8515405 [2,0,0,0,0,0|1,0,0]=3 287 B11R0.148 CCCCCCCNCC(=O)O Amb19373457 [2,0,0,0,0,0|1,0,0]=3 288 B11R0.148 CCCCCCCNCC(=O)O Amb8827566 [2,0,0,0,0,0|1,0,0]=3 289 B11R0.148 CCCCCCC\C=C\C(=O)O Amb6336657 [2,0,0,0,0,0|0,0,2]=4 290 B11R0.148 CCCCCCNCCC(=O)O Amb8830823 [2,0,0,0,0,0|1,0,0]=3 291 B11R0.148 CCCCC\C=C\CCC(=O)O Amb24079160 [2,0,0,0,0,0|0,0,2]=4 292 B11R0.148 CCCCOCCOCC(=O)O Amb9204477 [2,0,0,0,0,0|2,0,0]=4 293 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [2,0,0,0,0,0|1,0,0]=3 294 B11R0.148 CCC\C=C\CCCCC(=O)O Amb24063196 [2,0,0,0,0,0|0,0,2]=4 295 B11R0.148 CCNCCOCCCC(=O)O Amb18110845 [2,0,0,0,0,0|2,0,0]=4 296 B11R0.148 CCOCCOCCCC(=O)O Amb6262117 [2,0,0,0,0,0|2,0,0]=4 297 B11R0.148 CNCCCNCCCC(=O)O Amb28963363 [2,0,0,0,0,0|2,0,0]=4 298 B11R0.148 CNCCCNCCCC(=O)O Amb33470189 [2,0,0,0,0,0|2,0,0]=4 299 B11R0.148 COCCOCCCCC(=O)O Amb9207792 [2,0,0,0,0,0|2,0,0]=4 300 B11R0.148 NCCCCSCCCC(=O)O Amb17500972 [2,0,0,0,0,0|2,0,0]=4 301 B11R0.148 O=C(O)CCCCCCCCBr Amb8631538 [2,0,0,0,0,0|1,0,0]=3 302 B11R0.148 O=C(O)CCCCCCCCO Amb3372037 [2,0,0,0,0,0|1,0,0]=3 303 B13R0.66 CCCCCCCCS(=O)CCCCl Amb22731437 [1,1,0,0,0,0|2,0,0]=4 304 B13R0.66 CCCCCCCNC(=O)CCCCl Amb17323882 [1,1,0,0,0,0|2,0,0]=4 305 B13R0.87 CCOC(=O)CCCCCC(=O)CC Amb6305809 [1,1,0,0,0,0|0,0,1]=3 306 B13R0.88 C=C(Br)CCCCCCC(=O)OCC Amb6298921 [1,1,0,0,0,0|0,0,2]=4 307 B13R0.88 CCOC(=O)CCCCCCC(=O)O Amb8471020 [1,1,0,0,0,0|1,0,1]=4 308 B13R0.88 CCOC(=O)CCNCCCN(C)C Amb9024212 [1,1,0,0,0,0|2,0,0]=4 309 B13R0.175 CCCCC(=O)CCCC(=O)OCC Amb6305812 [1,1,0,0,0,0|0,0,1]=3 310 B13R0.193 CCCCCC(=O)CCC(=O)OCC Amb33533586 [1,1,0,0,0,0|0,0,1]=3 311 B13R0.275 CCCCCCCC(Br)C(=O)OCC Amb24066457 [1,1,0,0,0,0|0,0,0]=2 312 B13R0.330 CCCCCC\C(C)=C\C(=O)OCC Amb33493100 [1,1,0,0,0,0|0,0,2]=4 313 B13R0.367 CCCC(=O)CCCCC(=O)OCC Amb6305823 [1,1,0,0,0,0|0,0,1]=3 314 B13R0.367 CCOC(=O)CCCCC(=O)OCC Amb6891947 [1,1,0,0,0,0|1,0,1]=4 315 B13R0.367 CCOC(=O)CCCCC(Cl)CCCl Amb8387766 [1,1,0,0,0,0|1,0,0]=3 316 B13R0.367 CCOC(=O)CCCCC(O)CCCl Amb8393299 [1,1,0,0,0,0|1,0,0]=3 317 B13R0.54 CCCCCCCCCCCC(C)Br Amb22734063 [1,1,0,0,0,0|1,0,1]=4 318 B13R0.54 CCCCCCCCCCCC(C)N Amb21953727 [1,1,0,0,0,0|1,0,1]=4 319 B13R0.147 CCCCCCCCCNC(C)CC Amb7794406 [1,1,0,0,0,0|2,0,0]=4 320 B13R0.336 CCCCCCCCCCCCCBr Amb16234183 [1,1,0,0,0,0|1,0,1]=4 321 B13R0.336 CCCCCCCCCCCCCC Amb8513726 [1,1,0,0,0,0|1,0,1]=4 322 B13R0.336 CCCCCCCCCCCCCCl Amb9787118 [1,1,0,0,0,0|1,0,1]=4 323 B13R0.336 CCCCCCCCCCCCCN Amb8513364 [1,1,0,0,0,0|1,0,1]=4 324 B13R0.336 CCCCCCCCCCCCCO Amb2748034 [1,1,0,0,0,0|1,0,1]=4 325 B13R0.336 CCCCCCCCCCCCNC Amb3941528 [1,1,0,0,0,0|1,0,1]=4 326 B13R0.336 CCCCCCCCCCCSCC Amb32410616 [1,1,0,0,0,0|0,1,1]=4 327 B13R0.336 CCCCCCCCCCNCCC Amb9787079 [1,1,0,0,0,0|1,0,1]=4 328 B13R0.336 CCCCCCCCCCNCCN Amb18333779 [1,1,0,0,0,0|1,0,1]=4 329 B13R0.336 CCCCCCCCCCNCCO Amb9787053 [1,1,0,0,0,0|1,0,1]=4 330 B13R0.336 CCCCCCCCCCOCCCl Amb9787198 [1,1,0,0,0,0|0,0,1]=3 331 B13R0.336 CCCCCCCCCCSCCO Amb1032989 [1,1,0,0,0,0|0,1,1]=4 332 B13R0.336 CCCCCCCCCNCCOC Amb7794404 [1,1,0,0,0,0|2,0,0]=4 333 B13R0.336 CCCCCCCOCCOCCCl Amb9786143 [1,1,0,0,0,0|1,0,1]=4 334 B13R0.150 CCCCCCCCCC(=O)C(F)F Amb35744328 [1,1,0,0,0,0|1,0,0]=3 335 B13R0.150 CCCCCCCCCC(=O)N(C)C Amb2720945 [1,1,0,0,0,0|1,0,0]=3 336 B13R0.150 CCCCCCCCNC(=O)C(C)Br Amb17327670 [1,1,0,0,0,0|1,0,0]=3 337 B13R0.150 CCCCCCCCNC(=O)C(C)Cl Amb17329451 [1,1,0,0,0,0|1,0,0]=3 338 B13R0.150 CCCCOCCCNC(=O)C(C)Cl Amb17331233 [1,1,0,0,0,0|2,0,0]=4 339 B13R0.201 COC(=O)CCCCCCC(=O)OC Amb2695243 [1,1,0,0,0,0|1,0,1]=4 340 B13R0.202 COC(=O)CCCCCCCC(=O)O Amb2099653 [1,1,0,0,0,0|1,0,1]=4 341 B13R0.274 CCCCCCCC(=O)CC(=O)OC Amb17617713 [1,1,0,0,0,0|0,0,1]=3 342 B13R0.274 CCCCCCC[C@@H](O)CC(=O)OC Amb17615271 [1,1,0,0,0,0|0,0,0]=2 343 B13R0.274 CCCCCCC\C(C)=C\C(=O)OC Amb33472149 [1,1,0,0,0,0|0,0,2]=4 344 B13R0.274 CCCCCCNC(C)CC(=O)OC Amb20673380 [1,1,0,0,0,0|1,0,0]=3 345 B13R0.274 CCOCCCNC(C)CC(=O)OC Amb9398643 [1,1,0,0,0,0|2,0,0]=4 346 B15R0.2187 CCOC(=O)CCC(F)CCC(=O)OCC Amb10605638 [0,2,0,0,0,0|1,0,1]=4 347 B15R0.2847 CCOC(=O)CCNCCCN(CC)CC Amb9024268 [0,2,0,0,0,0|2,0,0]=4 348 B15R0.244 CCCCCC(=O)CCCCC(=O)OCC Amb6305818 [0,2,0,0,0,0|0,0,0]=2 349 B15R0.4259 CCCOC(=O)CCCCC(=O)OCCC Amb8516610 [0,2,0,0,0,0|1,0,1]=4 350 B15R0.3224 CCCCCCCCCC(=O)N(CC)CC Amb15692289 [0,2,0,0,0,0|1,0,0]=3 351 B15R0.69 CCCCCCCCCOC(=O)CC(C)=O Amb9787151 [0,2,0,0,0,0|1,0,1]=4 352 B15R0.3221 CCCCCCCCCC(=O)OC(C)CC Amb33756844 [0,2,0,0,0,0|0,0,0]=2 353 B15R0.3232 CC(C)(C)OC(=O)CCCCCCCCN Amb34913141 [0,2,0,0,0,0|1,0,0]=3 354 B15R0.3232 CC(C)(C)OC(=O)NCCCCCCCBr Amb23603710 [0,2,0,0,0,0|2,0,0]=4 355 B15R0.3232 CC(C)(C)OC(=O)NCCCCCCCI Amb34913145 [0,2,0,0,0,0|2,0,0]=4 356 B15R0.3232 CC(C)(C)OC(=O)NCCCCCCCN Amb2695632 [0,2,0,0,0,0|2,0,0]=4 357 B15R0.3232 CC(C)(C)OC(=O)NCCCCCCCO Amb27881178 [0,2,0,0,0,0|2,0,0]=4 358 B15R0.3232 CCCCCCNCCC(=O)OC(C)(C)C Amb20673226 [0,2,0,0,0,0|1,0,0]=3 359 B15R0.3232 CCCCNCCCNC(=O)OC(C)(C)C Amb26558167 [0,2,0,0,0,0|2,0,0]=4 360 B15R0.3232 CCCCOCCCNC(=O)OC(C)(C)C Amb28184619 [0,2,0,0,0,0|2,0,0]=4 361 B15R0.3232 CCNCCCCCNC(=O)OC(C)(C)C Amb5492772 [0,2,0,0,0,0|2,0,0]=4 362 B15R0.3232 CCOCCCNCCC(=O)OC(C)(C)C Amb20673244 [0,2,0,0,0,0|2,0,0]=4 363 B15R0.3232 CNCCCCCCNC(=O)OC(C)(C)C Amb32667463 [0,2,0,0,0,0|2,0,0]=4 364 B15R0.3232 CSCCCCCCNC(=O)OC(C)(C)C Amb26980579 [0,2,0,0,0,0|2,0,0]=4 365 B15R0.111 CCOC(=O)CCCCCCCCC(=O)O Amb3354796 [0,2,0,0,0,0|0,0,1]=3 366 B15R0.366 CCCCCCCCCCCC(=O)OCC Amb6366580 [0,2,0,0,0,0|0,0,0]=2 367 B15R0.366 CCCCCCCCCCCC(=O)OCCl Amb32413654 [0,2,0,0,0,0|1,0,0]=3 368 B15R0.366 CCCCCCCCNCCC(=O)OCC Amb20673293 [0,2,0,0,0,0|0,0,0]=2 369 B15R0.366 CCCCCC\C=C\CCCC(=O)OCC Amb24066550 [0,2,0,0,0,0|0,0,0]=2 370 B15R0.366 CCOC(=O)CCCCCCCCCCN Amb33804736 [0,2,0,0,0,0|0,0,0]=2 371 B15R0.2002 C=CCCCCCCCCC(=O)NCCO Amb33986313 [0,2,0,0,0,0|1,0,1]=4 372 B15R0.322 CCCCCCCCCC(=O)CCCCC Amb22359716 [0,2,0,0,0,0|1,0,0]=3 373 B13R1.6 CCCCCCC1CCCC(=O)O1 Amb9825889 [1,0,0,1,0,0|2,0,0]=4 374 B13R1.6 CCCCOCC1CCNC(=O)C1 Amb32654950 [1,0,0,1,0,0|2,0,0]=4 375 B13R1.42 CCNC(=O)CCN1CCCCC1 Amb24288669 [1,0,0,1,0,0|2,0,0]=4 376 B13R1.42 CCOC(=O)C#CC1CCCCC1 Amb33168619 [1,0,0,1,0,0|0,0,2]=4 377 B13R1.42 CCOC(=O)CCC1CCCCC1 Amb4007386 [1,0,0,1,0,0|0,0,0]=2 378 B13R1.42 CCOC(=O)CCC1CCCCN1 Amb18328931 [1,0,0,1,0,0|1,0,0]=3 379 B13R1.42 CCOC(=O)CCC1CCCCN1 Amb32681169 [1,0,0,1,0,0|1,0,0]=3 380 B13R1.42 CCOC(=O)CCC1CCCNC1 Amb33550327 [1,0,0,1,0,0|1,0,0]=3 381 B13R1.42 CCOC(=O)CCC1CCCNC1 Amb9902059 [1,0,0,1,0,0|1,0,0]=3 382 B13R1.42 CCOC(=O)CCC1CCNCC1 Amb22230647 [1,0,0,1,0,0|1,0,0]=3 383 B13R1.42 CCOC(=O)CCC1CCNCC1 Amb9902058 [1,0,0,1,0,0|1,0,0]=3 384 B13R1.42 CCOC(=O)CCC1CCOCC1 Amb32412841 [1,0,0,1,0,0|1,0,0]=3 385 B13R1.42 CCOC(=O)CCC1OCCCO1 Amb6305826 [1,0,0,1,0,0|2,0,0]=4 386 B13R1.42 CCOC(=O)CCN1CCCCC1 Amb1981444 [1,0,0,1,0,0|1,0,0]=3 387 B13R1.42 CCOC(=O)CCN1CCNCC1 Amb2690369 [1,0,0,1,0,0|2,0,0]=4 388 B13R1.42 CCOC(=O)CCN1CCOCC1 Amb1981445 [1,0,0,1,0,0|2,0,0]=4 389 B13R1.42 CCOC(=O)CNC1CCCCC1 Amb33548346 [1,0,0,1,0,0|1,0,0]=3 390 B13R1.42 CCOC(=O)CNC1CCCCC1 Amb6706998 [1,0,0,1,0,0|1,0,0]=3 391 B13R1.42 CCOC(=O)CNC1CCOCC1 Amb9474106 [1,0,0,1,0,0|2,0,0]=4 392 B13R1.42 CCOC(=O)COC1CCCCO1 Amb30633530 [1,0,0,1,0,0|2,0,0]=4 393 B13R1.42 CCOC(=O)COC1CCNCC1 Amb33204431 [1,0,0,1,0,0|2,0,0]=4 394 B13R1.42 CCOC(=O)COC1CCNCC1 Amb33204439 [1,0,0,1,0,0|2,0,0]=4 395 B13R1.42 CCOC(=O)\C=C\C1CCCCC1 Amb10067015 [1,0,0,1,0,0|0,0,2]=4 396 B13R1.119 CCCCCCCCC1OCCO1 Amb22364938 [1,0,0,1,0,0|0,0,2]=4 397 B13R1.190 CCCCCCC1CC(=O)OC1=O Amb33756887 [1,0,0,1,0,0|1,0,1]=4 398 B13R1.190 CCCCCCC1OC(=O)CC1C Amb22001856 [1,0,0,1,0,0|2,0,0]=4 399 B13R1.208 CCCC1CCNC1C(=O)OCC Amb33727374 [1,0,0,1,0,0|1,0,0]=3 400 B13R1.208 CCC[C@@H]1CNC[C@H]1C(=O)OCC Amb33038597 [1,0,0,1,0,0|1,0,0]=3 401 B13R1.279 O=C1CCCCCCCCCCC1 Amb1935123 [1,0,0,1,0,0|1,0,0]=3 402 B13R1.279 O=C1CCCCCCCCCCN1 Amb22011853 [1,0,0,1,0,0|1,0,0]=3 403 B13R1.279 O=C1CNCCCCCCCCN1 Amb27240963 [1,0,0,1,0,0|2,0,0]=4 404 B13R1.289 CC1CCCCCCCCC(=O)N1 Amb28365005 [1,0,0,1,0,0|1,0,0]=3 405 B13R1.404 CCOC(=O)CCNC1CCCC1 Amb9024240 [1,0,0,1,0,0|1,0,0]=3 406 B13R1.404 CCOC(=O)CNCC1CCCO1 Amb9748906 [1,0,0,1,0,0|2,0,0]=4 407 B13R1.404 CCOC(=O)COCC1CCCO1 Amb7773822 [1,0,0,1,0,0|2,0,0]=4 408 B13R1.448 CCOC(=O)CCCOC1CNC1 Amb32941787 [1,0,0,1,0,0|2,0,0]=4 409 B13R1.463 CC1CCCCCN1C(=O)OCCl Amb35644462 [1,0,0,1,0,0|2,0,0]=4 410 B13R1.463 CCCC(=O)C1CCCCCC1C Amb35725702 [1,0,0,1,0,0|1,0,0]=3 411 B13R1.463 CCNC(=O)C1CCCCCC1N Amb27415938 [1,0,0,1,0,0|2,0,0]=4 412 B13R1.463 CCOC(=O)C1CCCCCC1=O Amb33538921 [1,0,0,1,0,0|1,0,1]=4 413 B13R1.463 CCOC(=O)C1CCCCCN1C Amb28126421 [1,0,0,1,0,0|1,0,0]=3 414 B13R1.463 CCOC(=O)C1CCCCNC1C Amb27415710 [1,0,0,1,0,0|1,0,0]=3 415 B13R1.463 CCOC(=O)C1CCNCCC1N Amb33166119 [1,0,0,1,0,0|2,0,0]=4 416 B13R1.463 CCOC(=O)C1CCOCCC1O Amb28188179 [1,0,0,1,0,0|2,0,0]=4 417 B13R1.463 CCOC(=O)N1CCCCCC1C Amb28366124 [1,0,0,1,0,0|1,0,0]=3 418 B13R1.463 CCOC(=O)N1CCCNCC1C Amb17578442 [1,0,0,1,0,0|2,0,0]=4 419 B13R1.463 CCOC(=O)N1CCCOCC1C Amb27449008 [1,0,0,1,0,0|2,0,0]=4 420 B13R1.463 CCOC(=O)N1CCOCCC1C Amb27651218 [1,0,0,1,0,0|2,0,0]=4 421 B13R1.463 CCOC(=O)[C@@H]1CCCCC[C@@H]1N Amb33739710 [1,0,0,1,0,0|1,0,0]=3 422 B13R1.463 CCOC(=O)[C@H]1CCCCC[C@@H]1N Amb28457466 [1,0,0,1,0,0|1,0,0]=3 423 B13R1.464 CCC1CCCCC1C(=O)NOC Amb27823966 [1,0,0,1,0,0|2,0,0]=4 424 B13R1.464 CCNC(=O)C1CCCCC1CC Amb27794652 [1,0,0,1,0,0|1,0,0]=3 425 B13R1.464 CCNC(=O)C1CCCCC1CO Amb17335768 [1,0,0,1,0,0|2,0,0]=4 426 B13R1.464 CCOC(=O)C1CCCCC1CN Amb32652813 [1,0,0,1,0,0|1,0,0]=3 427 B13R1.464 CCOC(=O)C1CCCCC1CN Amb32652814 [1,0,0,1,0,0|1,0,0]=3 428 B13R1.464 CCOC(=O)C1CCCNC1CC Amb33275593 [1,0,0,1,0,0|1,0,0]=3 429 B13R1.464 CCOC(=O)C1CCNCC1OC Amb33804713 [1,0,0,1,0,0|2,0,0]=4 430 B13R1.464 CCOC(=O)N1CCCCC1CO Amb5721750 [1,0,0,1,0,0|2,0,0]=4 431 B13R1.464 CCOC(=O)[C@@H]1CCCC[C@@H]1CN Amb32645975 [1,0,0,1,0,0|1,0,0]=3 432 B13R1.464 CCOC(=O)[C@@H]1CCCC[C@@H]1CN Amb32653117 [1,0,0,1,0,0|1,0,0]=3 433 B13R1.464 CCOC(=O)[C@H]1CCCC[C@H]1CN Amb35745842 [1,0,0,1,0,0|1,0,0]=3 434 B13R1.464 CCOC(=O)[C@H]1CCCC[C@H]1CN Amb35745848 [1,0,0,1,0,0|1,0,0]=3 435 B13R1.464 [C-]#[N+][C@@H]1CCCC[C@H]1C(=O)OCC Amb25046313 [1,0,0,1,0,0|1,0,1]=4 436 B13R1.470 CC1CCCCC1NC(=O)OCCl Amb35609213 [1,0,0,1,0,0|2,0,0]=4 437 B13R1.470 CCCC(=O)NC1CCCCC1C Amb13958262 [1,0,0,1,0,0|2,0,0]=4 438 B13R1.470 CCNC(=O)CC1CCCCN1C Amb27649977 [1,0,0,1,0,0|2,0,0]=4 439 B13R1.470 CCOC(=O)CC1CCCCC1=O Amb10844666 [1,0,0,1,0,0|1,0,1]=4 440 B13R1.470 CCOC(=O)CC1CCCCC1N Amb33042724 [1,0,0,1,0,0|1,0,0]=3 441 B13R1.470 CCOC(=O)CC1CCCNC1C Amb33745024 [1,0,0,1,0,0|1,0,0]=3 442 B13R1.470 CCOC(=O)CC1CCNCC1C Amb23439503 [1,0,0,1,0,0|1,0,0]=3 443 B13R1.470 CCOC(=O)CC1CCNCC1C Amb32412884 [1,0,0,1,0,0|1,0,0]=3 444 B13R1.470 CCOC(=O)CC1CNCCC1C Amb33746513 [1,0,0,1,0,0|1,0,0]=3 445 B13R1.470 CCOC(=O)CC1CNCCC1N Amb32863517 [1,0,0,1,0,0|2,0,0]=4 446 B13R1.470 CCOC(=O)CC1COCCC1N Amb33230256 [1,0,0,1,0,0|2,0,0]=4 447 B13R1.470 CCOC(=O)CC1CSCCC1N Amb32863518 [1,0,0,1,0,0|2,0,0]=4 448 B13R1.470 CCOC(=O)CN1CCCCC1C Amb7761441 [1,0,0,1,0,0|1,0,0]=3 449 B13R1.470 CCOC(=O)C[C@@H]1CCCC[C@@H]1N Amb32697921 [1,0,0,1,0,0|1,0,0]=3 450 B13R1.470 CCOC(=O)NC1CCNCC1C Amb27950339 [1,0,0,1,0,0|2,0,0]=4 451 B13R1.470 CCOC(=O)N[C@@H]1CCCC[C@@H]1O Amb27969103 [1,0,0,1,0,0|2,0,0]=4 452 B13R1.470 CCOC(=O)N[C@@H]1CCCC[C@H]1Cl Amb28053591 [1,0,0,1,0,0|2,0,0]=4 453 B13R1.470 CCOC(=O)N[C@@H]1CCCC[C@H]1O Amb27446899 [1,0,0,1,0,0|2,0,0]=4 454 B13R1.470 CCOC(=O)N[C@@H]1CCCN[C@@H]1C Amb28145048 [1,0,0,1,0,0|2,0,0]=4 455 B13R1.470 CCOC(=O)N[C@H]1CCCC[C@@H]1F Amb28073065 [1,0,0,1,0,0|2,0,0]=4 456 B13R1.470 CCOC(=O)N[C@H]1CCCC[C@H]1O Amb27645595 [1,0,0,1,0,0|2,0,0]=4 457 B13R1.470 CCOC(=O)\C=C1\CCCCC1C Amb33493086 [1,0,0,1,0,0|0,0,2]=4 458 B13R1.654 CCCCCCCC1CCCC1=O Amb533700 [1,0,0,1,0,0|1,0,0]=3 459 B13R1.1464 CCCC(=O)N1CCCCCCC1 Amb2125376 [1,0,0,1,0,0|2,0,0]=4 460 B13R1.1464 CCOC(=N)C1CCCCCCC1 Amb27765871 [1,0,0,1,0,0|1,0,0]=3 461 B13R1.1464 CCOC(=O)C1=CCCCCCC1 Amb27217937 [1,0,0,1,0,0|0,0,2]=4 462 B13R1.1464 CCOC(=O)C1CCCCCCC1 Amb25063758 [1,0,0,1,0,0|0,0,0]=2 463 B13R1.1464 CCOC(=O)C1CCCCCCN1 Amb25104056 [1,0,0,1,0,0|1,0,0]=3 464 B13R1.1464 O=C(OCCl)N1CCCCCCC1 Amb35644944 [1,0,0,1,0,0|2,0,0]=4 465 B13R1.1575 CCNC(=O)CC1CCCNCC1 Amb27828715 [1,0,0,1,0,0|2,0,0]=4 466 B13R1.1575 CCNC(=O)NC1CCCCCC1 Amb27765440 [1,0,0,1,0,0|2,0,0]=4 467 B13R1.1575 CCOC(=O)C=C1CCCCCC1 Amb2686625 [1,0,0,1,0,0|0,0,2]=4 468 B13R1.1575 CCOC(=O)CC1CCCCCC1 Amb10807917 [1,0,0,1,0,0|0,0,0]=2 469 B13R1.1575 CCOC(=O)CC1CCCCCN1 Amb22498856 [1,0,0,1,0,0|1,0,0]=3 470 B13R1.1575 CCOC(=O)CC1CCCNCC1 Amb33744604 [1,0,0,1,0,0|1,0,0]=3 471 B13R1.1575 CCOC(=O)CC1CCCOCC1 Amb33068691 [1,0,0,1,0,0|1,0,0]=3 472 B13R1.1575 CCOC(=O)CN1CCCCCC1 Amb7760714 [1,0,0,1,0,0|1,0,0]=3 473 B13R1.1575 CCOC(=O)CN1CCCNCC1 Amb1121184 [1,0,0,1,0,0|2,0,0]=4 474 B13R1.1575 CCOC(=O)CN1CCCNCC1 Amb6892557 [1,0,0,1,0,0|2,0,0]=4 475 B13R1.1575 CCOC(=O)NC1CCCCCC1 Amb6874631 [1,0,0,1,0,0|1,0,0]=3 476 B13R1.1575 CCOC(=O)NC1CCCNCC1 Amb27207941 [1,0,0,1,0,0|2,0,0]=4 477 B13R1.1575 CCOC(=O)NC1CCCSCC1 Amb35691529 [1,0,0,1,0,0|2,0,0]=4 478 B13R1.1575 O=C(NC1CCCCCC1)OCCl Amb35644945 [1,0,0,1,0,0|2,0,0]=4 479 B13R1.2851 CCCCOC1CC1C(=O)OCC Amb9677551 [1,0,0,1,0,0|1,0,0]=3 480 B13R1.28 CCCCCCCC1CCCCC1 Amb21618900 [1,0,0,1,0,0|1,0,1]=4 481 B13R1.28 CCCCCCCN1CC=CCC1 Amb32428387 [1,0,0,1,0,0|2,0,0]=4 482 B13R1.28 CCCCCCNC1CCOCC1 Amb9472538 [1,0,0,1,0,0|1,0,1]=4 483 B13R1.28 CCCCCNCC1CCOCC1 Amb19069643 [1,0,0,1,0,0|1,0,1]=4 484 B13R1.225 CCNC1CCCCCC1OCC Amb17606044 [1,0,0,1,0,0|1,0,1]=4 485 B13R1.555 CCOCCNC1CCCCC1C Amb9241047 [1,0,0,1,0,0|1,0,1]=4 486 B13R1.659 CCCCCCCCCNC1CC1 Amb7794379 [1,0,0,1,0,0|2,0,0]=4 487 B13R1.1150 CCO\N=C\C1CCCCCCC1 Amb27458750 [1,0,0,1,0,0|1,0,1]=4 488 B13R1.1150 OC\C=C\CC1CCCCCCC1 Amb28350280 [1,0,0,1,0,0|2,0,0]=4 489 B13R1.1887 CCOCCNC1CCCCCC1 Amb9241032 [1,0,0,1,0,0|1,0,1]=4 490 B13R1.2883 C1CCCCCCNCCCCC1 Amb6360407 [1,0,0,1,0,0|1,0,1]=4 491 B13R1.9 CCCCCCC1CCC(=O)CC1 Amb33718611 [1,0,0,1,0,0|0,0,0]=2 492 B13R1.9 CCCCCCN1CCC(=O)CC1 Amb6384594 [1,0,0,1,0,0|1,0,0]=3 493 B13R1.91 CCC(=O)NC1CCCCC1CO Amb27247164 [1,0,0,1,0,0|2,0,0]=4 494 B13R1.91 CCC(=O)NC1CNCCC1CC Amb32677483 [1,0,0,1,0,0|2,0,0]=4 495 B13R1.91 CCC(=O)N[C@@H]1CCCC[C@H]1CO Amb27588671 [1,0,0,1,0,0|2,0,0]=4 496 B13R1.91 CCC1CCCCC1NC(=O)CBr Amb27179056 [1,0,0,1,0,0|2,0,0]=4 497 B13R1.91 CCC1CCCCC1NC(=O)CS Amb27858203 [1,0,0,1,0,0|2,0,0]=4 498 B13R1.91 CCC1CCCCC1NC(=O)NC Amb27225632 [1,0,0,1,0,0|2,0,0]=4 499 B13R1.91 CCC1CCCC\C1=C/C(=O)OC Amb27803102 [1,0,0,1,0,0|0,0,2]=4 500 B13R1.91 CCC1CCCC\C1=C\C(=O)OC Amb33468675 [1,0,0,1,0,0|0,0,2]=4 501 B13R1.382 CCC(=O)N1CCCCC1CCBr Amb17103918 [1,0,0,1,0,0|2,0,0]=4 502 B13R1.382 CCC(=O)N1CCCCC1CCCl Amb17103645 [1,0,0,1,0,0|2,0,0]=4 503 B13R1.382 CCC(=O)N1CCCCC1CCN Amb17046293 [1,0,0,1,0,0|2,0,0]=4 504 B13R1.382 CCC(=O)N1CCCCC1CCO Amb5797481 [1,0,0,1,0,0|2,0,0]=4 505 B13R1.382 CCCC1CCCCN1C(=O)NC Amb27415066 [1,0,0,1,0,0|2,0,0]=4 506 B13R1.487 CCCC[C@H]1CCCC[C@H](O)CC1 Amb28345404 [1,0,0,1,0,0|0,0,2]=4 507 B13R1.527 C=C(CC)CC1CCCCCC1N Amb27664612 [1,0,0,1,0,0|2,0,0]=4 508 B13R1.527 C=C(CC)CC1CCCCCC1O Amb25731638 [1,0,0,1,0,0|2,0,0]=4 509 B13R1.527 C=C(CC)C[C@@H]1CCCCC[C@H]1O Amb32945252 [1,0,0,1,0,0|2,0,0]=4 510 B13R1.527 CC1CCCCCC1NC(=O)CCl Amb27181116 [1,0,0,1,0,0|2,0,0]=4 511 B13R1.527 CC1CCCCCC1NC(=O)CN Amb28397086 [1,0,0,1,0,0|2,0,0]=4 512 B13R1.527 CNC(=O)CN1CCCCCC1C Amb27823783 [1,0,0,1,0,0|2,0,0]=4 513 B13R1.527 COC(=O)CC1CCCCCC1=O Amb25134202 [1,0,0,1,0,0|1,0,1]=4 514 B13R1.527 COC(=O)CC1CCCCCC1N Amb32861898 [1,0,0,1,0,0|1,0,0]=3 515 B13R1.527 COC(=O)CN1CCSCCC1C Amb27396675 [1,0,0,1,0,0|2,0,0]=4 516 B13R1.527 COC(=O)NC1CCCCCC1O Amb27810523 [1,0,0,1,0,0|2,0,0]=4 517 B13R1.527 COC(=O)\C=C1\CCCCCC1C Amb35721700 [1,0,0,1,0,0|0,0,2]=4 518 B13R1.528 CCC(=O)NCC1CCCCC1O Amb28321161 [1,0,0,1,0,0|2,0,0]=4 519 B13R1.528 CCC(=O)NCC1CCNCC1C Amb26353363 [1,0,0,1,0,0|2,0,0]=4 520 B13R1.528 CNC(=O)CCC1CCCCC1N Amb27859013 [1,0,0,1,0,0|2,0,0]=4 521 B13R1.528 CNC(=O)COC1CCCCC1C Amb25883056 [1,0,0,1,0,0|2,0,0]=4 522 B13R1.528 COC(=O)CCC1CCCCC1=O Amb576431 [1,0,0,1,0,0|1,0,1]=4 523 B13R1.528 COC(=O)CCC1CCCCC1N Amb33726906 [1,0,0,1,0,0|1,0,0]=3 524 B13R1.528 COC(=O)CCC1CCNCC1C Amb33747347 [1,0,0,1,0,0|1,0,0]=3 525 B13R1.528 COC(=O)CCN1CCCCC1C Amb7755661 [1,0,0,1,0,0|1,0,0]=3 526 B13R1.528 COC(=O)CCN1CCNCC1C Amb19028082 [1,0,0,1,0,0|2,0,0]=4 527 B13R1.528 COC(=O)CCN1CCNCC1C Amb33291370 [1,0,0,1,0,0|2,0,0]=4 528 B13R1.528 COC(=O)COC1CCCCC1C Amb9206376 [1,0,0,1,0,0|1,0,0]=3 529 B13R1.528 COC(=O)NCC1CCCCC1C Amb28351017 [1,0,0,1,0,0|1,0,0]=3 530 B13R1.528 COC(=O)NCC1CCCCN1C Amb27415034 [1,0,0,1,0,0|2,0,0]=4 531 B13R1.528 COC(=O)NCC1CCOCC1C Amb27599129 [1,0,0,1,0,0|2,0,0]=4 532 B13R1.528 COC(=O)NCC1NCCCC1C Amb27394523 [1,0,0,1,0,0|2,0,0]=4 533 B13R1.536 COC(=O)CCNCC1CCCO1 Amb9024181 [1,0,0,1,0,0|2,0,0]=4 534 B13R1.536 COC(=O)CCOCC1CCNC1 Amb21957248 [1,0,0,1,0,0|2,0,0]=4 535 B13R1.536 COC(=O)CCSCC1CCCN1 Amb22395581 [1,0,0,1,0,0|2,0,0]=4 536 B13R1.536 COC(=O)CCSCC1CCCN1 Amb35746836 [1,0,0,1,0,0|2,0,0]=4 537 B13R1.539 COC(=O)CCCCOC1CNC1 Amb32941602 [1,0,0,1,0,0|2,0,0]=4 538 B13R1.546 CCS(=O)C1CCCCCCC1N Amb27446435 [1,0,0,1,0,0|2,0,0]=4 539 B13R1.546 COC(=O)C1CCCCCCC1=O Amb22270247 [1,0,0,1,0,0|1,0,1]=4 540 B13R1.546 COC(=O)C1CCCCCCC1N Amb20668749 [1,0,0,1,0,0|1,0,0]=3 541 B13R1.546 COC(=O)C1CCCCCCC1N Amb25114777 [1,0,0,1,0,0|1,0,0]=3 542 B13R1.546 COC(=O)C1CCCCCC[C@@H]1O Amb27593953 [1,0,0,1,0,0|1,0,0]=3 543 B13R1.546 COC(=O)[C@@H]1CCCCCC[C@@H]1N Amb25932755 [1,0,0,1,0,0|1,0,0]=3 544 B13R1.546 COC(=O)[C@@H]1CCCCCC[C@@H]1N Amb32651799 [1,0,0,1,0,0|1,0,0]=3 545 B13R1.599 CCC(=O)NCC[C@@H]1CNC[C@H]1C Amb32696186 [1,0,0,1,0,0|2,0,0]=4 546 B13R1.611 CCC(=O)C1CCCCCC1CC Amb35725694 [1,0,0,1,0,0|0,0,0]=2 547 B13R1.611 CCC(=O)N1CCCCCC1CN Amb27483627 [1,0,0,1,0,0|2,0,0]=4 548 B13R1.611 CCC(Br)C1CCCCCC1CC Amb35721292 [1,0,0,1,0,0|1,0,1]=4 549 B13R1.611 CCC(Cl)C1CCCCCC1CC Amb35721291 [1,0,0,1,0,0|1,0,1]=4 550 B13R1.611 CCC(N)C1CCCCCC1CC Amb35671755 [1,0,0,1,0,0|1,0,1]=4 551 B13R1.611 CCC(O)C1CCCCCC1CC Amb35672752 [1,0,0,1,0,0|0,0,2]=4 552 B13R1.611 CCN1CCCCCC1C(=O)OC Amb27823899 [1,0,0,1,0,0|1,0,0]=3 553 B13R1.611 CCN1CCCNCC1C(=O)OC Amb28132094 [1,0,0,1,0,0|2,0,0]=4 554 B13R1.611 CCS(=O)C1CCCCCC1CN Amb28398663 [1,0,0,1,0,0|2,0,0]=4 555 B13R1.611 CCS(=O)C1CCCCCC1NC Amb27215296 [1,0,0,1,0,0|2,0,0]=4 556 B13R1.611 CNC1CCCCCC1C(=O)OC Amb28282320 [1,0,0,1,0,0|1,0,0]=3 557 B13R1.611 COC(=O)N1CCCCCC1CO Amb27415029 [1,0,0,1,0,0|2,0,0]=4 558 B13R1.718 COC(=O)C#CCC1CCCCC1 Amb27798236 [1,0,0,1,0,0|0,0,2]=4 559 B13R1.718 COC(=O)CCCC1CCCCN1 Amb33746927 [1,0,0,1,0,0|1,0,0]=3 560 B13R1.718 COC(=O)CCCN1CCCCC1 Amb22235542 [1,0,0,1,0,0|1,0,0]=3 561 B13R1.718 COC(=O)CCCN1CCCCC1 Amb8455430 [1,0,0,1,0,0|1,0,0]=3 562 B13R1.718 COC(=O)CCCN1CCNCC1 Amb8960799 [1,0,0,1,0,0|2,0,0]=4 563 B13R1.718 COC(=O)CCCN1CCOCC1 Amb8455435 [1,0,0,1,0,0|2,0,0]=4 564 B13R1.718 COC(=O)CCNC1CCCCC1 Amb9203454 [1,0,0,1,0,0|1,0,0]=3 565 B13R1.718 COC(=O)CCNC1CCOCC1 Amb9472630 [1,0,0,1,0,0|2,0,0]=4 566 B13R1.718 COC(=O)CCOC1CCCCC1 Amb9206350 [1,0,0,1,0,0|1,0,0]=3 567 B13R1.718 COC(=O)CCOC1CCNCC1 Amb21957742 [1,0,0,1,0,0|2,0,0]=4 568 B13R1.718 COC(=O)CCOC1CCNCC1 Amb31297732 [1,0,0,1,0,0|2,0,0]=4 569 B13R1.718 COC(=O)CCSC1CCNCC1 Amb22395536 [1,0,0,1,0,0|2,0,0]=4 570 B13R1.718 COC(=O)CCSC1CCNCC1 Amb35745554 [1,0,0,1,0,0|2,0,0]=4 571 B13R1.718 COC(=O)COCC1CCCNC1 Amb32645722 [1,0,0,1,0,0|2,0,0]=4 572 B13R1.718 COC(=O)COCC1CCCNC1 Amb33330197 [1,0,0,1,0,0|2,0,0]=4 573 B13R1.718 COC(=O)COCC1CCNCC1 Amb35749673 [1,0,0,1,0,0|2,0,0]=4 574 B13R1.718 COC(=O)COCC1CCNCC1 Amb35751379 [1,0,0,1,0,0|2,0,0]=4 575 B13R1.718 COC(=O)CSCC1CCCCN1 Amb22395629 [1,0,0,1,0,0|2,0,0]=4 576 B13R1.718 COC(=O)CSCC1CCCNC1 Amb22395608 [1,0,0,1,0,0|2,0,0]=4 577 B13R1.718 COC(=O)CSCC1CCNCC1 Amb22395592 [1,0,0,1,0,0|2,0,0]=4 578 B13R1.718 COC(=O)NCCC1CCCCN1 Amb6668912 [1,0,0,1,0,0|2,0,0]=4 579 B13R1.718 O=C(CBr)NCCC1CCCCC1 Amb17330356 [1,0,0,1,0,0|2,0,0]=4 580 B13R1.718 O=C(CCl)NCCC1CCCCC1 Amb17325960 [1,0,0,1,0,0|2,0,0]=4 581 B13R1.1689 COC(=O)C1CCCCCNCC1 Amb28141756 [1,0,0,1,0,0|1,0,0]=3 582 B13R1.1711 CCC(=O)NCC1CCCCCC1 Amb28193192 [1,0,0,1,0,0|1,0,0]=3 583 B13R1.1711 CCC(=O)NCC1CCCCCN1 Amb33038742 [1,0,0,1,0,0|2,0,0]=4 584 B13R1.1711 CCC(=O)NCC1CCCCNC1 Amb25926481 [1,0,0,1,0,0|2,0,0]=4 585 B13R1.1711 CCC(=O)NCC1CCCSCC1 Amb29884315 [1,0,0,1,0,0|2,0,0]=4 586 B13R1.1711 COC(=O)C#CC1CCCCCC1 Amb25278204 [1,0,0,1,0,0|0,0,2]=4 587 B13R1.1711 COC(=O)CCN1CCCCCC1 Amb843107 [1,0,0,1,0,0|1,0,0]=3 588 B13R1.1711 COC(=O)NCC1CCCCNC1 Amb27828396 [1,0,0,1,0,0|2,0,0]=4 589 B13R1.1711 COC(=O)NCC1CCCSCC1 Amb30030719 [1,0,0,1,0,0|2,0,0]=4 590 B13R1.1711 O=C(CBr)NCC1CCCCCC1 Amb28286509 [1,0,0,1,0,0|2,0,0]=4 591 B13R1.1711 O=C(CS)NCC1CCCCCC1 Amb28067183 [1,0,0,1,0,0|2,0,0]=4 592 B13R1.1870 CCC(=N)NC1CCCCCCC1 Amb28054013 [1,0,0,1,0,0|2,0,0]=4 593 B13R1.1870 CCC(=O)CN1CCCCCCC1 Amb19074506 [1,0,0,1,0,0|1,0,0]=3 594 B13R1.1870 CCC(=O)NC1CCCCCCC1 Amb5797475 [1,0,0,1,0,0|1,0,0]=3 595 B13R1.1870 CCC(=O)NC1CCCCCNC1 Amb32659971 [1,0,0,1,0,0|2,0,0]=4 596 B13R1.1870 CCC(=O)OC1CCCCCCC1 Amb27605036 [1,0,0,1,0,0|1,0,0]=3 597 B13R1.1870 CCN(C)CC1CCCCCCC1 Amb28400662 [1,0,0,1,0,0|2,0,0]=4 598 B13R1.1870 CNC(=O)NC1CCCCCCC1 Amb27793309 [1,0,0,1,0,0|2,0,0]=4 599 B13R1.1870 COC(=O)C=C1CCCCCCC1 Amb25180453 [1,0,0,1,0,0|0,0,2]=4 600 B13R1.1870 COC(=O)CC1CCCCCCN1 Amb33356231 [1,0,0,1,0,0|1,0,0]=3 601 B13R1.1870 COC(=O)CN1CCCCCCC1 Amb7761444 [1,0,0,1,0,0|1,0,0]=3 602 B13R1.1870 COC(=O)NC1CCCCCCC1 Amb17739564 [1,0,0,1,0,0|1,0,0]=3 603 B13R1.1870 COC(=O)OC1CCCCCCC1 Amb25782061 [1,0,0,1,0,0|1,0,0]=3 604 B13R1.1870 O=C(CBr)NC1CCCCCCC1 Amb27480675 [1,0,0,1,0,0|2,0,0]=4 605 B13R1.1870 O=C(CCl)NC1CCCCCCC1 Amb1150245 [1,0,0,1,0,0|2,0,0]=4 606 B13R1.1870 O=C(CO)NC1CCCCCCC1 Amb5798096 [1,0,0,1,0,0|2,0,0]=4 607 B13R1.1870 O=C(CO)OC1CCCCCCC1 Amb28249413 [1,0,0,1,0,0|2,0,0]=4 608 B13R1.1917 CCCCN1CCCNC(=O)C1C Amb28138332 [1,0,0,1,0,0|2,0,0]=4 609 B13R1.3819 CC1C(=O)OCCCCCCC1O Amb27661174 [1,0,0,1,0,0|2,0,0]=4 610 B15R1.795 CCOC(=O)CCNCCN1CCCC1 Amb20673278 [0,1,0,1,0,0|1,0,0]=3 611 B15R1.9453 CCCN1CCCC(CC(=O)OCC)C1 Amb32425817 [0,1,0,1,0,0|1,0,0]=3 612 B15R1.10572 CCOC(=O)CCCCCC(=O)C1CC1 Amb6305799 [0,1,0,1,0,0|0,0,1]=3 613 B15R1.1264 CCOC(=O)CCCCCOC1CNC1 Amb32941225 [0,1,0,1,0,0|1,0,0]=3 614 B15R1.809 CCOC(=O)CC(=O)CC1CCCCC1 Amb20673091 [0,1,0,1,0,0|0,0,1]=3 615 B15R1.809 CCOC(=O)C[C@H](N)CC1CCCCC1 Amb33804118 [0,1,0,1,0,0|0,0,0]=2 616 B15R1.1284 CCOC(=O)CC(=O)CCC1CCCC1 Amb8386783 [0,1,0,1,0,0|0,0,1]=3 617 B15R1.2593 CCOC(=O)CC1(O)CCCCCCC1 Amb33097480 [0,1,0,1,0,0|0,0,0]=2 618 B15R1.5906 CCCCCCCC(=O)C1CCCC1=O Amb33291211 [0,1,0,1,0,0|1,0,1]=4 619 B15R1.11888 CCCCCCCC(=O)CC(=O)C1CC1 Amb9210323 [0,1,0,1,0,0|1,0,1]=4 620 B15R1.16078 CCOC(=O)CC(N)C1CCCCCC1 Amb32795409 [0,1,0,1,0,0|0,0,0]=2 621 B15R1.826 CCOC(=O)[C@@H](N)CCC1CCCCC1 Amb16230921 [0,1,0,1,0,0|0,0,0]=2 622 B15R1.826 CCOC(=O)[C@H](N)CCC1CCCCC1 Amb33868463 [0,1,0,1,0,0|0,0,0]=2 623 B15R1.1039 CCOC(=O)C1CCCN(CCCN)C1 Amb13882873 [0,1,0,1,0,0|2,0,0]=4 624 B15R1.3953 CCOC(=O)\C(C)=C1/CCCCCC1C Amb35721705 [0,1,0,1,0,0|0,0,2]=4 625 B15R1.3954 CCOC(=O)C(=O)N1CCCCC1CC Amb22893463 [0,1,0,1,0,0|1,0,1]=4 626 B15R1.16791 CCOC(=O)C(=O)N1CCCCCCC1 Amb16187000 [0,1,0,1,0,0|1,0,1]=4 627 B15R1.16791 CCOC(=O)C(O)C1=CCCCCCC1 Amb33097495 [0,1,0,1,0,0|0,0,2]=4 628 B15R1.16898 CCOC(=O)C(=O)CC1CCCCCN1 Amb33291481 [0,1,0,1,0,0|1,0,1]=4 629 B15R1.16898 CCOC(=O)C(=O)NC1CCCCCC1 Amb6348091 [0,1,0,1,0,0|1,0,1]=4 630 B15R1.16898 CCOC(=O)[C@@H](N)CC1CCCCCC1 Amb33739253 [0,1,0,1,0,0|0,0,0]=2 631 B15R1.35 CCCCCCCCCC1=NCCCC1 Amb33510228 [0,1,0,1,0,0|2,0,0]=4 632 B15R1.778 CCOC(=O)CCCCC1CCNCC1 Amb33804398 [0,1,0,1,0,0|0,0,0]=2 633 B15R1.832 CCCCC1CC1CCCC(=O)OCC Amb1946108 [0,1,0,1,0,0|0,0,0]=2 634 B15R1.1252 CCCC(=O)NCCC1CCCCC1O Amb33229039 [0,1,0,1,0,0|2,0,0]=4 635 B15R1.1252 CCOC(=O)CCNC1CCCCC1C Amb9024103 [0,1,0,1,0,0|0,0,0]=2 636 B15R1.1252 CCOC(=O)\C=C\CN1CCCCC1C Amb33228340 [0,1,0,1,0,0|0,0,2]=4 637 B15R1.10422 CCOC(=O)CCCCC(=O)C1CCC1 Amb6305794 [0,1,0,1,0,0|0,0,1]=3 638 B15R1.2966 CCC(C)C(=O)CC1CCCCCCN1 Amb33355541 [0,1,0,1,0,0|2,0,0]=4 639 B15R1.24982 CCCCCCN1CCC(=O)C(=O)CC1 Amb32642046 [0,1,0,1,0,0|2,0,0]=4 640 B15R1.89 CCNC(=O)NCC(N)C1CCCCC1 Amb32715675 [0,1,0,1,0,0|2,0,0]=4 641 B15R1.89 CCOC(=O)CCC(=O)C1CCCCC1 Amb6305782 [0,1,0,1,0,0|0,0,1]=3 642 B15R1.1273 CCOC(=O)CC1CCCCCCC1N Amb32863516 [0,1,0,1,0,0|0,0,0]=2 643 B15R1.1273 CCOC(=O)C[C@@H]1CCCCCC[C@@H]1N Amb33192979 [0,1,0,1,0,0|0,0,0]=2 644 B15R1.5618 CCCC1CCC(=O)CC1C(=O)OCC Amb32867803 [0,1,0,1,0,0|0,0,1]=3 645 B15R1.10468 CCOC(=O)CCC(O)COC1CNC1 Amb32941528 [0,1,0,1,0,0|2,0,0]=4 646 B15R1.25068 CCCCCCC1(C)OC1C(=O)OCC Amb32698855 [0,1,0,1,0,0|1,0,0]=3 647 B15R1.254 CC(C)OC(=O)NCCC1CCCN1C Amb33339241 [0,1,0,1,0,0|2,0,0]=4 648 B15R1.106 CCCCCCCCC1CCCC(=O)O1 Amb22732769 [0,1,0,1,0,0|1,0,0]=3 649 B15R1.106 N#CCCCCCCC1CCCC(=O)C1 Amb6302011 [0,1,0,1,0,0|1,0,1]=4 650 B15R1.843 CCCCC1NCCCC1C(=O)OCC Amb33500850 [0,1,0,1,0,0|0,0,0]=2 651 B15R1.1251 CCOC(=O)CCN1CCCCCC1=O Amb8867905 [0,1,0,1,0,0|1,0,1]=4 652 B15R1.2461 CCOC(=O)CCNC1CCCCCC1 Amb9024251 [0,1,0,1,0,0|0,0,0]=2 653 B15R1.3880 CCOC(=O)CC1CCOCC1OCC Amb32671143 [0,1,0,1,0,0|1,0,0]=3 654 B15R1.810 CCOC(=O)C1CCCNC1CC(C)C Amb33500963 [0,1,0,1,0,0|1,0,0]=3 655 B15R1.810 CCOC(=O)N1CCNCC1CC(C)C Amb17579611 [0,1,0,1,0,0|2,0,0]=4 656 B15R1.810 CCOC(=O)[C@@H]1CCCCN1CC(F)F Amb31308338 [0,1,0,1,0,0|2,0,0]=4 657 B15R1.157 O=C(CCCCl)NCCC1CCCCC1 Amb17325182 [0,1,0,1,0,0|2,0,0]=4 658 B15R1.1208 CC1CCCCN1CCC(=O)NCCN Amb20573322 [0,1,0,1,0,0|2,0,0]=4 659 B15R1.2207 NCCNC(=O)CCN1CCCCCC1 Amb20573358 [0,1,0,1,0,0|2,0,0]=4 660 B15R1.794 CCOC(=O)CCCC(=O)C1CCCC1 Amb6305788 [0,1,0,1,0,0|0,0,1]=3 661 B15R1.9231 CCCC1CC(=O)CCC1C(=O)OCC Amb33039966 [0,1,0,1,0,0|0,0,1]=3 662 B15R1.36731 CCOC(=O)CCN1C(C)CCCC1C Amb9026444 [0,1,0,1,0,0|1,0,0]=3 663 B15R2.31 O=C1CCCC(CN2CCCCC2)C1 Amb30013877 [0,0,0,2,0,0|2,0,0]=4 664 B15R2.31 O=C1CCCC(NC2CCCCC2)C1 Amb27437242 [0,0,0,2,0,0|2,0,0]=4 665 B15R2.31 O=C1CCOC(CC2CCCCC2)C1 Amb27830781 [0,0,0,2,0,0|2,0,0]=4 666 B15R2.335 CC1CCCN1CC2CCCC(=O)C2 Amb30013880 [0,0,0,2,0,0|2,0,0]=4 667 B15R2.1117 O=C1CCCC(COC2CCCC2)C1 Amb35695741 [0,0,0,2,0,0|2,0,0]=4 668 B15R2.1117 O=C1CCCC(CSC2CCCC2)C1 Amb35699386 [0,0,0,2,0,0|2,0,0]=4 669 B15R2.1117 O=C1CCCC(SCC2CCCC2)C1 Amb27181496 [0,0,0,2,0,0|2,0,0]=4 670 B15R2.7124 O=C1CCCC(N2CCCCCC2)C1 Amb27780772 [0,0,0,2,0,0|2,0,0]=4 671 B15R2.7124 O=C1CCCN(C2CCCCCC2)C1 Amb10603082 [0,0,0,2,0,0|2,0,0]=4 672 B15R2.11929 CCC[C@@H]1CCC[C@H]2CCNC(=O)[C@@H]21 Amb27469721 [0,0,0,2,0,0|1,0,0]=3 673 B15R2.13221 O=C1C=C2CCCCCCCC(C1)C2 Amb26021707 [0,0,0,2,0,0|1,0,1]=4 674 B15R2.13221 O=C1CC2CCCCCCCC(C1)C2 Amb27864039 [0,0,0,2,0,0|1,0,0]=3 675 B15R2.13221 O=C1C[C@H]2CCCCCCC[C@@H](C1)C2 Amb27483017 [0,0,0,2,0,0|1,0,0]=3 676 B15R2.42191 CC1CCCCCC12CC(=O)CCO2 Amb35734063 [0,0,0,2,0,0|2,0,0]=4 677 B15R2.47611 O=C1CCOC2(CCCCCCC2)C1 Amb27668180 [0,0,0,2,0,0|2,0,0]=4 678 B15R2.123 CCC1CCCCC1NC2=NCCO2 Amb27858989 [0,0,0,2,0,0|2,0,0]=4 679 B15R2.123 CC[C@H]1CCCCC1NC2=NCCO2 Amb28290434 [0,0,0,2,0,0|2,0,0]=4 680 B15R2.123 CC[C@H]1CCCC[C@@H]1NC2=NCCO2 Amb27632012 [0,0,0,2,0,0|2,0,0]=4 681 B15R2.123 CC[C@H]1CCCC[C@H]1NC2=NCCO2 Amb28435708 [0,0,0,2,0,0|2,0,0]=4 682 B15R2.343 C[C@H]1CCCCC[C@@H]1NC2=NCCO2 Amb27790260 [0,0,0,2,0,0|2,0,0]=4 683 B15R2.55 O=C1CCCC1CCC2CCCCC2 Amb27401373 [0,0,0,2,0,0|1,0,0]=3 684 B15R2.55 O=C1CCCC1CCC2CCCCO2 Amb35655048 [0,0,0,2,0,0|2,0,0]=4 685 B15R2.55 O=C1CCCC1CCN2CCCCC2 Amb27747328 [0,0,0,2,0,0|2,0,0]=4 686 B15R2.55 O=C1COCC1CCC2CCCCC2 Amb35608123 [0,0,0,2,0,0|2,0,0]=4 687 B15R2.55 O=C1NCCC1CCC2CCCCO2 Amb35640999 [0,0,0,2,0,0|2,0,0]=4 688 B15R2.55 O=C1NCCC1CCN2CCCCC2 Amb27213539 [0,0,0,2,0,0|2,0,0]=4 689 B15R2.55 O=C1NCCC1COC2CCCCC2 Amb27824672 [0,0,0,2,0,0|2,0,0]=4 690 B15R2.55 O=C1OCCC1NCC2CCCCS2 Amb27973755 [0,0,0,2,0,0|2,0,0]=4 691 B15R2.55 O=C1OCCN1CCN2CCCCC2 Amb35694534 [0,0,0,2,0,0|2,0,0]=4 692 B15R2.55 O=C1OCC[C@@H]1NCC2CCCCC2 Amb27434009 [0,0,0,2,0,0|1,0,0]=3 693 B15R2.359 CC1CCCCC1NC2CCNC2=O Amb28125552 [0,0,0,2,0,0|2,0,0]=4 694 B15R2.359 CC1COCCC1NC2CCOC2=O Amb28189218 [0,0,0,2,0,0|2,0,0]=4 695 B15R2.359 CC1NCCCC1CN2CCOC2=O Amb27477692 [0,0,0,2,0,0|2,0,0]=4 696 B15R2.359 NC1CCCCC1OC2CCOC2=O Amb27205712 [0,0,0,2,0,0|2,0,0]=4 697 B15R2.359 O=C1OCCC1CC2CCCCC2O Amb4055475 [0,0,0,2,0,0|1,0,0]=3 698 B15R2.411 NC1CCCC1CCN2CCOC2=O Amb27747325 [0,0,0,2,0,0|2,0,0]=4 699 B15R2.982 O=C1CCCC1C2CCCCCC2O Amb27475563 [0,0,0,2,0,0|2,0,0]=4 700 B15R2.982 O=C1OCCN1C2CCCCCC2O Amb27658389 [0,0,0,2,0,0|2,0,0]=4 701 B15R2.1321 CCCC1CCCN1C2CCCC2=O Amb27493520 [0,0,0,2,0,0|2,0,0]=4 702 B15R2.1321 CCCN1CCCC1C2CCCC2=O Amb27167241 [0,0,0,2,0,0|2,0,0]=4 703 B15R2.1321 CNCC1CCCN1C2CCOC2=O Amb27958320 [0,0,0,2,0,0|2,0,0]=4 704 B15R2.2302 CCC1CCCCC1C2COCC2=O Amb35608124 [0,0,0,2,0,0|2,0,0]=4 705 B15R2.2302 COC1CCCCC1C2CCNC2=O Amb28388400 [0,0,0,2,0,0|2,0,0]=4 706 B15R2.2302 NCC1CCCCC1N2CCOC2=O Amb9286411 [0,0,0,2,0,0|2,0,0]=4 707 B15R2.2302 O=C1OCCC1N2CCCCC2CO Amb19088894 [0,0,0,2,0,0|2,0,0]=4 708 B15R2.2326 CCC1CCCN1CC2CCCC2=O Amb19064014 [0,0,0,2,0,0|2,0,0]=4 709 B15R2.2326 CSC1CCCC1NC2CCOC2=O Amb27418919 [0,0,0,2,0,0|2,0,0]=4 710 B15R2.8453 O=C1CCCC1C2CCCCCCN2 Amb26024325 [0,0,0,2,0,0|2,0,0]=4 711 B15R2.8453 O=C1NCCN1C2CCCCCCC2 Amb24438219 [0,0,0,2,0,0|2,0,0]=4 712 B15R2.13884 O=C1CCCC1CN2CCCCCC2 Amb19064020 [0,0,0,2,0,0|2,0,0]=4 713 B15R2.13884 O=C1NCCC1NC2CCCCCC2 Amb29862300 [0,0,0,2,0,0|2,0,0]=4 714 B15R2.13884 O=C1NCCN1CC2CCCCCC2 Amb27985063 [0,0,0,2,0,0|2,0,0]=4 715 B15R2.13884 O=C1OCCC1OC2CCCNCC2 Amb29859317 [0,0,0,2,0,0|2,0,0]=4 716 B15R2.658 CCCC1CC1N2CCC(=O)CC2C Amb27225549 [0,0,0,2,0,0|2,0,0]=4 717 B15R2.75059 CCNC(=O)NCC1CCCC2CC12 Amb35655675 [0,0,0,2,0,0|2,0,0]=4 718 B15R2.75059 CCOC(=O)C#CC1CCCC2CC12 Amb33168778 [0,0,0,2,0,0|0,0,2]=4 719 B15R2.17241 CCOC(=O)NC1CCCC2CCC21 Amb27234756 [0,0,0,2,0,0|1,0,0]=3 720 B15R2.17170 CCOC(=O)C1CC2CCN1CC2O Amb28206036 [0,0,0,2,0,0|2,0,0]=4 721 B15R2.17170 CCOC(=O)N1CC2CCC1CC2O Amb25813651 [0,0,0,2,0,0|2,0,0]=4 722 B15R2.17340 CCCC(=O)N1CCCC2CCCC21 Amb27600536 [0,0,0,2,0,0|2,0,0]=4 723 B15R2.17340 CCOC(=O)C1CCCC2OCCC21 Amb23560358 [0,0,0,2,0,0|1,0,0]=3 724 B15R2.17340 CCOC(=O)C1CCNC2CCCC21 Amb33728948 [0,0,0,2,0,0|1,0,0]=3 725 B15R2.17340 CCOC(=O)C1NCCN2CCCC12 Amb33730869 [0,0,0,2,0,0|2,0,0]=4 726 B15R2.17340 CCOC(=O)N1CCCC2COCC21 Amb29872470 [0,0,0,2,0,0|2,0,0]=4 727 B15R2.17340 O=C(OCCl)N1CCCC2CCCC21 Amb30032457 [0,0,0,2,0,0|2,0,0]=4 728 B15R2.74328 CCOC(=O)C12CCCCC1NCC2 Amb33097412 [0,0,0,2,0,0|1,0,0]=3 729 B15R2.74328 CCOC(=O)C12CCCCC1NCC2 Amb33483375 [0,0,0,2,0,0|1,0,0]=3 730 B15R2.74328 CCOC(=O)C12CCCCC1OCC2 Amb32660059 [0,0,0,2,0,0|1,0,0]=3 731 B15R2.74328 CCOC(=O)C12CCNC1CCNC2 Amb27476478 [0,0,0,2,0,0|2,0,0]=4 732 B15R2.74328 CCOC(=O)C12CCNCC1NCC2 Amb27387040 [0,0,0,2,0,0|2,0,0]=4 733 B15R2.74328 CCOC(=O)C12CCOC1CCNC2 Amb27812033 [0,0,0,2,0,0|2,0,0]=4 734 B15R2.74328 CCOC(=O)[C@@]12CCCC[C@@H]1CNC2 Amb33739796 [0,0,0,2,0,0|1,0,0]=3 735 B15R2.74328 CCOC(=O)[C@@]12CCCC[C@@H]1NCC2 Amb33734266 [0,0,0,2,0,0|1,0,0]=3 736 B15R2.74328 CCOC(=O)[C@]12CCCC[C@H]1NCC2 Amb33039560 [0,0,0,2,0,0|1,0,0]=3 737 B15R2.74328 CCOC(=O)[C@]12CNC[C@H]1CCOC2 Amb27258938 [0,0,0,2,0,0|2,0,0]=4 738 B15R2.74328 CCOC(=O)[C@]12CNC[C@H]1CCOC2 Amb33677248 [0,0,0,2,0,0|2,0,0]=4 739 B15R2.74825 CCOC(=O)C1C2CCCC1CNC2 Amb26004917 [0,0,0,2,0,0|1,0,0]=3 740 B15R2.1320 CCCC1COCC12CC(=O)NC2C Amb35635812 [0,0,0,2,0,0|2,0,0]=4 741 B15R2.17397 CCOC(=O)C1C(C)OC2OCCC21 Amb22803068 [0,0,0,2,0,0|2,0,0]=4 742 B15R2.17397 CCOC(=O)C1[C@@H]2CCCN2C[C@@H]1O Amb27213945 [0,0,0,2,0,0|2,0,0]=4 743 B15R2.17457 CCOC(=O)CC1NCC2CCCC21 Amb33356187 [0,0,0,2,0,0|1,0,0]=3 744 B15R2.17457 CCOC(=O)C[C@@H]1NC[C@@H]2CCC[C@H]12 Amb33495962 [0,0,0,2,0,0|1,0,0]=3 745 B15R2.75882 CCOC(=O)CC12CCCN1CCC2 Amb24184012 [0,0,0,2,0,0|1,0,0]=3 746 B15R2.75882 CCOC(=O)NC12CCCC1CNC2 Amb27408981 [0,0,0,2,0,0|2,0,0]=4 747 B15R2.73 CCNC(=O)N1CCC2CCCCC21 Amb27182910 [0,0,0,2,0,0|2,0,0]=4 748 B15R2.73 CCNC(=O)N1CC[C@@H]2CCCC[C@@H]21 Amb27845167 [0,0,0,2,0,0|2,0,0]=4 749 B15R2.73 CCOC(=O)C1CCC2CCCCN21 Amb25138094 [0,0,0,2,0,0|1,0,0]=3 750 B15R2.73 CCOC(=O)C1CCC2NCCOC21 Amb27252116 [0,0,0,2,0,0|2,0,0]=4 751 B15R2.73 CCOC(=O)C1NOC2CCCCC21 Amb33496088 [0,0,0,2,0,0|2,0,0]=4 752 B15R2.73 O=C(OCCl)N1CCC2CCCCC21 Amb30032458 [0,0,0,2,0,0|2,0,0]=4 753 B15R2.73 O=C(OCCl)N1CC[C@@H]2CCCC[C@@H]21 Amb30032347 [0,0,0,2,0,0|2,0,0]=4 754 B15R2.325 O=C1CC(CC2CCCCC2)C(=O)O1 Amb33422127 [0,0,0,2,0,0|1,0,1]=4 755 B15R2.389 O=C1CCC(C2CCCCC2)C(=O)O1 Amb25080150 [0,0,0,2,0,0|1,0,1]=4 756 B15R2.1342 CCNC(=O)C1CC1C2CCNCC2 Amb27762368 [0,0,0,2,0,0|2,0,0]=4 757 B15R2.1342 CCOC(=O)C1CC1C2CCCNC2 Amb33802382 [0,0,0,2,0,0|1,0,0]=3 758 B15R2.1358 CCCC(=O)C1CCC12CCCCC2 Amb29874098 [0,0,0,2,0,0|1,0,0]=3 759 B15R2.1358 CCOC(=O)C1NCC12CCOCC2 Amb33735967 [0,0,0,2,0,0|2,0,0]=4 760 B15R2.1371 CCOC(=O)NC1CC12CCCCC2 Amb27198879 [0,0,0,2,0,0|1,0,0]=3 761 B15R2.1371 CCOC(=O)NC1CC12CCOCC2 Amb27780924 [0,0,0,2,0,0|2,0,0]=4 762 B15R2.1371 O=C(NC1CC12CCCCC2)OCCl Amb35644976 [0,0,0,2,0,0|2,0,0]=4 763 B15R2.3562 CCOC(=O)CC1CN2CCC1CC2 Amb34152600 [0,0,0,2,0,0|1,0,0]=3 764 B15R2.3562 CCOC(=O)NC1CC2CCN1CC2 Amb27411815 [0,0,0,2,0,0|2,0,0]=4 765 B15R2.3562 CCOC(=O)NC1CN2CCC1CC2 Amb24671180 [0,0,0,2,0,0|2,0,0]=4 766 B15R2.3562 C\C=C\C(=O)CC1CC2CCC1CC2 Amb35721837 [0,0,0,2,0,0|1,0,1]=4 767 B15R2.3562 O=C(NC1CC2CCC1CC2)OCCl Amb30032455 [0,0,0,2,0,0|2,0,0]=4 768 B15R2.93174 CCOC(=O)NC1CC2CCCCC21 Amb28068783 [0,0,0,2,0,0|1,0,0]=3 769 B15R2.3554 CCOC(=O)NC1CCC2CCC1O2 Amb27845261 [0,0,0,2,0,0|2,0,0]=4 770 B15R2.3554 CCOC(=O)N[C@@H]1CC[C@H]2CC[C@@H]1C2 Amb28060140 [0,0,0,2,0,0|1,0,0]=3 771 B15R2.3554 CCOC(=O)N[C@H]1CC[C@H]2CC[C@@H]1C2 Amb28074034 [0,0,0,2,0,0|1,0,0]=3 772 B15R2.8603 CC1CCCCCC12CC(=O)NC2C Amb35734088 [0,0,0,2,0,0|1,0,0]=3 773 B15R2.8603 CC1CCCCCC12CC(=O)OC2=O Amb35734040 [0,0,0,2,0,0|1,0,1]=4 774 B15R2.13827 CC1CCCCCC1NC(=O)C2CC2 Amb27873138 [0,0,0,2,0,0|2,0,0]=4 775 B15R2.13827 CC1CCCCCN1CC(=O)C2CC2 Amb27882654 [0,0,0,2,0,0|2,0,0]=4 776 B15R2.557 CC1CCCCC1C2CC(=O)OC2=O Amb33133521 [0,0,0,2,0,0|1,0,1]=4 777 B15R2.1356 CCCC(=O)C1CC2CCCCC2N1 Amb28319537 [0,0,0,2,0,0|2,0,0]=4 778 B15R2.1356 CCOC(=O)C1CC2CCCCC2N1 Amb9203864 [0,0,0,2,0,0|1,0,0]=3 779 B15R2.1356 CCOC(=O)C1CC2CCNCC2O1 Amb28121977 [0,0,0,2,0,0|2,0,0]=4 780 B15R2.1356 CCOC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1 Amb22831730 [0,0,0,2,0,0|1,0,0]=3 781 B15R2.1356 CCOC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1 Amb28196333 [0,0,0,2,0,0|1,0,0]=3 782 B15R2.1356 CCOC(=O)[C@H]1CC2CCCCC2N1 Amb27668989 [0,0,0,2,0,0|1,0,0]=3 783 B15R2.1356 O=C(OCCl)N1CC2CCCCC2C1 Amb30032454 [0,0,0,2,0,0|2,0,0]=4 784 B15R2.1356 O=C(OCCl)N1C[C@H]2CCCC[C@H]2C1 Amb35628891 [0,0,0,2,0,0|2,0,0]=4 785 B15R2.17182 CCOC(=O)C1OC12CCCCC2C Amb25749945 [0,0,0,2,0,0|1,0,0]=3 786 B15R2.17182 CCOC(=O)C1OC12CCOCC2C Amb24382955 [0,0,0,2,0,0|2,0,0]=4 787 B15R2.17246 CCNC(=O)NCC12CCCCC1C2 Amb30010188 [0,0,0,2,0,0|2,0,0]=4 788 B15R2.17289 CCOC(=O)C#CC1CC2CCC1C2 Amb33168645 [0,0,0,2,0,0|0,0,2]=4 789 B15R2.17289 CCOC(=O)CCC1CC2CCC1C2 Amb28653427 [0,0,0,2,0,0|0,0,0]=2 790 B15R2.17289 CCOC(=O)\C=C\C1CC2CCC1C2 Amb33469089 [0,0,0,2,0,0|0,0,2]=4 791 B15R2.17332 CCOC(=O)[C@H]1N[C@@H]2C[C@H]1CC[C@H]2O Amb28052193 [0,0,0,2,0,0|2,0,0]=4 792 B15R2.76 CCCC(=O)C1CCCC12CCCC2 Amb27196581 [0,0,0,2,0,0|1,0,0]=3 793 B15R2.76 CCOC(=O)C1CCCC12CCNC2 Amb25181107 [0,0,0,2,0,0|1,0,0]=3 794 B15R2.76 CCOC(=O)C1CCCC12OCCO2 Amb26590481 [0,0,0,2,0,0|2,0,0]=4 795 B15R2.76 CCOC(=O)C1CNCC12CCCC2 Amb23597882 [0,0,0,2,0,0|1,0,0]=3 796 B15R2.76 CCOC(=O)C1CNCC12CCOC2 Amb24406178 [0,0,0,2,0,0|2,0,0]=4 797 B15R2.76 CCOC(=O)C1CNCC12CCSC2 Amb33468665 [0,0,0,2,0,0|2,0,0]=4 798 B15R2.76 CCOC(=O)N1CCCC12CCCC2 Amb27607007 [0,0,0,2,0,0|1,0,0]=3 799 B15R2.76 O=C(OCCl)N1CCCC12CCCC2 Amb30032456 [0,0,0,2,0,0|2,0,0]=4 800 B15R2.1154 CC1CC(=O)CCN1CC2CCCC2 Amb19052774 [0,0,0,2,0,0|2,0,0]=4 801 B15R2.1154 CC1NC(=O)CCC1NC2CCCC2 Amb28126212 [0,0,0,2,0,0|2,0,0]=4 802 B15R2.1345 CCCC(=O)NC1CCC12CCCC2 Amb30025955 [0,0,0,2,0,0|2,0,0]=4 803 B15R2.1345 CCNC(=O)NC1CCC12CCCC2 Amb35686468 [0,0,0,2,0,0|2,0,0]=4 804 B15R2.1345 CCOC(=O)NC1CCC12CCCC2 Amb35698460 [0,0,0,2,0,0|1,0,0]=3 805 B15R2.1345 O=C(NC1CCC12CCCC2)OCCl Amb30025718 [0,0,0,2,0,0|2,0,0]=4 806 B15R2.5805 CCN1C(=O)CNCC1C2CCCC2 Amb27481062 [0,0,0,2,0,0|2,0,0]=4 807 B15R2.7104 O=C1CC(CCC2CCCC2)C(=O)O1 Amb33380225 [0,0,0,2,0,0|1,0,1]=4 808 B15R2.8679 O=C1CCC(NC2CCCC2)CCN1 Amb28343729 [0,0,0,2,0,0|2,0,0]=4 809 B15R2.7564 CC1CC1CNC2CCC(=O)NC2C Amb28194449 [0,0,0,2,0,0|2,0,0]=4 810 B15R2.17268 CCNC(=O)NCC1CCC2CC2C1 Amb35714813 [0,0,0,2,0,0|2,0,0]=4 811 B15R2.17268 CCOC(=O)C#CC1CCC2CC2C1 Amb33168779 [0,0,0,2,0,0|0,0,2]=4 812 B15R2.43839 CC1CC(=O)CCN1CCC2CCC2 Amb27947360 [0,0,0,2,0,0|2,0,0]=4 813 B15R2.17205 CCOC(=O)C1CC[C@H]2OC[C@@H]1C2N Amb27440418 [0,0,0,2,0,0|2,0,0]=4 814 B15R2.1354 CCOC(=O)N1CC2CCCC2C1C Amb26936871 [0,0,0,2,0,0|1,0,0]=3 815 B15R2.1354 CCOC(=O)N1CC2CCNC2C1C Amb27225822 [0,0,0,2,0,0|2,0,0]=4 816 B15R2.1354 CCOC(=O)N1CC2NCCC2C1C Amb27870680 [0,0,0,2,0,0|2,0,0]=4 817 B15R2.17312 CCOC(=O)C1NCC2C(O)CCC12 Amb24558604 [0,0,0,2,0,0|2,0,0]=4 818 B15R2.17312 CCOC(=O)[C@H]1NC[C@@H]2[C@@H](F)CC[C@H]12 Amb27485885 [0,0,0,2,0,0|2,0,0]=4 819 B15R2.17445 CCOC(=O)N[C@]12CCCC[C@H]1CC2 Amb27662376 [0,0,0,2,0,0|1,0,0]=3 820 B15R2.1939 CCC1CC1CN2CCC(=O)CC2C Amb27245132 [0,0,0,2,0,0|2,0,0]=4 821 B15R2.1939 CC[C@@H]1C[C@H]1CN2CCC(=O)CC2C Amb28066855 [0,0,0,2,0,0|2,0,0]=4 822 B15R2.1350 CCNC(=O)C1CCC2CCNC2C1 Amb27607633 [0,0,0,2,0,0|2,0,0]=4 823 B15R2.1350 CCOC(=O)C1CCC2CCNC2C1 Amb25273690 [0,0,0,2,0,0|1,0,0]=3 824 B15R2.1350 CCOC(=O)N1CCC2COCC2C1 Amb30029158 [0,0,0,2,0,0|2,0,0]=4 825 B15R2.1350 CCOC(=O)N1CCC2NCCC2C1 Amb28069007 [0,0,0,2,0,0|2,0,0]=4 826 B15R2.4352 CCOC(=O)C#CC1CCCC12CC2 Amb33168786 [0,0,0,2,0,0|0,0,2]=4 827 B15R2.17178 CCOC(=O)C1OC12CCCC2CC Amb32698880 [0,0,0,2,0,0|1,0,0]=3 828 B15R2.17178 CCOC(=O)C1OC12CCCC2OC Amb33071056 [0,0,0,2,0,0|2,0,0]=4 829 B15R2.17178 CCOC(=O)C1OC12COCC2CC Amb33071414 [0,0,0,2,0,0|2,0,0]=4 830 B15R2.2148 CCOC(=O)CC1CCCCC12CO2 Amb32882431 [0,0,0,2,0,0|1,0,0]=3 831 B15R2.2148 CCOC(=O)C[C@@H]1CCCC[C@@]12CO2 Amb32653133 [0,0,0,2,0,0|1,0,0]=3 832 B15R2.8667 CC1CCC1NC2CCNC(=O)CC2 Amb28435520 [0,0,0,2,0,0|2,0,0]=4 833 B15R2.2301 CCC1CCCCC12CC(=O)NC2C Amb28144438 [0,0,0,2,0,0|1,0,0]=3 834 B15R2.2301 CCC1CCCCC12CC(=O)OC2=O Amb27244752 [0,0,0,2,0,0|1,0,1]=4 835 B15R2.42260 O=C1CCC2(CCCCCC2)CCN1 Amb28283346 [0,0,0,2,0,0|1,0,0]=3 836 B15R2.9875 O=C1CC2(CCCCCCC2)C(=O)O1 Amb9209619 [0,0,0,2,0,0|1,0,1]=4 837 B15R2.59810 CC1NC(=O)CC1C2CCCCCC2 Amb27211672 [0,0,0,2,0,0|1,0,0]=3 838 B15R2.59810 O=C1CC(C2CCCCCC2)C(=O)O1 Amb33133515 [0,0,0,2,0,0|1,0,1]=4 839 B15R2.74417 CCOC(=O)C1OC12CCCCCC2 Amb25040598 [0,0,0,2,0,0|1,0,0]=3 840 B15R2.74417 CCOC(=O)C1OC12CCCOCC2 Amb26348289 [0,0,0,2,0,0|2,0,0]=4 841 B15R2.74417 CCOC(=O)C1OC12CCCSCC2 Amb33071424 [0,0,0,2,0,0|2,0,0]=4 842 B15R2.74812 CCOC(=O)C1C2CCC=CCCC21 Amb26064180 [0,0,0,2,0,0|0,0,2]=4 843 B15R2.74812 CCOC(=O)C1C2CCCCCCC21 Amb6359855 [0,0,0,2,0,0|0,0,0]=2 844 B15R2.74812 CCOC(=O)C1C2CCCCNCC21 Amb33192642 [0,0,0,2,0,0|1,0,0]=3 845 B15R2.74812 CCOC(=O)C1[C@@H]2CCC=CCC[C@@H]12 Amb34916395 [0,0,0,2,0,0|0,0,2]=4 846 B15R2.74812 CCOC(=O)C1[C@H]2CCC=CCC[C@H]12 Amb34915624 [0,0,0,2,0,0|0,0,2]=4 847 B15R2.74812 CCOC(=O)[C@@H]1[C@H]2CCC=CCC[C@H]21 Amb27827934 [0,0,0,2,0,0|0,0,2]=4 848 B15R2.74812 CCOC(=O)[C@H]1[C@H]2CCC=CCC[C@H]21 Amb26349189 [0,0,0,2,0,0|0,0,2]=4 849 B15R2.69936 O=C(CC1CCCCCCN1)C2CC2 Amb25038372 [0,0,0,2,0,0|2,0,0]=4 850 B15R2.69936 O=C(NC1CCCCCCC1)C2CC2 Amb6874581 [0,0,0,2,0,0|2,0,0]=4 851 B15R2.70120 O=C(NCC1CCCCCC1)C2CC2 Amb28436951 [0,0,0,2,0,0|2,0,0]=4