0 B14R0.337 C#CC(O)CCCCCCCCCCC Amb22345519 [0,0,0,0,0,0|1,0,3]=4 1 B14R0.337 CCCCCCCCCCCC(=O)NN Amb6572508 [0,0,0,0,0,0|2,0,0]=2 2 B14R0.337 CCCCCCCCCCCC(=O)NO Amb31031031 [0,0,0,0,0,0|2,0,0]=2 3 B14R0.337 CCCCCCCCCCCC(=O)OC Amb4378331 [0,0,0,0,0,0|0,0,0]=0 4 B14R0.337 CCCCCCCCCCCC(Cl)CCl Amb9787197 [0,0,0,0,0,0|3,0,1]=4 5 B14R0.337 CCCCCCCCCCNC(=O)CCl Amb3366789 [0,0,0,0,0,0|3,0,0]=3 6 B14R0.337 CCCCCCCCCCOC(=O)CBr Amb1103529 [0,0,0,0,0,0|3,0,0]=3 7 B14R0.337 CCCCCCCCCCOC(=O)CC Amb9786156 [0,0,0,0,0,0|2,0,0]=2 8 B14R0.337 CCCCCCCCCCOC(=O)CCl Amb6618965 [0,0,0,0,0,0|3,0,0]=3 9 B14R0.337 COC(=O)CCCCCCCCCCBr Amb3354793 [0,0,0,0,0,0|1,0,0]=1 10 B14R0.337 COC(=O)CCCCCCCCCCCl Amb22522963 [0,0,0,0,0,0|1,0,0]=1 11 B14R0.337 COC(=O)CCCCCCCCCCN Amb23575681 [0,0,0,0,0,0|1,0,0]=1 12 B13R0.54 C=CCCCCCCCCCC(=O)O Amb6296074 [1,0,0,0,0,0|0,0,2]=3 13 B13R0.54 C=CCCCCCCCCOC(C)=O Amb10563791 [1,0,0,0,0,0|1,0,2]=4 14 B13R0.54 CC(C)CCCCCCCCCCO Amb22055767 [1,0,0,0,0,0|2,0,1]=4 15 B13R0.54 CCCCCCCCCCCC(=O)Cl Amb3940238 [1,0,0,0,0,0|1,0,0]=2 16 B13R0.54 CCCCCCCCCCCC(=O)O Amb2708779 [1,0,0,0,0,0|0,0,0]=1 17 B13R0.54 CCCCCCCCCCCC(=O)[O-] Amb22729066 [1,0,0,0,0,0|0,0,1]=2 18 B13R0.54 CCCCCCCCCCCC(=O)[O-] Amb8516675 [1,0,0,0,0,0|0,0,1]=2 19 B13R0.54 CCCCCCCCCCCC(C)Br Amb22734063 [1,0,0,0,0,0|1,0,1]=3 20 B13R0.54 CCCCCCCCCCCC(C)N Amb21953727 [1,0,0,0,0,0|1,0,1]=3 21 B13R0.54 CCCCCCCCCCCC(N)=O Amb4008368 [1,0,0,0,0,0|1,0,0]=2 22 B13R0.54 CCCCCCCCCCCC(N)=S Amb13953232 [1,0,0,0,0,0|1,1,0]=3 23 B13R0.54 CCCCCCCCCCCN(C)C Amb8516600 [1,0,0,0,0,0|2,0,0]=3 24 B13R0.54 CCCCCCCCCCOC(=O)Cl Amb22337976 [1,0,0,0,0,0|2,0,0]=3 25 B13R0.54 CCCCCCCCC\C=C/C(=O)O Amb30666645 [1,0,0,0,0,0|0,0,2]=3 26 B13R0.54 CCCCCCCCC\C=C\C(=O)O Amb13952752 [1,0,0,0,0,0|0,0,2]=3 27 B13R0.54 CCCCCCCCSCCC(=O)O Amb1038994 [1,0,0,0,0,0|1,0,0]=2 28 B13R0.54 CCCCCNCCCCCC(=O)O Amb32410634 [1,0,0,0,0,0|1,0,0]=2 29 B13R0.54 CCCCOCCOCCCC(=O)O Amb9208474 [1,0,0,0,0,0|2,0,0]=3 30 B13R0.54 CCCCOCCOCCOC(C)=O Amb8516522 [1,0,0,0,0,0|3,0,0]=4 31 B13R0.54 CCCCSCCCCCCC(=O)O Amb1036584 [1,0,0,0,0,0|1,0,0]=2 32 B13R0.54 CCCC\C=C/CCCCOC(C)=O Amb4025835 [1,0,0,0,0,0|1,0,2]=4 33 B13R0.54 CN(C)CCCCCCCCCCN Amb24117501 [1,0,0,0,0,0|3,0,0]=4 34 B13R0.54 COCCOCCOCCCC(=O)O Amb32667431 [1,0,0,0,0,0|3,0,0]=4 35 B13R0.54 N#CCCCCCCCCCC(=O)O Amb22547629 [1,0,0,0,0,0|1,0,1]=3 36 B13R0.54 NCCCCCCCCCCC(=O)Cl Amb17143769 [1,0,0,0,0,0|2,0,0]=3 37 B13R0.54 NCCCCCCCCCCC(=O)O Amb3940461 [1,0,0,0,0,0|1,0,0]=2 38 B13R0.54 O=C(O)CCCCCCCCCCBr Amb639361 [1,0,0,0,0,0|1,0,0]=2 39 B13R0.54 O=C(O)CCCCCCCCCCCl Amb534918 [1,0,0,0,0,0|1,0,0]=2 40 B13R0.54 O=C(O)CCCCCCCCCCO Amb1814707 [1,0,0,0,0,0|1,0,0]=2 41 B13R0.54 O=C(O)CCCCCCCCCCS Amb584507 [1,0,0,0,0,0|1,0,0]=2 42 B13R0.54 [N-]=[N+]=NCCCCCCCCC(=O)O Amb34913620 [1,0,0,0,0,0|3,0,0]=4 43 B13R0.147 C=CC(=O)OCCCCCCCCC Amb20670989 [1,0,0,0,0,0|2,0,1]=4 44 B13R0.147 C=CCCCCCCCCC(=O)OC Amb612439 [1,0,0,0,0,0|0,0,2]=3 45 B13R0.147 CC#CCCCCCCCC(=O)OC Amb22641576 [1,0,0,0,0,0|0,0,2]=3 46 B13R0.147 CCCCCCCCCCC(=O)NN Amb534278 [1,0,0,0,0,0|2,0,0]=3 47 B13R0.147 CCCCCCCCCCC(=O)OC Amb9787313 [1,0,0,0,0,0|0,0,0]=1 48 B13R0.147 CCCCCCCCCNC(=O)CCl Amb17797886 [1,0,0,0,0,0|3,0,0]=4 49 B13R0.147 CCCCCCCNCCC(=O)NC Amb18333360 [1,0,0,0,0,0|2,0,0]=3 50 B13R0.147 CCCCCCCNCCC(=O)NN Amb20171959 [1,0,0,0,0,0|3,0,0]=4 51 B13R0.147 COC(=O)CCCCCCCCC=O Amb9787740 [1,0,0,0,0,0|1,0,1]=3 52 B13R0.147 COC(=O)CCCCCCCCCBr Amb3941556 [1,0,0,0,0,0|1,0,0]=2 53 B13R0.147 COC(=O)CCCCCCCCCN Amb32680801 [1,0,0,0,0,0|1,0,0]=2 54 B13R0.147 COC(=O)CCCCCCCCCN Amb33330795 [1,0,0,0,0,0|1,0,0]=2 55 B13R0.147 COC(=O)CCCSCCOCCN Amb17502012 [1,0,0,0,0,0|3,0,0]=4 56 B13R0.147 C\C=C\CCCCCCCC(=O)OC Amb22641574 [1,0,0,0,0,0|0,0,2]=3 57 B13R0.336 CCCCCCCCCCCCCBr Amb16234183 [1,0,0,0,0,0|2,0,1]=4 58 B13R0.336 CCCCCCCCCCCCCC Amb8513726 [1,0,0,0,0,0|1,0,1]=3 59 B13R0.336 CCCCCCCCCCCCCCl Amb9787118 [1,0,0,0,0,0|2,0,1]=4 60 B13R0.336 CCCCCCCCCCCCCN Amb8513364 [1,0,0,0,0,0|2,0,1]=4 61 B13R0.336 CCCCCCCCCCCCCO Amb2748034 [1,0,0,0,0,0|2,0,1]=4 62 B13R0.336 CCCCCCCCCCCCNC Amb3941528 [1,0,0,0,0,0|1,0,1]=3 63 B13R0.336 CCCCCCCCCCCCON Amb24117984 [1,0,0,0,0,0|1,0,1]=3 64 B13R0.336 CCCCCCCCCCCN=C=S Amb19883893 [1,0,0,0,0,0|3,0,0]=4 65 B13R0.336 CCCCCCCCCCCSCC Amb32410616 [1,0,0,0,0,0|2,0,0]=3 66 B13R0.336 CCCCCCCCCCNCCC Amb9787079 [1,0,0,0,0,0|2,0,1]=4 67 B13R0.336 CCCCCCCCCC\C=C\C#N Amb6600578 [1,0,0,0,0,0|2,0,1]=4 68 B13R0.336 CCCCCCCCCNCCOC Amb7794404 [1,0,0,0,0,0|1,0,1]=3 69 B13R0.336 CNCCCCCCCCCCCO Amb32653434 [1,0,0,0,0,0|2,0,1]=4 70 B15R0.81 CCCCCCCCCCCCC(=O)OC Amb21928887 [0,1,0,0,0,0|0,0,0]=1 71 B15R0.81 COC(=O)CCCCCCCCCCCBr Amb4466753 [0,1,0,0,0,0|0,0,0]=1 72 B15R0.81 COC(=O)CCCCCCCCCCCN Amb17608040 [0,1,0,0,0,0|0,0,0]=1 73 B15R0.81 COC(=O)CCCCCCCCCCCN Amb21856053 [0,1,0,0,0,0|0,0,0]=1 74 B15R0.84 CCCCCCCCCCCC(C)=C(F)F Amb22641691 [0,1,0,0,0,0|3,0,0]=4 75 B15R0.84 CCCCCCCCCCNC(=O)C(C)Br Amb17332064 [0,1,0,0,0,0|2,0,0]=3 76 B15R0.172 COC(=O)CCCCCCCCC(=O)OC Amb534293 [0,1,0,0,0,0|1,0,1]=3 77 B15R0.172 COC(=O)CCCCCCCCC(F)CBr Amb22547620 [0,1,0,0,0,0|1,0,0]=2 78 B15R0.172 COC(=O)CCCCCCCCC(F)CO Amb22547616 [0,1,0,0,0,0|1,0,0]=2 79 B15R0.172 COC(=O)CCCCCCCCC(O)CF Amb22547611 [0,1,0,0,0,0|1,0,0]=2 80 B15R0.324 CCCCCCCCCCC(Br)C(=O)OC Amb17673704 [0,1,0,0,0,0|0,0,0]=1 81 B15R0.324 CCCCCCCCNCC(C)C(=O)OC Amb20673404 [0,1,0,0,0,0|1,0,0]=2 82 B15R0.324 CCCCOCCCNCC(C)C(=O)OC Amb20673369 [0,1,0,0,0,0|2,0,0]=3 83 B15R0.366 CCCCCCCCCCCC(=O)OCC Amb6366580 [0,1,0,0,0,0|0,0,0]=1 84 B15R0.366 CCCCCCCCCCCC(=O)OCCl Amb32413654 [0,1,0,0,0,0|0,0,0]=1 85 B15R0.366 CCCCCCCCNCCC(=O)OCC Amb20673293 [0,1,0,0,0,0|1,0,0]=2 86 B15R0.366 CCCCCC\C=C\CCCC(=O)OCC Amb24066550 [0,1,0,0,0,0|0,0,2]=3 87 B15R0.366 CCOC(=O)CCCCCCCCCCN Amb33804736 [0,1,0,0,0,0|1,0,0]=2 88 B15R0.3221 CCCCCCCCCC(O)CC(=O)OC Amb21928822 [0,1,0,0,0,0|0,0,0]=1 89 B15R0.3221 CCCCCCCCC[C@@H](O)CC(=O)OC Amb31308367 [0,1,0,0,0,0|0,0,0]=1 90 B15R0.3221 CCCCCCCCNC(C)CC(=O)OC Amb20673405 [0,1,0,0,0,0|1,0,0]=2 91 B15R0.3221 CCCCOCCCNC(C)CC(=O)OC Amb20673370 [0,1,0,0,0,0|2,0,0]=3 92 B15R1.12 CCCCCCCCC1CCC(=O)CC1 Amb33718613 [0,0,0,1,0,0|1,0,0]=2 93 B15R1.85 CCC1CCCCC1OCCC(=O)OC Amb9206371 [0,0,0,1,0,0|1,0,0]=2 94 B15R1.962 COC(=O)CCCSCC1CCCNC1 Amb17503128 [0,0,0,1,0,0|2,0,0]=3 95 B15R1.962 COC(=O)CCCSCC1CCNCC1 Amb17503029 [0,0,0,1,0,0|2,0,0]=3 96 B15R1.962 COC(=O)CCNCCC1=CCCCC1 Amb20171960 [0,0,0,1,0,0|1,0,2]=4 97 B15R1.962 COC(=O)CCSCCC1CCCCN1 Amb22395656 [0,0,0,1,0,0|2,0,0]=3 98 B15R1.1091 COC(=O)CCCNC1CCCCC1C Amb8961058 [0,0,0,1,0,0|1,0,0]=2 99 B15R1.3843 COC(=O)CN1CCCCCCCC1=O Amb35644116 [0,0,0,1,0,0|2,0,1]=4 100 B15R1.11371 COC(=O)C1CCCCCCCCC1=O Amb33330808 [0,0,0,1,0,0|1,0,1]=3 101 B15R1.11631 COC(=O)CCCCCCCCC1CO1 Amb533252 [0,0,0,1,0,0|1,0,0]=2 102 B15R1.12436 COC(=O)\C=C\NC1CCCCCCC1 Amb28042608 [0,0,0,1,0,0|1,0,2]=4 103 B12R0.5 C=CCCCCCCCCCCC Amb2721661 [2,0,0,0,0,0|0,0,1]=3 104 B12R0.5 C=CCCCCCCCCCCN Amb24120407 [2,0,0,0,0,0|1,0,1]=4 105 B12R0.5 C=CCNCCCCCCCCC Amb7761762 [2,0,0,0,0,0|1,0,1]=4 106 B12R0.5 CCCCCCCCCCCC#N Amb8384531 [2,0,0,0,0,0|1,0,1]=4 107 B12R0.5 CCCCCCCCCCCC=O Amb3940434 [2,0,0,0,0,0|0,0,0]=2 108 B12R0.5 CCCCCCCCCCCCBr Amb6891945 [2,0,0,0,0,0|1,0,1]=4 109 B12R0.5 CCCCCCCCCCCCC Amb29471649 [2,0,0,0,0,0|0,0,1]=3 110 B12R0.5 CCCCCCCCCCCCC Amb8513362 [2,0,0,0,0,0|0,0,1]=3 111 B12R0.5 CCCCCCCCCCCCCl Amb4008392 [2,0,0,0,0,0|1,0,1]=4 112 B12R0.5 CCCCCCCCCCCCI Amb3940281 [2,0,0,0,0,0|1,0,1]=4 113 B12R0.5 CCCCCCCCCCCCN Amb3940463 [2,0,0,0,0,0|1,0,1]=4 114 B12R0.5 CCCCCCCCCCCCO Amb2721434 [2,0,0,0,0,0|0,0,1]=3 115 B12R0.5 CCCCCCCCCCCC[NH3+] Amb22049481 [2,0,0,0,0,0|1,0,1]=4 116 B12R0.5 CCCCCCCCCCCNC Amb32676722 [2,0,0,0,0,0|1,0,0]=3 117 B12R0.5 CCCCCCCCCCCNC Amb9787074 [2,0,0,0,0,0|1,0,0]=3 118 B12R0.5 CCCCCCCCCNCCC Amb7794670 [2,0,0,0,0,0|1,0,1]=4 119 B12R0.5 CCCCCCCCCSCCO Amb7968787 [2,0,0,0,0,0|1,0,1]=4 120 B12R0.5 CCCCCCCCNCCNC Amb2691994 [2,0,0,0,0,0|2,0,0]=4 121 B12R0.5 CCCCCCCNCCCCC Amb7761456 [2,0,0,0,0,0|1,0,1]=4 122 B12R0.5 CCCCCCNCCCCCC Amb3938960 [2,0,0,0,0,0|1,0,1]=4 123 B12R0.5 CCCCCCOCCCCCC Amb9787554 [2,0,0,0,0,0|1,0,1]=4 124 B12R0.5 CCCCCCSCCCCCC Amb8513185 [2,0,0,0,0,0|1,0,1]=4 125 B12R0.5 CCOCCCCCCCCCO Amb22233218 [2,0,0,0,0,0|1,0,1]=4 126 B12R0.5 COCCCCCNCCCOC Amb33133269 [2,0,0,0,0,0|2,0,0]=4 127 B12R0.5 NCCCCCCCCCCCO Amb26304136 [2,0,0,0,0,0|1,0,1]=4 128 B12R0.5 NCCCCCCCCCCCO Amb30988059 [2,0,0,0,0,0|1,0,1]=4 129 B12R0.5 OCCCCCCCCCCCBr Amb3372065 [2,0,0,0,0,0|1,0,1]=4 130 B12R0.5 OCCCCCCCCCCCO Amb15692712 [2,0,0,0,0,0|1,0,1]=4 131 B12R0.5 OCCCCCCCCCCCS Amb8396653 [2,0,0,0,0,0|1,0,1]=4 132 B12R0.234 C#CCCCCCCCCC(=O)O Amb536933 [2,0,0,0,0,0|0,0,2]=4 133 B12R0.234 C=C(Br)CCCCCCCCCC Amb6298937 [2,0,0,0,0,0|1,0,1]=4 134 B12R0.234 C=C(Cl)CCCCCCCCCC Amb6298931 [2,0,0,0,0,0|1,0,1]=4 135 B12R0.234 C=CCCCCCCCCC(=O)O Amb533736 [2,0,0,0,0,0|0,0,2]=4 136 B12R0.234 CC#CCCCCCCCC(=O)O Amb6565389 [2,0,0,0,0,0|0,0,2]=4 137 B12R0.234 CC(=O)OCCCCCCCCBr Amb24063233 [2,0,0,0,0,0|2,0,0]=4 138 B12R0.234 CCCCCCCCCCB(O)O Amb19958787 [2,0,0,0,0,0|1,0,1]=4 139 B12R0.234 CCCCCCCCCCC(=O)Cl Amb9787304 [2,0,0,0,0,0|1,0,0]=3 140 B12R0.234 CCCCCCCCCCC(=O)O Amb3941499 [2,0,0,0,0,0|0,0,0]=2 141 B12R0.234 CCCCCCCCCCC(C)=O Amb6366439 [2,0,0,0,0,0|0,0,0]=2 142 B12R0.234 CCCCCCCCCCC(C)N Amb8869702 [2,0,0,0,0,0|1,0,1]=4 143 B12R0.234 CCCCCCCCCCN(C)C Amb9787202 [2,0,0,0,0,0|2,0,0]=4 144 B12R0.234 CCCCCCCCCOC(C)=O Amb6366259 [2,0,0,0,0,0|1,0,0]=3 145 B12R0.234 CCCCCCCCOCC(=O)O Amb7790043 [2,0,0,0,0,0|1,0,0]=3 146 B12R0.234 CCCCCCCC\C=C\C(=O)O Amb33987634 [2,0,0,0,0,0|0,0,2]=4 147 B12R0.234 CCOCCOCCCCC(=O)O Amb9207787 [2,0,0,0,0,0|2,0,0]=4 148 B12R0.234 N#CCCCCCCCCC(=O)O Amb4008315 [2,0,0,0,0,0|1,0,1]=4 149 B12R0.234 NCCCCCCCCCC(=O)O Amb2229638 [2,0,0,0,0,0|1,0,0]=3 150 B12R0.234 NCCCCCCCCCC(=O)O Amb31030991 [2,0,0,0,0,0|1,0,0]=3 151 B12R0.234 O=C(O)CCCCCCCCCBr Amb4014619 [2,0,0,0,0,0|1,0,0]=3 152 B12R0.234 O=C(O)CCCCCCCCCO Amb3940517 [2,0,0,0,0,0|1,0,0]=3 153 B12R0.248 C=CCCCCCCCC(=O)OC Amb533244 [2,0,0,0,0,0|0,0,2]=4 154 B12R0.248 CCCCCCCCCC(=O)NN Amb6530432 [2,0,0,0,0,0|2,0,0]=4 155 B12R0.248 CCCCCCCCCC(=O)NO Amb33548521 [2,0,0,0,0,0|2,0,0]=4 156 B12R0.248 CCCCCCCCCC(=O)OC Amb4378003 [2,0,0,0,0,0|0,0,0]=2 157 B12R0.248 CCCCC\C=C/CCC(=O)OC Amb24093816 [2,0,0,0,0,0|0,0,2]=4 158 B12R0.248 CCNCCOCCCC(=O)OC Amb18107249 [2,0,0,0,0,0|2,0,0]=4 159 B12R0.248 COC(=O)CCCCCCCC=O Amb8391799 [2,0,0,0,0,0|1,0,1]=4 160 B12R0.248 COC(=O)CCCCCCCCBr Amb34913614 [2,0,0,0,0,0|1,0,0]=3 161 B12R0.248 COC(=O)CCCCCCCCO Amb17616943 [2,0,0,0,0,0|1,0,0]=3 162 B12R0.248 COC(=O)CCCSCCCCN Amb17500973 [2,0,0,0,0,0|2,0,0]=4 163 B12R0.248 COCCCCCNCC(=O)OC Amb33133279 [2,0,0,0,0,0|2,0,0]=4 164 B14R0.68 C=C(F)CCCCCCCCCC(=O)O Amb22641506 [1,1,0,0,0,0|0,0,2]=4 165 B14R0.68 CC(C)CCCCCCC\C=C/C(=O)O Amb22586579 [1,1,0,0,0,0|0,0,2]=4 166 B14R0.68 CC(O)CCCCCCCCCC(=O)[O-] Amb30988058 [1,1,0,0,0,0|0,0,1]=3 167 B14R0.68 O=C(O)CCCCCCCCCC(=O)O Amb10807546 [1,1,0,0,0,0|1,0,1]=4 168 B14R0.153 CCCCC(=O)NCCCCCC(=O)O Amb6243765 [1,1,0,0,0,0|1,0,1]=4 169 B14R0.231 CCCCCC(=O)CCCCCC(=O)O Amb6305237 [1,1,0,0,0,0|0,0,1]=3 170 B14R0.305 COC(=O)CCCCCCCCC(=O)O Amb6366515 [1,1,0,0,0,0|1,0,1]=4 171 B14R0.305 O=C(O)CCCCCCCCC(O)CO Amb9786104 [1,1,0,0,0,0|1,0,0]=3 172 B14R0.340 CCCCCCCCCCC(Br)C(=O)O Amb8513066 [1,1,0,0,0,0|0,0,0]=2 173 B14R0.340 CCCCCCCCCCC(N)C(=O)O Amb21858489 [1,1,0,0,0,0|0,0,0]=2 174 B14R0.340 CCCCCCCCCCC(O)C(=O)O Amb3987639 [1,1,0,0,0,0|0,0,0]=2 175 B14R0.340 CCCCCCCCCC[C@@H](N)C(=O)O Amb22745407 [1,1,0,0,0,0|0,0,0]=2 176 B14R0.340 CCCCCCCCCC[C@H](N)C(=O)O Amb33836077 [1,1,0,0,0,0|0,0,0]=2 177 B14R0.344 CCCCCCCCC(O)C#CC(=O)O Amb17779806 [1,1,0,0,0,0|0,0,2]=4 178 B14R0.344 CCCCCCCCC(O)CCC(=O)O Amb33313442 [1,1,0,0,0,0|0,0,0]=2 179 B14R0.344 CCCCCCCCC(O)CCC(=O)[O-] Amb32652042 [1,1,0,0,0,0|0,0,1]=3 180 B14R0.344 CCCCCCCCS(=O)CCC(=O)O Amb1038995 [1,1,0,0,0,0|1,0,0]=3 181 B14R0.391 CCCCCCCCCC(C)CC(=O)O Amb28963737 [1,1,0,0,0,0|0,0,0]=2 182 B14R0.391 CCCCCCCCCC(O)CC(=O)O Amb21928747 [1,1,0,0,0,0|0,0,0]=2 183 B14R0.391 CCCCCCCCNC(=O)CC(=O)O Amb28905868 [1,1,0,0,0,0|1,0,1]=4 184 B14R0.391 CCCCCCCCOC(=O)CC(C)=O Amb9787149 [1,1,0,0,0,0|1,0,1]=4 185 B14R0.394 C#CCCCCCCCCCCC(=O)O Amb1396957 [1,1,0,0,0,0|0,0,1]=3 186 B14R0.394 C=CCCCCCCCCCCC(=O)O Amb6297458 [1,1,0,0,0,0|0,0,1]=3 187 B14R0.394 CCCCCCCCCCCCB(O)O Amb13890365 [1,1,0,0,0,0|1,0,1]=4 188 B14R0.394 CCCCCCCCCCCCC(=O)O Amb8513363 [1,1,0,0,0,0|0,0,0]=2 189 B14R0.394 CCCCCCCCCCCCC(C)=O Amb22730728 [1,1,0,0,0,0|0,0,0]=2 190 B14R0.394 CCCCCCCCCCCCC(C)O Amb8513348 [1,1,0,0,0,0|0,0,2]=4 191 B14R0.394 CCCCCCCCCCCCN(C)C Amb8395263 [1,1,0,0,0,0|2,0,0]=4 192 B14R0.394 CCCCCCCCCCCOC(C)=O Amb6366704 [1,1,0,0,0,0|0,0,0]=2 193 B14R0.394 CCCCCCCCCNCCN(C)C Amb7761766 [1,1,0,0,0,0|2,0,0]=4 194 B14R0.394 C\C=C\CCCCCCCCOC(C)=O Amb22641577 [1,1,0,0,0,0|0,0,2]=4 195 B14R0.394 N#CCCCCCCCCCCC(=O)O Amb4014736 [1,1,0,0,0,0|0,0,1]=3 196 B14R0.394 NCCCCCCCCCCCC(=O)O Amb3940462 [1,1,0,0,0,0|0,0,0]=2 197 B14R0.394 O=C(O)CCCCCCCCCCCBr Amb3940328 [1,1,0,0,0,0|0,0,0]=2 198 B14R0.394 O=C(O)CCCCCCCCCCCO Amb3940329 [1,1,0,0,0,0|0,0,0]=2 199 B14R0.394 O=C(O)COCCOCCCCCCCl Amb33719366 [1,1,0,0,0,0|2,0,0]=4 200 B14R0.394 [N-]=[N+]=NCCCCCCCCCC(=O)O Amb32668376 [1,1,0,0,0,0|2,0,0]=4 201 B14R0.197 COC(=O)CCCCCCCC(=O)OC Amb9787239 [1,1,0,0,0,0|1,0,1]=4 202 B14R0.393 CCCCCCCCCCC(=O)CCC Amb9031611 [1,1,0,0,0,0|1,0,0]=3 203 B14R0.393 CCCCCCCCCCC(=O)OCC Amb8513621 [1,1,0,0,0,0|0,0,0]=2 204 B14R0.393 CCCCCCCCCCS(=O)CCO Amb1039004 [1,1,0,0,0,0|2,0,0]=4 205 B14R0.393 CCCCCCCNCCC(=O)NCC Amb20171956 [1,1,0,0,0,0|2,0,0]=4 206 B14R0.393 CCCCCCCNCCC(=O)OCC Amb20171955 [1,1,0,0,0,0|1,0,0]=3 207 B14R0.393 CCOC(=O)CCCCCCCCCBr Amb21945748 [1,1,0,0,0,0|1,0,0]=3 208 B14R0.393 CCOC(=O)CCCCCCCCCN Amb33804740 [1,1,0,0,0,0|1,0,0]=3 209 B14R0.2056 CCCCCCCCCCS(=O)(=O)NC Amb32692075 [1,1,0,0,0,0|2,0,0]=4 210 B14R0.145 CCCCCCCC(C)NCCCOC Amb7795492 [1,1,0,0,0,0|1,0,1]=4 211 B14R0.145 CCCCCCCC(O)CCCCCC Amb6869645 [1,1,0,0,0,0|1,0,1]=4 212 B14R0.392 CCCCCCCCCCCCCCBr Amb8513855 [1,1,0,0,0,0|1,0,1]=4 213 B14R0.392 CCCCCCCCCCCCCCCl Amb8384591 [1,1,0,0,0,0|1,0,1]=4 214 B14R0.392 CCCCCCCCCCCCCCF Amb10840999 [1,1,0,0,0,0|1,0,1]=4 215 B14R0.392 CCCCCCCCCCCCCCO Amb3940391 [1,1,0,0,0,0|1,0,1]=4 216 B14R0.392 CCCCCCCCCCCCCNC Amb10241352 [1,1,0,0,0,0|1,0,1]=4 217 B14R0.392 CCCCCCCCCCCCC[NH2+]C Amb9787093 [1,1,0,0,0,0|1,0,1]=4 218 B14R0.392 CCCCCCCCCCCCSCC Amb4008818 [1,1,0,0,0,0|0,1,1]=4 219 B14R0.392 CCCCCCCCCCCNCCC Amb9787065 [1,1,0,0,0,0|1,0,1]=4 220 B14R0.392 CCCCCCCCCCCOCCO Amb9787691 [1,1,0,0,0,0|2,0,0]=4 221 B14R0.392 CCCCCCCCCCC[NH2+]CCC Amb9787083 [1,1,0,0,0,0|1,0,1]=4 222 B14R0.392 CCCCCCCCCNCCCCC Amb7761764 [1,1,0,0,0,0|1,0,1]=4 223 B14R0.392 CCCCCCCCC[NH2+]CCCCC Amb9787092 [1,1,0,0,0,0|1,0,1]=4 224 B14R0.392 CCCCCCCCNCCCCCC Amb7757641 [1,1,0,0,0,0|1,0,1]=4 225 B14R0.392 CCCCCCCNCCCCCCC Amb495299 [1,1,0,0,0,0|1,0,1]=4 226 B14R0.392 CCCCCCCNCCCCCCC Amb839439 [1,1,0,0,0,0|1,0,1]=4 227 B14R0.392 CCCCCCCOCCCCCCC Amb4008530 [1,1,0,0,0,0|1,0,1]=4 228 B14R0.392 CCCCCCCSCCCCCCC Amb9787168 [1,1,0,0,0,0|1,0,1]=4 229 B14R0.392 CC\C=C/CCCCCCCCCCO Amb33756791 [1,1,0,0,0,0|1,0,1]=4 230 B14R0.392 CC\C=C\CCCCCCCCCCO Amb539676 [1,1,0,0,0,0|1,0,1]=4 231 B16R0.61 CCCCCCCCCCCCC(=O)OCCl Amb32414072 [0,2,0,0,0,0|0,0,0]=2 232 B16R0.61 CCOC(=O)CCCCCCCCCCCBr Amb32406014 [0,2,0,0,0,0|0,0,0]=2 233 B16R0.61 CCOC(=O)CCCCCCCCCCCN Amb28858255 [0,2,0,0,0,0|0,0,0]=2 234 B16R0.61 CCOC(=O)CCCCCCCCCCCN Amb32668359 [0,2,0,0,0,0|0,0,0]=2 235 B16R0.164 COC(=O)CCCCCCCCCC(=O)OC Amb6366458 [0,2,0,0,0,0|0,0,1]=3 236 B16R0.165 COC(=O)CCCCCCCCCCC(=O)O Amb13887306 [0,2,0,0,0,0|0,0,1]=3 237 B16R0.221 C=CC(=O)OCCCCCCCCCCCC Amb17934077 [0,2,0,0,0,0|1,0,1]=4 238 B16R0.221 CCCCCCCCCCCCCC(=O)NN Amb17779807 [0,2,0,0,0,0|2,0,0]=4 239 B16R0.221 CCCCCCCCCCCCCC(=O)NN Amb6493018 [0,2,0,0,0,0|2,0,0]=4 240 B16R0.221 CCCCCCCCCCCCCC(=O)OC Amb8513623 [0,2,0,0,0,0|0,0,0]=2 241 B16R0.221 CCCCCCCCCCCCNC(=O)CCl Amb9786179 [0,2,0,0,0,0|2,0,0]=4 242 B16R0.221 CCCCCCCCCCCCNC(=O)CN Amb23440885 [0,2,0,0,0,0|2,0,0]=4 243 B16R0.221 CCCCCCCCCCCCOC(=O)CBr Amb9787144 [0,2,0,0,0,0|2,0,0]=4 244 B16R0.221 CCCCCCCCCCCCOC(=O)CC Amb31291585 [0,2,0,0,0,0|1,0,0]=3 245 B16R0.221 CCCCCCCCCCCCOC(=O)CCl Amb9787143 [0,2,0,0,0,0|2,0,0]=4 246 B16R0.221 CCCCCCCCCCCCOC(=O)CN Amb21520298 [0,2,0,0,0,0|2,0,0]=4 247 B16R0.221 CCCCCCCCCCCCS\C(N)=N\C Amb13951544 [0,2,0,0,0,0|2,0,0]=4 248 B16R0.221 COC(=O)CCCCCCCCCCN=[N+]=[N-] Amb34912868 [0,2,0,0,0,0|1,0,0]=3 249 B16R0.222 CCCCCCCCCCCS\C(=N/C)NC Amb10609020 [0,2,0,0,0,0|2,0,0]=4 250 B16R0.299 CCCCCC(=O)CCCCCC(=O)OCC Amb6305819 [0,2,0,0,0,0|0,0,1]=3 251 B16R0.1183 CCCCCCCCCCC(Br)C(=O)OCC Amb22734285 [0,2,0,0,0,0|0,0,0]=2 252 B16R0.97 CCOC(=O)CCCCCCCC(=O)OCC Amb5718047 [0,2,0,0,0,0|1,0,1]=4 253 B16R0.154 CCCCCCCCCC(=O)CC(=O)OCC Amb30627695 [0,2,0,0,0,0|0,0,1]=3 254 B16R0.302 CCCCCCCCCCCC(=O)NC(N)=S Amb3989756 [0,2,0,0,0,0|1,0,1]=4 255 B16R0.302 CCCCCCCCCCCC(=O)OC(C)C Amb17935700 [0,2,0,0,0,0|0,0,0]=2 256 B16R0.661 CCCCCCCCCCCC(=O)NCCO Amb4015062 [0,2,0,0,0,0|1,0,0]=3 257 B16R0.661 CCCCCCCCCCCC(=O)OCCC Amb9787145 [0,2,0,0,0,0|0,0,0]=2 258 B16R0.661 CCCCCCCCCCCC(=O)OCCCl Amb9789397 [0,2,0,0,0,0|0,0,0]=2 259 B16R0.661 CCCCCCCCCCNC(=O)CCCCl Amb17324426 [0,2,0,0,0,0|2,0,0]=4 260 B14R1.26 CCCCCCCC1CCCC(=O)O1 Amb767091 [1,0,0,1,0,0|0,0,0]=2 261 B14R1.26 N#CCCCCCC1CCCC(=O)C1 Amb6302010 [1,0,0,1,0,0|1,0,1]=4 262 B14R1.96 CCC1CCCCN1CCCC(=O)Cl Amb17143700 [1,0,0,1,0,0|2,0,0]=4 263 B14R1.96 CCC1CCCCN1CCCC(=O)O Amb5775446 [1,0,0,1,0,0|1,0,0]=3 264 B14R1.96 CCC1CCCCN1CCCC(N)=O Amb17143194 [1,0,0,1,0,0|2,0,0]=4 265 B14R1.269 CCCC1CCCCCC1NC(C)=O Amb2227902 [1,0,0,1,0,0|1,0,0]=3 266 B14R1.269 CCC[C@H]1CCCCC[C@@H]1NC(C)=O Amb27783350 [1,0,0,1,0,0|1,0,0]=3 267 B14R1.275 CCCC1CCCCCCCC(=O)N1 Amb28408987 [1,0,0,1,0,0|1,0,0]=3 268 B14R1.333 O=C(O)CCC1CCCCCCC1=O Amb27751434 [1,0,0,1,0,0|1,0,1]=4 269 B14R1.422 CC(=O)NCCNCC1CCCCC1 Amb6732520 [1,0,0,1,0,0|2,0,0]=4 270 B14R1.422 O=C(O)CCCCCC1CCCCC1 Amb22230076 [1,0,0,1,0,0|0,0,0]=2 271 B14R1.422 O=C(O)CCCCCC1CCCCN1 Amb32430378 [1,0,0,1,0,0|1,0,0]=3 272 B14R1.422 O=C(O)CCCCCN1CCOCC1 Amb33079998 [1,0,0,1,0,0|2,0,0]=4 273 B14R1.422 O=C(O)CCCCOC1CCCCC1 Amb9207782 [1,0,0,1,0,0|1,0,0]=3 274 B14R1.422 O=C(O)CCCNCC1CCCCC1 Amb6274295 [1,0,0,1,0,0|1,0,0]=3 275 B14R1.422 O=C(O)CCCSCC1CCCNC1 Amb17503127 [1,0,0,1,0,0|2,0,0]=4 276 B14R1.422 O=C(O)CCCSCC1CCNCC1 Amb17503028 [1,0,0,1,0,0|2,0,0]=4 277 B14R1.422 O=C(O)CCNCCN1CCCCC1 Amb9326457 [1,0,0,1,0,0|2,0,0]=4 278 B14R1.422 O=C(O)CCSCCN1CCCCC1 Amb6745725 [1,0,0,1,0,0|2,0,0]=4 279 B14R1.422 O=C(O)CNCCCN1CCCCC1 Amb20152206 [1,0,0,1,0,0|2,0,0]=4 280 B14R1.427 O=C(O)CCNCCCN1CCCC1 Amb19090342 [1,0,0,1,0,0|2,0,0]=4 281 B14R1.482 O=C(O)CCN1CCCCC1CCO Amb6637635 [1,0,0,1,0,0|2,0,0]=4 282 B14R1.4408 O=C1C=CCCCCCCCCCC1 Amb25793577 [1,0,0,1,0,0|0,0,2]=4 283 B14R1.4408 O=C1CCCCCCCCCCCN1 Amb9825846 [1,0,0,1,0,0|1,0,0]=3 284 B14R1.4408 O=C1CCCCCCCCCCCO1 Amb9825923 [1,0,0,1,0,0|0,0,0]=2 285 B14R1.4408 O=C1CCCCCCCCNCCO1 Amb28187014 [1,0,0,1,0,0|1,0,0]=3 286 B14R1.4408 O=C1CCCCCCCNCCCO1 Amb27746900 [1,0,0,1,0,0|1,0,0]=3 287 B14R1.4408 O=C1NCCCCCCCCCCN1 Amb28130432 [1,0,0,1,0,0|2,0,0]=4 288 B14R1.4408 O=C1OCCCCCCCCCCO1 Amb24459843 [1,0,0,1,0,0|1,0,0]=3 289 B14R1.4408 OC1CCCCCCCCCCCC1 Amb27598545 [1,0,0,1,0,0|0,0,2]=4 290 B14R1.4728 CCCCCCCCC1CC1C(=O)O Amb1033024 [1,0,0,1,0,0|0,0,0]=2 291 B14R1.4808 C=C1CCCCCCCCC1C(=O)O Amb27592138 [1,0,0,1,0,0|0,0,2]=4 292 B14R1.5254 CCNC1CCCCCCC1S(C)=O Amb28398389 [1,0,0,1,0,0|2,0,0]=4 293 B14R1.6343 O=C(O)CCCCN1CCCNCC1 Amb17479032 [1,0,0,1,0,0|2,0,0]=4 294 B14R1.6343 O=C(O)CNCCN1CCCCCC1 Amb20573254 [1,0,0,1,0,0|2,0,0]=4 295 B14R1.6388 O=C(O)CCCCCCCCC1CC1 Amb32645995 [1,0,0,1,0,0|0,0,0]=2 296 B14R1.6414 NC(=O)C1CCCCCCCCCC1 Amb27984828 [1,0,0,1,0,0|1,0,0]=3 297 B14R1.6414 O=C(O)C1C=CCCCCCCCC1 Amb27231809 [1,0,0,1,0,0|0,0,2]=4 298 B14R1.6414 O=C(O)C1CCCCCCCCCC1 Amb4034592 [1,0,0,1,0,0|0,0,0]=2 299 B14R1.6414 O=C(O)C1CCCCCCCCCN1 Amb27983623 [1,0,0,1,0,0|1,0,0]=3 300 B14R1.6444 O=C(O)C=C1CCCCCCCCC1 Amb28118972 [1,0,0,1,0,0|0,0,2]=4 301 B14R1.14 CCCCCCCC1CCC(=O)CC1 Amb30634329 [1,0,0,1,0,0|1,0,0]=3 302 B14R1.247 CC1CCCCCCCCCCC1=O Amb540121 [1,0,0,1,0,0|1,0,0]=3 303 B14R1.247 O=C1CCCCCCCCCCC1=O Amb4136412 [1,0,0,1,0,0|2,0,0]=4 304 B14R1.247 O=C1CCCCCCCCCCC1Br Amb4017597 [1,0,0,1,0,0|2,0,0]=4 305 B14R1.247 O=C1CCCCCCCCCCC1O Amb4017908 [1,0,0,1,0,0|2,0,0]=4 306 B14R1.483 CCOC1CCCCC1CC(=O)OC Amb32584291 [1,0,0,1,0,0|1,0,0]=3 307 B14R1.709 COC(=O)CCC1CCCCCC1=O Amb17595252 [1,0,0,1,0,0|1,0,1]=4 308 B14R1.716 COC(=O)CCCSC1CCNCC1 Amb17502197 [1,0,0,1,0,0|2,0,0]=4 309 B14R1.716 COC(=O)CCSCC1CCCCN1 Amb22395632 [1,0,0,1,0,0|2,0,0]=4 310 B14R1.716 COC(=O)CCSCC1CCCCN1 Amb35745536 [1,0,0,1,0,0|2,0,0]=4 311 B14R1.716 COC(=O)CCSCC1CCCNC1 Amb22395611 [1,0,0,1,0,0|2,0,0]=4 312 B14R1.716 COC(=O)CCSCC1CCNCC1 Amb22395596 [1,0,0,1,0,0|2,0,0]=4 313 B14R1.716 COC(=O)CCSCC1CCNCC1 Amb35745834 [1,0,0,1,0,0|2,0,0]=4 314 B14R1.716 COC(=O)CSCCC1CCCCN1 Amb22395652 [1,0,0,1,0,0|2,0,0]=4 315 B14R1.716 COC(=O)CSCCC1CCCCN1 Amb35745537 [1,0,0,1,0,0|2,0,0]=4 316 B14R1.716 COC(=O)CSCCC1CCNCC1 Amb22395700 [1,0,0,1,0,0|2,0,0]=4 317 B14R1.716 COC(=O)CSCCC1CCNCC1 Amb32662516 [1,0,0,1,0,0|2,0,0]=4 318 B14R1.789 CCCCN1CCOCC1C(=O)OC Amb33164170 [1,0,0,1,0,0|2,0,0]=4 319 B14R1.837 COC(=O)CCOC1CCCCC1C Amb9206374 [1,0,0,1,0,0|1,0,0]=3 320 B14R1.845 COC1CCCCCCCCCCC1 Amb8514867 [1,0,0,1,0,0|1,0,1]=4 321 B14R1.848 CCC1CCCCC\C1=C/C(=O)OC Amb35721689 [1,0,0,1,0,0|0,0,2]=4 322 B14R1.855 CCC1CCCCCCC1C(=O)NC Amb27621102 [1,0,0,1,0,0|1,0,0]=3 323 B14R1.855 CNC1CCCCCCC1C(=O)OC Amb27833258 [1,0,0,1,0,0|1,0,0]=3 324 B14R1.863 CCC1CCCCC1OCC(=O)OC Amb9206373 [1,0,0,1,0,0|1,0,0]=3 325 B14R1.863 CCC1CCCCN1CCC(=O)OC Amb8872865 [1,0,0,1,0,0|1,0,0]=3 326 B14R1.1224 COC(=O)CN1CCCCCCCC1 Amb27249749 [1,0,0,1,0,0|1,0,0]=3 327 B14R1.1586 COC(=O)CCCN1CCCCCC1 Amb8455440 [1,0,0,1,0,0|1,0,0]=3 328 B14R1.2877 COC(=O)CC1CCCCCCC1N Amb32863500 [1,0,0,1,0,0|1,0,0]=3 329 B14R1.2877 COC(=O)C[C@@H]1CCCCCC[C@@H]1N Amb33192978 [1,0,0,1,0,0|1,0,0]=3 330 B14R1.4889 O=C1CCCCCCCCC(O)CC1 Amb27824496 [1,0,0,1,0,0|2,0,0]=4 331 B14R1.7633 O=C(CF)C1CCCCCCCCC1 Amb27757721 [1,0,0,1,0,0|2,0,0]=4 332 B14R1.7684 CNC(=O)CNC1CCCCCCC1 Amb6710272 [1,0,0,1,0,0|2,0,0]=4 333 B14R1.7684 COC(=O)CCN1CCCCCCC1 Amb7755663 [1,0,0,1,0,0|1,0,0]=3 334 B14R1.123 CCCCCCCCC1CCCCC1 Amb22733702 [1,0,0,1,0,0|1,0,1]=4 335 B14R1.123 CCCCCCCCC1CCCNC1 Amb22642854 [1,0,0,1,0,0|1,0,1]=4 336 B14R1.123 CCCCCCCCC1CCCNC1 Amb35745609 [1,0,0,1,0,0|1,0,1]=4 337 B14R1.123 CCCCCCCCC1CCNCC1 Amb35745610 [1,0,0,1,0,0|2,0,0]=4 338 B14R1.123 CCCCCCCCC1CCNCC1 Amb3933583 [1,0,0,1,0,0|2,0,0]=4 339 B14R1.123 COCCCCCNC1CCCCC1 Amb33133267 [1,0,0,1,0,0|1,0,1]=4 340 B14R1.882 COCCCCNC1CCCCC1C Amb19089788 [1,0,0,1,0,0|1,0,1]=4 341 B14R1.1254 COCCCNC1CCCCCCC1 Amb6730168 [1,0,0,1,0,0|1,0,1]=4 342 B14R1.2352 COCCCCNC1CCCCCC1 Amb19089787 [1,0,0,1,0,0|1,0,1]=4 343 B14R1.2874 C1CCCCCCCCCCCCC1 Amb22230503 [1,0,0,1,0,0|1,0,1]=4 344 B16R1.8816 FC1=CCCCCCCCCCCCCC1 Amb22641508 [0,1,0,1,0,0|2,0,0]=4 345 B16R1.8816 O=C1CCCCCCCCCCCCCC1 Amb6357375 [0,1,0,1,0,0|1,0,0]=3 346 B16R1.8816 O=C1CCCCCCCCCCOCCO1 Amb533453 [0,1,0,1,0,0|0,0,0]=2 347 B16R1.26934 CCCCCC1C(=O)CCC1CC(=O)OC Amb1146734 [0,1,0,1,0,0|0,0,1]=3 348 B16R1.1363 [N-]=[N+]=C1CCCCCCCCCCCC1=O Amb17596070 [0,1,0,1,0,0|2,0,0]=4 349 B16R1.1635 COC(=O)C(C)CNCCN1CCCCC1 Amb20673376 [0,1,0,1,0,0|2,0,0]=4 350 B16R1.2611 COC(=O)C(C)CNC1CCCCCCC1 Amb17719261 [0,1,0,1,0,0|1,0,0]=3 351 B16R1.27 CCCCCCCCCC1CCCC(=O)O1 Amb10807863 [0,1,0,1,0,0|2,0,0]=4 352 B16R1.890 CCOC(=O)CCNCC1CCCN1CC Amb9024132 [0,1,0,1,0,0|2,0,0]=4 353 B16R1.932 CCOC(=O)CCNCCN1CCCCC1 Amb20673279 [0,1,0,1,0,0|2,0,0]=4 354 B16R1.2034 CCOC(=O)CCNC1CCCCCCC1 Amb9024242 [0,1,0,1,0,0|1,0,0]=3 355 B16R1.14009 CCOC(=O)CCCCCC1CCCC1=O Amb6357384 [0,1,0,1,0,0|1,0,1]=4 356 B16R1.1343 COC(=O)CCC(N)CCN1CCOCC1 Amb33325886 [0,1,0,1,0,0|2,0,0]=4 357 B16R1.1343 COC(=O)CNC(=O)CCC1CCCCC1 Amb1957927 [0,1,0,1,0,0|1,0,1]=4 358 B16R1.849 COC(=O)CC(C)NCCN1CCCCC1 Amb20673377 [0,1,0,1,0,0|2,0,0]=4 359 B16R2.26 CCC1CCCCN1C2CCC(=O)CC2 Amb27627754 [0,0,0,2,0,0|2,0,0]=4 360 B16R2.99 CCCC1CCCN1C2CCC(=O)CC2 Amb27790023 [0,0,0,2,0,0|2,0,0]=4 361 B16R2.132 O=C1CCC(OCC2CCCCC2)CC1 Amb27465598 [0,0,0,2,0,0|2,0,0]=4 362 B16R2.33330 O=C1CCC(OC2CCCCCC2)CC1 Amb28423693 [0,0,0,2,0,0|2,0,0]=4 363 B16R2.33330 O=C1CCN(CC2CCCCCC2)CC1 Amb28193221 [0,0,0,2,0,0|2,0,0]=4 364 B16R2.55 CCCC1CCCCN1C2CCC(=O)C2 Amb27764401 [0,0,0,2,0,0|2,0,0]=4 365 B16R2.166 CCC1CCCCCN1C2CCC(=O)C2 Amb27611366 [0,0,0,2,0,0|2,0,0]=4 366 B16R2.5347 CCC(=O)CN1CCC2CCCCC2C1 Amb27435007 [0,0,0,2,0,0|2,0,0]=4 367 B16R2.5347 COC(=O)CC1CCC2CNCCC2C1 Amb33606264 [0,0,0,2,0,0|1,0,0]=3 368 B16R2.5347 COC(=O)CC1CCC2CNCCC2C1 Amb33738275 [0,0,0,2,0,0|1,0,0]=3 369 B16R2.5347 COC(=O)CN1CCC2CCCCC2C1 Amb9265103 [0,0,0,2,0,0|1,0,0]=3 370 B16R2.5347 COC(=O)CN1CCN2CCCCC2C1 Amb27646197 [0,0,0,2,0,0|2,0,0]=4 371 B16R2.5347 COC(=O)\C=C1\CCC2CCCCC2C1 Amb33472162 [0,0,0,2,0,0|0,0,2]=4 372 B16R2.148 COC(=O)C1CCCC1C2CCNCC2 Amb33609436 [0,0,0,2,0,0|1,0,0]=3 373 B16R2.148 COC(=O)C1CCCC1C2CCNCC2 Amb33746612 [0,0,0,2,0,0|1,0,0]=3 374 B16R2.148 COC(=O)C1CCCN1C2CCNCC2 Amb10609296 [0,0,0,2,0,0|2,0,0]=4 375 B16R2.148 COC(=O)C1CCCN1C2CCNCC2 Amb2700005 [0,0,0,2,0,0|2,0,0]=4 376 B16R2.148 COC(=O)C1CCCN1C2CCOCC2 Amb20669480 [0,0,0,2,0,0|2,0,0]=4 377 B16R2.148 COC(=O)C1CCOC1C2CCNCC2 Amb32653480 [0,0,0,2,0,0|2,0,0]=4 378 B16R2.148 COC(=O)C1CCOC1C2CCNCC2 Amb32660992 [0,0,0,2,0,0|2,0,0]=4 379 B16R2.148 COC(=O)C1CNCC1C2CCCCC2 Amb28067283 [0,0,0,2,0,0|1,0,0]=3 380 B16R2.148 COC(=O)C1CNCC1C2CCCCO2 Amb35587033 [0,0,0,2,0,0|2,0,0]=4 381 B16R2.148 COC(=O)C1CNCC1C2CCCOC2 Amb24346419 [0,0,0,2,0,0|2,0,0]=4 382 B16R2.148 COC(=O)C1CNCC1C2CCOCC2 Amb24653191 [0,0,0,2,0,0|2,0,0]=4 383 B16R2.148 COC(=O)[C@@H]1CCO[C@H]1C2CCNCC2 Amb32661011 [0,0,0,2,0,0|2,0,0]=4 384 B16R2.148 COC(=O)[C@@H]1CCO[C@H]1C2CCNCC2 Amb32661013 [0,0,0,2,0,0|2,0,0]=4 385 B16R2.148 COC(=O)[C@@H]1CNC[C@H]1C2CCCCC2 Amb33231172 [0,0,0,2,0,0|1,0,0]=3 386 B16R2.148 COC(=O)[C@@H]1CNC[C@H]1C2CCOCC2 Amb35751217 [0,0,0,2,0,0|2,0,0]=4 387 B16R2.148 COC(=O)[C@@H]1CNC[C@H]1C2CCOCC2 Amb35751720 [0,0,0,2,0,0|2,0,0]=4 388 B16R2.148 COC(=O)[C@H]1CCCN1C2CCNCC2 Amb2700007 [0,0,0,2,0,0|2,0,0]=4 389 B16R2.1255 COC(=O)C1CNCC12CCCCC2C Amb27878232 [0,0,0,2,0,0|1,0,0]=3 390 B16R2.2525 CCC1CCCC12CNCC2C(=O)OC Amb27426036 [0,0,0,2,0,0|1,0,0]=3 391 B16R2.2525 CCC1COCC12CNCC2C(=O)OC Amb35647006 [0,0,0,2,0,0|2,0,0]=4 392 B16R2.14939 O=C1NCCCCCCNC2CCCC12 Amb28723734 [0,0,0,2,0,0|2,0,0]=4 393 B16R2.14939 O=C1NCCCCCCN[C@@H]2CCC[C@H]12 Amb29073073 [0,0,0,2,0,0|2,0,0]=4 394 B16R2.34259 COC(=O)C1CNCC12CCCOCC2 Amb24508555 [0,0,0,2,0,0|2,0,0]=4 395 B16R2.170412 CCC(=O)CN1CCCC2CCCCC21 Amb27171768 [0,0,0,2,0,0|2,0,0]=4 396 B16R2.181944 COC(=O)CNC[C@@]12CCC[C@@H]1OCC2 Amb33099111 [0,0,0,2,0,0|2,0,0]=4 397 B16R2.213230 COC(=O)CNCC1CNCC12CCC2 Amb33038852 [0,0,0,2,0,0|2,0,0]=4 398 B16R2.145 COC(=O)C1CCCCC12CCNCC2 Amb33802741 [0,0,0,2,0,0|1,0,0]=3 399 B16R2.145 COC(=O)C1CNCCC12CCOCC2 Amb33803100 [0,0,0,2,0,0|2,0,0]=4 400 B16R2.2293 COC(=O)\C=C1\CCCC12CCCCC2 Amb28396701 [0,0,0,2,0,0|0,0,2]=4 401 B16R2.5952 CC1C(=O)CCC1CCC2CCCCO2 Amb30036343 [0,0,0,2,0,0|2,0,0]=4 402 B16R2.5952 CC1C(=O)CCC1CCC2CCOCC2 Amb27777714 [0,0,0,2,0,0|2,0,0]=4 403 B16R2.1160 COC(=O)C1CCCCN1C2CCCC2 Amb27783735 [0,0,0,2,0,0|1,0,0]=3 404 B16R2.1160 COC(=O)C1CCCCN1C2CCOC2 Amb27168894 [0,0,0,2,0,0|2,0,0]=4 405 B16R2.1160 COC(=O)C1CCCCN1C2CCSC2 Amb35637228 [0,0,0,2,0,0|2,0,0]=4 406 B16R2.1160 COC(=O)[C@H]1CCCCN1C2CCSC2 Amb35696865 [0,0,0,2,0,0|2,0,0]=4 407 B16R2.175518 COC(=O)CC12CCCCC1NCCC2 Amb35789170 [0,0,0,2,0,0|1,0,0]=3 408 B16R2.175518 COC(=O)CC12CCCCC1NCCC2 Amb35789322 [0,0,0,2,0,0|1,0,0]=3 409 B16R2.127128 CN1C(=O)CCC[C@@H]2NCCCC[C@@]21C Amb30530925 [0,0,0,2,0,0|2,0,0]=4 410 B16R2.1181 COC(=O)CNC1CC2CCCCN2C1 Amb32645119 [0,0,0,2,0,0|2,0,0]=4 411 B16R2.33912 COC(=O)C1CCN1C2CCCCC2C Amb27979556 [0,0,0,2,0,0|1,0,0]=3 412 B16R2.34082 COC(=O)C1COCCN1CC2CCC2 Amb33164169 [0,0,0,2,0,0|2,0,0]=4 413 B16R2.190228 CCC1CCCCCC12OC2C(=O)OC Amb33071067 [0,0,0,2,0,0|1,0,0]=3 414 B16R2.13582 O=C1CC2CCCCCCCCCCC12 Amb27830440 [0,0,0,2,0,0|1,0,0]=3 415 B16R2.13582 O=C1NC2CCCCCCCCCCC12 Amb33193014 [0,0,0,2,0,0|1,0,0]=3