0 B11R0.46 CCCCCN(C)CCC(=O)O Z1459932154 [0,0,0,0,0,0|1,0,0]=1 1 B11R0.46 NCCCCC(=O)NCC(=O)O Z1188070459 [0,0,0,0,0,0|3,0,1]=4 2 B10R0.4 C#CCCCCCCC(=O)O Z1255435221 [1,0,0,0,0,0|0,0,2]=3 3 B10R0.4 CC(=O)OCCCCCCN Z5197785028 [1,0,0,0,0,0|3,0,0]=4 4 B10R0.4 CCCCCCCCC(=O)N Z296759818 [1,0,0,0,0,0|1,0,0]=2 5 B10R0.4 CCCCCCCCC(=O)O Z104473336 [1,0,0,0,0,0|0,0,0]=1 6 B10R0.4 CCCCCCCCS(=O)C Z1198155780 [1,0,0,0,0,0|2,0,0]=3 7 B10R0.4 CCCCCCOCC(=O)O Z362795556 [1,0,0,0,0,0|1,0,0]=2 8 B10R0.4 CCOCCCCCC(=O)O Z1219750577 [1,0,0,0,0,0|1,0,0]=2 9 B10R0.4 COCCCOCCC(=O)O Z608071756 [1,0,0,0,0,0|2,0,0]=3 10 B10R0.4 COCCOCCCC(=O)O Z316259206 [1,0,0,0,0,0|2,0,0]=3 11 B10R0.4 CSCCCCCCC(=O)O Z1262519805 [1,0,0,0,0,0|1,0,0]=2 12 B10R0.4 NCCCCCCCC(=O)O Z1201625777 [1,0,0,0,0,0|1,0,0]=2 13 B10R0.78 CCCCC(O)CCC(=O)O Z838959646 [1,0,0,0,0,0|1,0,0]=2 14 B10R0.78 CCCNC(=O)CCC(=O)O Z90423791 [1,0,0,0,0,0|2,0,1]=4 15 B10R0.91 CCCCCN(C)CCC#N Z137832996 [1,0,0,0,0,0|2,0,1]=4 16 B10R0.91 CCCCNC(C)CCCC Z446072116 [1,0,0,0,0,0|2,0,1]=4 17 B12R0.124 CCCCCN(CC)CCC(=O)O Z3886315917 [0,1,0,0,0,0|1,0,0]=2 18 B12R0.141 CCSCCC(C)N(C)CC(=O)O Z1460008383 [0,1,0,0,0,0|2,0,0]=3 19 B12R0.142 CCCCCC(C)CNC(=S)NN Z56851198 [0,1,0,0,0,0|2,1,0]=4 20 B12R0.255 CCCCCCC(O)CCC(=O)[O-] Z2768516745 [0,1,0,0,0,0|1,0,1]=3 21 B12R0.255 COCCCCN(C)CCC(=O)O Z1459937344 [0,1,0,0,0,0|1,0,0]=2 22 B12R0.255 COCCCNC(=O)CCC(=O)O Z90425256 [0,1,0,0,0,0|2,0,1]=4 23 B12R1.54 O=C(O)CNC(=O)C1CCCC1 Z85886788 [0,0,0,1,0,0|2,0,1]=4 24 B12R1.210 O=C(O)CC1CCCCNC1=O Z1262530899 [0,0,0,1,0,0|2,0,1]=4 25 B12R1.226 CC(=O)NC[C@@H]1C[C@@H](CCN1)C Z4714305745 [0,0,0,1,0,0|3,0,0]=4 26 B12R1.226 CC1CCCC(C1)OCC(=O)O Z362795694 [0,0,0,1,0,0|1,0,0]=2 27 B12R1.226 CN1CCCC(C1)CCC(=O)O Z3244908710 [0,0,0,1,0,0|1,0,0]=2 28 B12R1.226 NC1CCCN(C1)CCC(=O)O Z4449634242 [0,0,0,1,0,0|2,0,0]=3 29 B12R1.226 O=C(O)CCC1CCCC(=O)N1 Z1262514420 [0,0,0,1,0,0|2,0,1]=4 30 B12R1.226 O=C(O)CCC1CCCC(C1)O Z2195333402 [0,0,0,1,0,0|1,0,0]=2 31 B12R1.226 O=C(O)CC[C@H]1CCC[C@H](C1)O Z4606560762 [0,0,0,1,0,0|1,0,0]=2 32 B12R1.528 CCCCNC1CCS(=O)(=O)C1 Z56956068 [0,0,0,1,0,0|2,0,1]=4 33 B12R1.1011 O=C1CCCCCC(C1)C(=O)O Z1262523591 [0,0,0,1,0,0|1,0,1]=3 34 B12R1.1343 O=C(O)CCC1CCCCNC1 Z5060031354 [0,0,0,1,0,0|1,0,0]=2 35 B12R1.1343 O=C(O)CCN1CCCCCC1 Z1171978831 [0,0,0,1,0,0|1,0,0]=2 36 B12R1.1343 O=C(O)CCN1CSCCSC1 Z2588062920 [0,0,0,1,0,0|3,0,0]=4 37 B12R1.3110 CC1(CCOCC1)/C=C/C(=O)O Z1262561088 [0,0,0,1,0,0|1,0,2]=4 38 B12R1.3110 NC1(CCCCC1)CCC(=O)O Z2900673592 [0,0,0,1,0,0|1,0,0]=2 39 B12R1.3110 NC1(CCOCC1)CCC(=O)O Z2935002206 [0,0,0,1,0,0|2,0,0]=3 40 B10R0.6 CCCCCC(C)CC(=O)O Z1198151370 [0,0,0,0,1,0|0,0,0]=1 41 B10R0.6 CCCCCC(O)CC(=O)O Z982131990 [0,0,0,0,1,0|1,0,0]=2 42 B9R0.2 C#CCCCCCC(=O)O Z1205493707 [2,0,0,0,0,0|0,0,2]=4 43 B9R0.2 CCCCCCCC(=O)O Z104495238 [2,0,0,0,0,0|0,0,0]=2 44 B9R0.2 CCCCCNCC(=O)N Z104536260 [2,0,0,0,0,0|2,0,0]=4 45 B9R0.2 CCCCCOCC(=O)O Z409357548 [2,0,0,0,0,0|1,0,0]=3 46 B9R0.2 CCCCSCCC(=O)O Z149304844 [2,0,0,0,0,0|1,0,0]=3 47 B9R0.2 CCNCCCCC(=O)O Z2893830564 [2,0,0,0,0,0|1,0,0]=3 48 B9R0.2 CCOCCOCC(=O)O Z316258972 [2,0,0,0,0,0|2,0,0]=4 49 B9R0.2 COCCNCCC(=O)O Z53116030 [2,0,0,0,0,0|2,0,0]=4 50 B9R0.2 COCCOCCC(=O)O Z316259200 [2,0,0,0,0,0|2,0,0]=4 51 B9R0.2 NCCCCCCC(=O)O Z56896351 [2,0,0,0,0,0|1,0,0]=3 52 B9R0.2 NCCOCCCC(=O)O Z5080450038 [2,0,0,0,0,0|2,0,0]=4 53 B9R0.2 O=C(O)CCNCCCO Z53116999 [2,0,0,0,0,0|2,0,0]=4 54 B9R0.45 CCCCCCCCCO Z104476100 [2,0,0,0,0,0|0,0,1]=3 55 B9R0.45 CCCCCCCNC=O Z1203732044 [2,0,0,0,0,0|1,0,0]=3 56 B9R0.45 CCCCCCNCCO Z137800948 [2,0,0,0,0,0|1,0,1]=4 57 B9R0.45 CCCCOCCCCO Z993012624 [2,0,0,0,0,0|1,0,1]=4 58 B9R0.45 NCCCCCCCCO Z4745386600 [2,0,0,0,0,0|1,0,1]=4 59 B9R0.48 CCCN(C)CCC(=O)O Z1259273124 [2,0,0,0,0,0|1,0,0]=3 60 B9R0.48 CN(CCO)CCC(=O)O Z53116523 [2,0,0,0,0,0|2,0,0]=4 61 B9R0.48 COCC(C)NCC(=O)O Z1259273105 [2,0,0,0,0,0|2,0,0]=4 62 B9R0.5 CCCCCC(O)CCO Z1198158015 [2,0,0,0,0,0|1,0,0]=3 63 B11R0.2 CCCCCCC(C)CC(=O)O Z362824108 [1,1,0,0,0,0|0,0,0]=2 64 B11R0.2 CCCCCCN(C)CC(=O)O Z1259273334 [1,1,0,0,0,0|1,0,0]=3 65 B11R0.30 CC(=O)CCCCCCC(=O)C Z1198162235 [1,1,0,0,0,0|1,0,1]=4 66 B11R0.30 CC(=O)CCCCCCC(=O)O Z1262510893 [1,1,0,0,0,0|0,0,1]=3 67 B11R0.30 CC(=O)NCCCCCC(=O)O Z56914861 [1,1,0,0,0,0|1,0,1]=4 68 B11R0.30 CC(C)CCNCCCC(=O)O Z1696091863 [1,1,0,0,0,0|1,0,0]=3 69 B11R0.30 O=C(O)CCCCCCC(=O)O Z104473456 [1,1,0,0,0,0|1,0,1]=4 70 B11R0.40 COC(=O)CCCCCCCN Z1416203196 [1,1,0,0,0,0|1,0,0]=3 71 B11R0.42 C#CCCCCCC(N)C(=O)O Z4920921873 [1,1,0,0,0,0|0,0,2]=4 72 B11R0.42 CCOCCNCC(C)C(=O)O Z1270387257 [1,1,0,0,0,0|2,0,0]=4 73 B11R0.111 CCC(N)COCCCC(=O)O Z5332674953 [1,1,0,0,0,0|1,0,0]=3 74 B11R0.147 CCCNC(=O)CCCC(=O)O Z90423792 [1,1,0,0,0,0|1,0,1]=4 75 B11R0.148 CCCCCCCCCC(=O)O Z104474944 [1,1,0,0,0,0|0,0,0]=2 76 B11R0.148 CCCCCCCCNC(=O)C Z1509141066 [1,1,0,0,0,0|1,0,0]=3 77 B11R0.148 CCCCCCCNCC(=O)O Z1259273296 [1,1,0,0,0,0|0,0,0]=2 78 B11R0.148 CNCCCNCCCC(=O)O Z1537009544 [1,1,0,0,0,0|1,0,0]=3 79 B11R0.59 CCCC(C)N(C)CCC(=O)O Z1465347640 [1,1,0,0,0,0|1,0,0]=3 80 B11R0.163 CCCCS(=O)C[C@H](N)C(=O)O Z1198151261 [1,1,0,0,0,0|2,0,0]=4 81 B11R0.6 CC(=CCCC(C)CC(=O)O)C Z1255423445 [0,1,0,0,1,0|0,0,2]=4 82 B11R0.324 CCCCCS(=O)(=O)CC(=O)O Z295402342 [0,1,0,0,1,0|2,0,0]=4 83 B13R0.345 CCCCC(=O)N(C)CCCC(=O)O Z224146540 [0,1,0,0,0,1|1,0,1]=4 84 B13R0.264 CCCC(C)C(=O)N(C)CCC(=O)O Z715586598 [0,2,0,0,0,0|1,0,1]=4 85 B13R0.193 CCCCCC(=O)CCC(=O)OCC Z838956842 [0,2,0,0,0,0|1,0,1]=4 86 B13R0.1256 CCCCCC(C)(C)CNC(=O)NC Z1389115937 [0,2,0,0,0,0|2,0,0]=4 87 B13R0.154 COCCOCCN(C)CCC(=O)O Z1459937315 [0,2,0,0,0,0|1,0,0]=3 88 B11R1.27 CCCCCC1CCC(=O)O1 Z1255430984 [1,0,0,1,0,0|0,0,0]=2 89 B11R1.53 CCC1CCCCC1C(=O)O Z1162465707 [1,0,0,1,0,0|0,0,0]=2 90 B11R1.53 CCC1CCCCN1C(=O)N Z235248554 [1,0,0,1,0,0|2,0,0]=4 91 B11R1.53 CCC1OCCCC1C(=O)O Z1318264671 [1,0,0,1,0,0|1,0,0]=3 92 B11R1.53 CCN1CCCCC1C(=O)O Z803129924 [1,0,0,1,0,0|1,0,0]=3 93 B11R1.53 CCN1CCOCC1C(=O)O Z1582264059 [1,0,0,1,0,0|2,0,0]=4 94 B11R1.53 COC1CCCCC1C(=O)O Z1080715176 [1,0,0,1,0,0|1,0,0]=3 95 B11R1.53 COC1CCNCC1C(=O)O Z4105034441 [1,0,0,1,0,0|2,0,0]=4 96 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Z2915026000 [1,0,0,1,0,0|1,0,0]=3 97 B11R1.57 CCN1CCCC1CC(=O)O Z1695906928 [1,0,0,1,0,0|1,0,0]=3 98 B11R1.57 O=C(O)CN1CCCC1CO Z817025854 [1,0,0,1,0,0|2,0,0]=4 99 B11R1.86 CC(=O)NC1CCCCC1C Z32972082 [1,0,0,1,0,0|2,0,0]=4 100 B11R1.86 CC1CCCCC1CC(=O)O Z352783476 [1,0,0,1,0,0|0,0,0]=2 101 B11R1.86 CC1CCCCC1NC(=O)N Z56985817 [1,0,0,1,0,0|2,0,0]=4 102 B11R1.86 CC1CCCCN1CC(=O)N Z54751033 [1,0,0,1,0,0|2,0,0]=4 103 B11R1.86 CC1CCNCC1CC(=O)O Z2515281558 [1,0,0,1,0,0|1,0,0]=3 104 B11R1.86 CN1CCCCC1CC(=O)O Z2106602368 [1,0,0,1,0,0|1,0,0]=3 105 B11R1.86 NC1CCOCC1CC(=O)O Z2732475544 [1,0,0,1,0,0|2,0,0]=4 106 B11R1.86 N[C@@H]1CCCC[C@@H]1CC(=O)O Z2235791115 [1,0,0,1,0,0|1,0,0]=3 107 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1O Z1262514098 [1,0,0,1,0,0|1,0,0]=3 108 B11R1.90 CN1CCCC1CCC(=O)O Z2517419474 [1,0,0,1,0,0|1,0,0]=3 109 B11R1.91 CC(=O)CCC1CCCCC1 Z406376884 [1,0,0,1,0,0|1,0,0]=3 110 B11R1.91 CC(O)CCC1CCCCC1 Z854048750 [1,0,0,1,0,0|1,0,1]=4 111 B11R1.91 NC(=O)CCC1CCCCC1 Z33547070 [1,0,0,1,0,0|1,0,0]=3 112 B11R1.91 NC(=O)CCC1CCCNC1 Z852089132 [1,0,0,1,0,0|2,0,0]=4 113 B11R1.91 NC(=O)CCC1CCNCC1 Z963586266 [1,0,0,1,0,0|2,0,0]=4 114 B11R1.91 NC(=O)NCC1CCCCC1 Z198194728 [1,0,0,1,0,0|2,0,0]=4 115 B11R1.91 O=C(O)/C=C/C1CCCCC1 Z975822798 [1,0,0,1,0,0|0,0,2]=4 116 B11R1.91 O=C(O)CCC1CCCCC1 Z104479892 [1,0,0,1,0,0|0,0,0]=2 117 B11R1.91 O=C(O)CCC1CCCCN1 Z1526503392 [1,0,0,1,0,0|1,0,0]=3 118 B11R1.91 O=C(O)CCC1CCCCO1 Z1167042736 [1,0,0,1,0,0|1,0,0]=3 119 B11R1.91 O=C(O)CCC1CCCNC1 Z839027062 [1,0,0,1,0,0|1,0,0]=3 120 B11R1.91 O=C(O)CCC1CCCOC1 Z1154555237 [1,0,0,1,0,0|1,0,0]=3 121 B11R1.91 O=C(O)CCC1CCNCC1 Z364250128 [1,0,0,1,0,0|1,0,0]=3 122 B11R1.91 O=C(O)CCC1CCOCC1 Z979765670 [1,0,0,1,0,0|1,0,0]=3 123 B11R1.91 O=C(O)CCC1CNCCO1 Z3326049576 [1,0,0,1,0,0|2,0,0]=4 124 B11R1.91 O=C(O)CCN1CCCCC1 Z744843478 [1,0,0,1,0,0|1,0,0]=3 125 B11R1.91 O=C(O)CCN1CCNCC1 Z57683717 [1,0,0,1,0,0|2,0,0]=4 126 B11R1.91 O=C(O)CCN1CCOCC1 Z57683745 [1,0,0,1,0,0|2,0,0]=4 127 B11R1.91 O=C(O)CNC1CCCCC1 Z1259273154 [1,0,0,1,0,0|1,0,0]=3 128 B11R1.91 O=C(O)CNC1CCNCC1 Z1694636318 [1,0,0,1,0,0|2,0,0]=4 129 B11R1.91 O=C(O)COC1CCCCC1 Z316258722 [1,0,0,1,0,0|1,0,0]=3 130 B11R1.91 O=C(O)COC1CCCOC1 Z1898756150 [1,0,0,1,0,0|2,0,0]=4 131 B11R1.91 O=C(O)COC1CCNCC1 Z1511483985 [1,0,0,1,0,0|2,0,0]=4 132 B11R1.91 O=C(O)COC1CCOCC1 Z802587584 [1,0,0,1,0,0|2,0,0]=4 133 B11R1.91 O=C(O)CSC1CCCCO1 Z1262516824 [1,0,0,1,0,0|2,0,0]=4 134 B11R1.101 O=C1CCCCCCCCN1 Z1255465322 [1,0,0,1,0,0|1,0,0]=3 135 B11R1.143 NC(=O)C1CCCCCC1N Z1407673034 [1,0,0,1,0,0|2,0,0]=4 136 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Z2306862306 [1,0,0,1,0,0|1,0,0]=3 137 B11R1.172 CC(=O)NCCC1CCCC1 Z318202282 [1,0,0,1,0,0|2,0,0]=4 138 B11R1.172 O=C(O)CCCC1CCCC1 Z1209411148 [1,0,0,1,0,0|0,0,0]=2 139 B11R1.172 O=C(O)CCCN1CCCC1 Z763029994 [1,0,0,1,0,0|1,0,0]=3 140 B11R1.172 O=C(O)CCNC1CCCC1 Z910841990 [1,0,0,1,0,0|1,0,0]=3 141 B11R1.172 O=C(O)CCSC1CCCC1 Z102926388 [1,0,0,1,0,0|1,0,0]=3 142 B11R1.172 O=C(O)CNCC1CCCO1 Z4840900390 [1,0,0,1,0,0|2,0,0]=4 143 B11R1.172 O=C(O)COCC1CCCC1 Z1255418412 [1,0,0,1,0,0|1,0,0]=3 144 B11R1.172 O=C(O)COCC1CCCO1 Z316259308 [1,0,0,1,0,0|2,0,0]=4 145 B11R1.172 O=C(O)COCC1CCOC1 Z825745840 [1,0,0,1,0,0|2,0,0]=4 146 B11R1.172 O=C(O)CSCC1CCCO1 Z239951478 [1,0,0,1,0,0|2,0,0]=4 147 B11R1.193 CCCC1CCCC1C(=O)O Z1434224393 [1,0,0,1,0,0|0,0,0]=2 148 B11R1.193 CCCC1CCNC1C(=O)O Z2217033073 [1,0,0,1,0,0|1,0,0]=3 149 B11R1.193 CCCN1CCCC1C(=O)O Z326520902 [1,0,0,1,0,0|1,0,0]=3 150 B11R1.706 O=C(O)C1CCCCCCC1 Z792377154 [1,0,0,1,0,0|0,0,0]=2 151 B11R1.706 O=C(O)C1CCCCCCN1 Z1998612770 [1,0,0,1,0,0|1,0,0]=3 152 B11R1.742 CC(=O)CN1CCCCCC1 Z56041634 [1,0,0,1,0,0|2,0,0]=4 153 B11R1.742 CC(=O)NC1CCCCCC1 Z32452010 [1,0,0,1,0,0|2,0,0]=4 154 B11R1.742 NC(=O)CC1CCCCCC1 Z1262638694 [1,0,0,1,0,0|1,0,0]=3 155 B11R1.742 NC(=O)CC1CCCNCC1 Z1746998025 [1,0,0,1,0,0|2,0,0]=4 156 B11R1.742 O=C(O)CC1CCCCCC1 Z352783664 [1,0,0,1,0,0|0,0,0]=2 157 B11R1.742 O=C(O)CC1CCCNCC1 Z2830496103 [1,0,0,1,0,0|1,0,0]=3 158 B11R1.742 O=C(O)CN1CCCCCC1 Z1171978829 [1,0,0,1,0,0|1,0,0]=3 159 B11R1.742 O=C(O)CN1CCCNCC1 Z1259161963 [1,0,0,1,0,0|2,0,0]=4 160 B11R1.75 CC1CCC(O1)CCC(=O)O Z1262470998 [1,0,0,1,0,0|1,0,0]=3 161 B11R1.75 CN1CCC(C1)CCC(=O)O Z5380297895 [1,0,0,1,0,0|1,0,0]=3 162 B11R1.75 NC1CCC(C1)CCC(=O)O Z4390881825 [1,0,0,1,0,0|1,0,0]=3 163 B11R1.75 O=C(O)CCN1CCC(C1)F Z2733346657 [1,0,0,1,0,0|2,0,0]=4 164 B11R1.167 CC1CC(C(CN1)C)C(=O)O Z3214138136 [1,0,0,1,0,0|1,0,0]=3 165 B11R1.167 CC1CCC(C(N1)C(=O)O)C Z4075226032 [1,0,0,1,0,0|1,0,0]=3 166 B11R1.495 CC1CCC(N1CC(=O)O)C Z608708802 [1,0,0,1,0,0|1,0,0]=3 167 B11R1.713 NC1(CCCC1)CCC(=O)O Z3085811385 [1,0,0,1,0,0|1,0,0]=3 168 B11R1.713 NC1(CCOC1)CCC(=O)O Z2941795757 [1,0,0,1,0,0|2,0,0]=4 169 B11R1.203 OCCCN1CCCCCC1 Z3069017316 [1,0,0,1,0,0|1,0,1]=4 170 B11R1.203 OCCNC1CCCCCC1 Z1862093141 [1,0,0,1,0,0|1,0,1]=4 171 B11R1.43 NCC1CC(CO1)CC(=O)O Z3481962152 [0,0,0,1,1,0|2,0,0]=4 172 B11R1.77 CN(CC(=O)N)C1CCCC1 Z169488320 [0,0,0,1,1,0|2,0,0]=4 173 B11R1.77 NC(CC(=O)O)C1CCCC1 Z975823288 [0,0,0,1,1,0|1,0,0]=3 174 B11R1.157 CC1CCCC(C1)CC(=O)O Z352783434 [0,0,0,1,1,0|0,0,0]=2 175 B11R1.157 CC1CCCN(C1)CC(=O)N Z54749656 [0,0,0,1,1,0|2,0,0]=4 176 B11R1.157 CC1CNCC(C1)CC(=O)O Z2235790824 [0,0,0,1,1,0|1,0,0]=3 177 B11R1.157 CC1CNCC(O1)CC(=O)O Z3991477375 [0,0,0,1,1,0|2,0,0]=4 178 B11R1.157 CC1COCC(O1)CC(=O)O Z5033360121 [0,0,0,1,1,0|2,0,0]=4 179 B11R1.157 CN1CCCC(C1)CC(=O)O Z2310699362 [0,0,0,1,1,0|1,0,0]=3 180 B11R1.157 C[C@@H]1CCC[C@@H](O1)CC(=O)O Z4946669801 [0,0,0,1,1,0|1,0,0]=3 181 B11R1.157 NC(=O)CC1CCCC(C1)N Z4439100400 [0,0,0,1,1,0|2,0,0]=4 182 B11R1.157 NC1CCCC(C1)CC(=O)O Z5087190945 [0,0,0,1,1,0|1,0,0]=3 183 B11R1.157 NC1CCOC(C1)CC(=O)O Z4579787506 [0,0,0,1,1,0|2,0,0]=4 184 B11R1.157 O=C(O)CC1CCCC(=O)C1 Z907709938 [0,0,0,1,1,0|1,0,1]=4 185 B11R1.157 O=C(O)CC1CCCC(C1)O Z1262524441 [0,0,0,1,1,0|1,0,0]=3 186 B11R1.928 CC1(CCCCC1)CC(=O)O Z1255466882 [0,0,0,1,1,0|0,0,0]=2 187 B11R1.928 CC1(CCNCC1)CC(=O)O Z5590137993 [0,0,0,1,1,0|1,0,0]=3 188 B11R1.928 NC(=O)CC1(CCCCC1)N Z2941400913 [0,0,0,1,1,0|2,0,0]=4 189 B11R1.928 NC1(CCCCC1)CC(=O)O Z1741975256 [0,0,0,1,1,0|1,0,0]=3 190 B11R1.928 NC1(CCNCC1)CC(=O)O Z1624323979 [0,0,0,1,1,0|2,0,0]=4 191 B11R1.928 NC1(CCOCC1)CC(=O)O Z2255110164 [0,0,0,1,1,0|2,0,0]=4 192 B11R1.928 O=C(O)CC1(CCCCC1)O Z982131964 [0,0,0,1,1,0|1,0,0]=3 193 B11R1.928 O=C(O)CC1(CCNCC1)O Z3488912123 [0,0,0,1,1,0|2,0,0]=4 194 B11R1.928 O=C(O)CC1(CCOCC1)O Z982132196 [0,0,0,1,1,0|2,0,0]=4 195 B13R1.342 CC(COCC(=O)O)N1CCCC1 Z2235330303 [0,0,0,1,0,1|1,0,0]=3 196 B13R1.342 O=C(O)CCNC(=O)C1CCCC1 Z85914439 [0,0,0,1,0,1|1,0,1]=4 197 B13R1.658 CCCCCC1NC(CS1)C(=O)O Z362825440 [0,0,0,1,0,1|1,0,0]=3 198 B13R1.1988 CC(=O)NCCN1CCCCCC1 Z4913683373 [0,0,0,1,0,1|2,0,0]=4 199 B13R1.3787 CC1CCCC(N1CCC(=O)O)C Z1465342223 [0,0,0,1,0,1|0,0,0]=2 200 B13R1.165 CC(C)[C@@H]1CC[C@@H](C[C@H]1C(=O)O)C Z3774619187 [0,1,0,1,0,0|0,0,0]=2 201 B13R1.45 CN(CCC(=O)O)C1CCCCC1 Z1465342168 [0,1,0,1,0,0|1,0,0]=3 202 B13R1.45 CN(CCC(=O)O)C1CCNCC1 Z1824511419 [0,1,0,1,0,0|1,0,0]=3 203 B13R1.2398 NC[C@@H]1C[C@H]([C@H](C[C@@H]1C(=O)O)O)O Z4457865380 [0,1,0,1,0,0|2,0,0]=4 204 B13R1.148 CC1CCCC(C1)OC(C)C(=O)O Z362795716 [0,1,0,1,0,0|1,0,0]=3 205 B13R1.6192 CC(OC1CCCCCC1)C(=O)O Z756083816 [0,1,0,1,0,0|1,0,0]=3 206 B13R1.6192 N[C@@H](CC1CCCCCC1)C(=O)O Z1762997304 [0,1,0,1,0,0|0,0,0]=2 207 B13R1.3 CCN1CCN(CC1)CCC(=O)O Z802671570 [0,1,0,1,0,0|2,0,0]=4 208 B13R1.147 CC(CC(=O)O)N1CCCC(C1)N Z4453949258 [0,1,0,1,0,0|2,0,0]=4 209 B13R1.7456 NC(CC(=O)O)C1CCCCCC1 Z3013901756 [0,1,0,1,0,0|0,0,0]=2 210 B13R1.15 COC(=O)CCN1CCCC(C1)N Z4496034551 [0,1,0,1,0,0|2,0,0]=4 211 B13R1.1711 COC(=O)CCC1CCCCNC1 Z5174570295 [0,1,0,1,0,0|1,0,0]=3 212 B13R1.1711 NNC(=O)CCN1CCCCCC1 Z56974905 [0,1,0,1,0,0|2,0,0]=4 213 B13R1.2045 COC(=O)CCC1(CCCCC1)N Z2900981688 [0,1,0,1,0,0|1,0,0]=3 214 B13R1.4928 C=CC(=O)NC1C(CCCC1C)C Z2517214421 [0,1,0,1,0,0|2,0,0]=4 215 B13R1.344 CC(=O)NCC(C)CN1CCCC1 Z737654020 [0,1,0,1,0,0|2,0,0]=4 216 B13R1.344 O=C(O)CCC(=O)NC1CCCC1 Z90423879 [0,1,0,1,0,0|1,0,1]=4 217 B13R1.3420 CC1CC(CN(C1)CCC(=O)O)N Z4390869670 [0,1,0,1,0,0|1,0,0]=3 218 B13R1.588 O=C(O)CCS(=O)(=O)C1CCCC1 Z295403590 [0,1,0,1,0,0|2,0,0]=4 219 B13R1.8832 O=C(O)CC1CCNCCC1(F)F Z3475827369 [0,1,0,1,0,0|2,0,0]=4 220 B13R2.12 O=C1CCN(CC1)C2CCCC2 Z295399704 [0,0,0,2,0,0|2,0,0]=4 221 B13R2.5037 O=C1C=CC2(CCCCC2)CC1 Z1255468299 [0,0,0,2,0,0|1,0,1]=4 222 B13R2.5037 O=C1CCC2(CCCCC2)CC1 Z1255383084 [0,0,0,2,0,0|1,0,0]=3 223 B13R2.5037 O=C1CCC2(CCNCC2)CC1 Z1954803451 [0,0,0,2,0,0|2,0,0]=4 224 B13R2.5037 O=C1CCC2(CCOCC2)CC1 Z1255397922 [0,0,0,2,0,0|2,0,0]=4 225 B13R2.5509 O=C(O)C1CC2CCC1CNC2 Z3771620164 [0,0,0,2,0,0|1,0,0]=3 226 B13R2.5509 O=C(O)C1CC2CCCC1CC2 Z1262522809 [0,0,0,2,0,0|0,0,0]=2 227 B13R2.5509 O=C(O)C1CN2CCCC1CC2 Z5211069993 [0,0,0,2,0,0|1,0,0]=3 228 B13R2.5509 O=C(O)C1CN2CCCN1CC2 Z1528678311 [0,0,0,2,0,0|2,0,0]=4 229 B13R2.235 O=C(O)C1CC(=O)C12CCCC2 Z4444420104 [0,0,0,2,0,0|1,0,1]=4 230 B13R2.436 O=C(O)C1CN(C1)C2CCOC2 Z1217192528 [0,0,0,2,0,0|2,0,0]=4 231 B13R2.436 O=C(O)[C@H]1C[C@H](C1)N2CCCC2 Z5357300235 [0,0,0,2,0,0|1,0,0]=3 232 B13R2.2349 CC1(CNC(=O)C1)C2CCCC2 Z1270255680 [0,0,0,2,0,0|2,0,0]=4 233 B13R2.5511 CC1(CC1C(=O)O)C2CCOC2 Z1705842963 [0,0,0,2,0,0|1,0,0]=3 234 B13R2.13858 O=C(O)CCC12CCC(C1)CC2 Z3480644025 [0,0,0,2,0,0|0,0,0]=2 235 B13R2.13972 O=C(O)[C@@H]1C[C@H]2[C@@H]1CCCCC2 Z3486445533 [0,0,0,2,0,0|0,0,0]=2 236 B13R2.433 O=C(O)C1CC2CCCC(C2)C1 Z414834580 [0,0,0,2,0,0|0,0,0]=2 237 B13R2.433 O=C(O)C1CC2CCCN(C2)C1 Z5228629247 [0,0,0,2,0,0|1,0,0]=3 238 B13R2.433 O=C(O)[C@@H]1C[C@@H]2CSC[C@@H](C2)C1 Z4521801945 [0,0,0,2,0,0|1,0,0]=3 239 B13R2.433 O=C(O)[C@H]1C[C@H]2C=CC[C@H](C2)C1 Z4478802065 [0,0,0,2,0,0|0,0,2]=4 240 B13R2.433 O=C(O)[C@H]1C[C@H]2CNC[C@H](C2)C1 Z4765703666 [0,0,0,2,0,0|1,0,0]=3 241 B13R2.433 O=C(O)[C@H]1C[C@H]2COC[C@H](C2)C1 Z4512542729 [0,0,0,2,0,0|1,0,0]=3 242 B13R2.11132 CC1CC2(CCO1)CC2C(=O)O Z1192355697 [0,0,0,2,0,0|1,0,0]=3 243 B13R2.354 O=C(O)C12CCCN1CC(C2)O Z4951365714 [0,0,0,2,0,0|2,0,0]=4 244 B13R2.12149 O=C1CC(C2(C1)CCC2)C(=O)O Z3300298042 [0,0,0,2,0,0|1,0,1]=4 245 B13R2.13132 O=C1CC2(CCCCCC2)CN1 Z1198235317 [0,0,0,2,0,0|2,0,0]=4 246 B13R2.13132 O=C1NCC2(O1)CCCNCC2 Z5065206115 [0,0,0,2,0,0|2,0,0]=4 247 B13R2.13968 NC(=O)N1CC2(C1)CCCCC2 Z1681183186 [0,0,0,2,0,0|2,0,0]=4 248 B13R2.13968 O=C(O)C1CC2(C1)CCCCC2 Z1258538520 [0,0,0,2,0,0|0,0,0]=2 249 B13R2.13968 O=C(O)C1CC2(C1)CCNCC2 Z3800523226 [0,0,0,2,0,0|1,0,0]=3 250 B9R0.4 CC(CC(=O)O)NCCO Z431539096 [1,0,0,0,1,0|2,0,0]=4 251 B9R0.47 CC(CSCCN)C(=O)O Z2379806326 [0,0,0,0,2,0|2,0,0]=4 252 B9R0.47 CCCCCC(O)C(=O)O Z788000584 [0,0,0,0,2,0|1,0,0]=3 253 B9R0.47 CCCCOC(C)C(=O)O Z409190966 [0,0,0,0,2,0|1,0,0]=3 254 B9R0.47 CCCCSC(C)C(=O)O Z149191762 [0,0,0,0,2,0|1,0,0]=3 255 B9R0.47 CCCSCC(N)C(=O)O Z444349874 [0,0,0,0,2,0|2,0,0]=4 256 B9R0.47 COCCCC(N)C(=O)O Z1428160326 [0,0,0,0,2,0|2,0,0]=4 257 B9R0.47 COCCOC(C)C(=O)O Z316259198 [0,0,0,0,2,0|2,0,0]=4 258 B9R0.47 CSCCCC(N)C(=O)O Z3274997631 [0,0,0,0,2,0|2,0,0]=4 259 B9R0.47 NCCCCC(N)C(=O)O Z57127389 [0,0,0,0,2,0|2,0,0]=4 260 B9R0.47 NCCCC[C@H](N)C(=O)O Z812534818 [0,0,0,0,2,0|2,0,0]=4