0 B14R0.140 C#CC(=O)COC(=O)CCCCCCC 1458a_100000211873_100009852258 [0,0,0,0,0,0|1,0,3]=4 1 B14R0.140 C#CCCCCCC(=O)NCC(C)CO 240690a_100000744482_100000694772 [0,0,0,0,0,0|2,0,2]=4 2 B14R0.140 C#CCCCCCC(=O)NCC(C)CO 527a_100000744482_100000694772 [0,0,0,0,0,0|2,0,2]=4 3 B14R0.140 C#CCCCCCC(=O)NCC(O)CC 11a_100011218483_100000694772 [0,0,0,0,0,0|2,0,2]=4 4 B14R0.140 C#CCCCCCC(=O)NCC(O)CC 240690a_100011218483_100000694772 [0,0,0,0,0,0|2,0,2]=4 5 B14R0.140 C#CCCCCCC(=O)NCC(O)CC 527a_100011218483_100000694772 [0,0,0,0,0,0|2,0,2]=4 6 B14R0.140 C#CCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000694772 [0,0,0,0,0,0|2,0,2]=4 7 B14R0.140 C#CCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100000694772 [0,0,0,0,0,0|2,0,2]=4 8 B14R0.140 C#CCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000694772 [0,0,0,0,0,0|1,0,2]=3 9 B14R0.140 C#CCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000694772 [0,0,0,0,0,0|1,0,2]=3 10 B14R0.140 C#CCCCCNC(=O)NC[C@H](O)CO 2708a_100000706060_100020644852 [0,0,0,0,0,0|2,0,2]=4 11 B14R0.140 C#CCCCCNC(=O)NC[C@H](O)CO 273464a_100000706060_100020644852 [0,0,0,0,0,0|2,0,2]=4 12 B14R0.140 C#CCCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000706060 [0,0,0,0,0,0|2,0,2]=4 13 B14R0.140 C#CCCCNCC(=O)NCC(O)CO 34a_100000718082_200012027429 [0,0,0,0,0,0|2,0,2]=4 14 B14R0.140 C#CCCCOCC(=O)NCC(O)CO 34a_100000215630_200012027429 [0,0,0,0,0,0|2,0,2]=4 15 B14R0.140 C#CCCCOCC(=O)NCC(O)CO 7a_100000215630_200012027429 [0,0,0,0,0,0|2,0,2]=4 16 B14R0.140 C#CCCCSCC(=O)NCC(O)CO 62a_100011215417_200012027429 [0,0,0,0,0,0|2,0,2]=4 17 B14R0.140 C#CCCCSCC(=O)NCC(O)CO 62a_200012027429_100011215417 [0,0,0,0,0,0|2,0,2]=4 18 B14R0.140 C/C=C/CCOCC(=O)NCC(O)CO 34a_100016278192_200012027429 [0,0,0,0,0,0|2,0,2]=4 19 B14R0.140 C=CC(=O)COC(=O)CCCCCCC 1458a_100000185746_100009852258 [0,0,0,0,0,0|1,0,3]=4 20 B14R0.140 C=CC(O)COC(C)CCCCCCC 34a_200011215852_100000730141 [0,0,0,0,0,0|2,0,2]=4 21 B14R0.140 C=CC(O)COC(C)CCCCCCC 7a_200011215852_100000730141 [0,0,0,0,0,0|2,0,2]=4 22 B14R0.140 C=CCCCCCC(=O)NCC(C)CO 240690a_100000744482_100011934241 [0,0,0,0,0,0|2,0,2]=4 23 B14R0.140 C=CCCCCCC(=O)NCC(C)CO 527a_100000744482_100011934241 [0,0,0,0,0,0|2,0,2]=4 24 B14R0.140 C=CCCCCCC(=O)NCC(O)CC 11a_100011218483_100011934241 [0,0,0,0,0,0|2,0,2]=4 25 B14R0.140 C=CCCCCCC(=O)NCC(O)CC 240690a_100011218483_100011934241 [0,0,0,0,0,0|2,0,2]=4 26 B14R0.140 C=CCCCCCC(=O)NCC(O)CC 527a_100011218483_100011934241 [0,0,0,0,0,0|2,0,2]=4 27 B14R0.140 C=CCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100011934241 [0,0,0,0,0,0|2,0,2]=4 28 B14R0.140 C=CCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100011934241 [0,0,0,0,0,0|2,0,2]=4 29 B14R0.140 C=CCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100011934241 [0,0,0,0,0,0|1,0,2]=3 30 B14R0.140 C=CCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100011934241 [0,0,0,0,0,0|1,0,2]=3 31 B14R0.140 C=CCCCCNC(=O)NC[C@H](O)CO 2708a_100000703577_100020644852 [0,0,0,0,0,0|2,0,2]=4 32 B14R0.140 C=CCCCCNC(=O)NC[C@H](O)CO 273464a_100000703577_100020644852 [0,0,0,0,0,0|2,0,2]=4 33 B14R0.140 C=CCCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000703577 [0,0,0,0,0,0|2,0,2]=4 34 B14R0.140 C=CCCCNCC(=O)NCC(O)CO 2230a_100000700776_200012027429 [0,0,0,0,0,0|2,0,2]=4 35 B14R0.140 C=CCCCNCC(=O)NCC(O)CO 34a_100000700776_200012027429 [0,0,0,0,0,0|2,0,2]=4 36 B14R0.140 C=CCCCOCC(=O)NCC(O)CO 34a_100000758997_200012027429 [0,0,0,0,0,0|2,0,2]=4 37 B14R0.140 C=CCCCOCC(=O)NCC(O)CO 7a_100000758997_200012027429 [0,0,0,0,0,0|2,0,2]=4 38 B14R0.140 C=CCCCSCC(=O)NCC(O)CO 62a_100011713584_200012027429 [0,0,0,0,0,0|2,0,2]=4 39 B14R0.140 C=CCCCSCC(=O)NCC(O)CO 62a_200012027429_100000757094 [0,0,0,0,0,0|2,0,2]=4 40 B14R0.140 CC#CCCOCC(=O)NCC(O)CO 34a_100000750427_200012027429 [0,0,0,0,0,0|2,0,2]=4 41 B14R0.140 CC(CO)CNC(=O)CCCCCCO 240690a_100000744482_100011996774 [0,0,0,0,0,0|3,0,0]=3 42 B14R0.140 CC(CO)CNC(=O)NCCCCCO 273464a_100000744482_100000762737 [0,0,0,0,0,0|4,0,0]=4 43 B14R0.140 CC(CO)CNC(=O)NCCCCCO 273464a_100000762737_100000744482 [0,0,0,0,0,0|4,0,0]=4 44 B14R0.140 CC(CO)CNC(=O)NCCCCCO 512a_100000744482_100000762737 [0,0,0,0,0,0|4,0,0]=4 45 B14R0.140 CC(CO)CNC(=O)NCCCCCO 512a_100000762737_100000744482 [0,0,0,0,0,0|4,0,0]=4 46 B14R0.140 CC/C=C\COCC(=O)NCC(O)CO 34a_100016268518_200012027429 [0,0,0,0,0,0|2,0,2]=4 47 B14R0.140 CC/C=C\CSCC(=O)NCC(O)CO 62a_100103147603_200012027429 [0,0,0,0,0,0|2,0,2]=4 48 B14R0.140 CC/C=C\CSCC(=O)NCC(O)CO 62a_200012027429_100103147603 [0,0,0,0,0,0|2,0,2]=4 49 B14R0.140 CCC#CCOCC(=O)NCC(O)CO 34a_100000032950_200012027429 [0,0,0,0,0,0|2,0,2]=4 50 B14R0.140 CCC#CCSCC(=O)NCC(O)CO 62a_100009813939_200012027429 [0,0,0,0,0,0|2,0,2]=4 51 B14R0.140 CCC#CCSCC(=O)NCC(O)CO 62a_200012027429_100009813939 [0,0,0,0,0,0|2,0,2]=4 52 B14R0.140 CCC(C)CCC(=O)CCCCCCF 1458a_100000701222_100015922095 [0,0,0,0,0,0|4,0,0]=4 53 B14R0.140 CCC(C)CCC(=O)CCCCCCO 1458a_100000701222_100000766143 [0,0,0,0,0,0|4,0,0]=4 54 B14R0.140 CCC(C)CNC(=O)CCCCCCO 240690a_100020588543_100011996774 [0,0,0,0,0,0|4,0,0]=4 55 B14R0.140 CCC(C)CNC(=O)CCCCCOC 11a_100020588543_100011935119 [0,0,0,0,0,0|4,0,0]=4 56 B14R0.140 CCC(C)CNC(=O)CCCCCOC 1626a_100020588543_100011935119 [0,0,0,0,0,0|4,0,0]=4 57 B14R0.140 CCC(C)CNC(=O)CCCCCOC 240690a_100020588543_100011935119 [0,0,0,0,0,0|4,0,0]=4 58 B14R0.140 CCC(C)CNC(=O)CCCCCOC 527a_100020588543_100011935119 [0,0,0,0,0,0|4,0,0]=4 59 B14R0.140 CCC(O)CCC(=O)NCCCCCO 240690a_100000762737_203496584001 [0,0,0,0,0,0|4,0,0]=4 60 B14R0.140 CCC(O)CNC(=O)CCCCCCO 240690a_100011218483_100011996774 [0,0,0,0,0,0|3,0,0]=3 61 B14R0.140 CCC(O)CNC(=O)CCCCCOC 11a_100011218483_100011935119 [0,0,0,0,0,0|3,0,0]=3 62 B14R0.140 CCC(O)CNC(=O)CCCCCOC 240690a_100011218483_100011935119 [0,0,0,0,0,0|3,0,0]=3 63 B14R0.140 CCC(O)CNC(=O)CCCCCOC 527a_100011218483_100011935119 [0,0,0,0,0,0|3,0,0]=3 64 B14R0.140 CCC(O)CNC(=O)CCOCCOC 11a_100011218483_100000745395 [0,0,0,0,0,0|4,0,0]=4 65 B14R0.140 CCC(O)CNC(=O)CCOCCOC 240690a_100011218483_100000745395 [0,0,0,0,0,0|4,0,0]=4 66 B14R0.140 CCC(O)CNC(=O)CCOCCOC 527a_100011218483_100000745395 [0,0,0,0,0,0|4,0,0]=4 67 B14R0.140 CCC(O)CNC(=O)NCCCCCO 273464a_100000762737_100011218483 [0,0,0,0,0,0|4,0,0]=4 68 B14R0.140 CCC(O)CNC(=O)NCCCCCO 273464a_100011218483_100000762737 [0,0,0,0,0,0|4,0,0]=4 69 B14R0.140 CCC(O)CNC(=O)NCCCCCO 512a_100011218483_100000762737 [0,0,0,0,0,0|4,0,0]=4 70 B14R0.140 CCCC/C=C/CC(=O)NCC(C)CO 240690a_100000744482_200016282684 [0,0,0,0,0,0|2,0,2]=4 71 B14R0.140 CCCC/C=C/CC(=O)NCC(C)CO 527a_100000744482_200016282684 [0,0,0,0,0,0|2,0,2]=4 72 B14R0.140 CCCC/C=C/CC(=O)NCC(O)CC 11a_100011218483_200016282684 [0,0,0,0,0,0|2,0,2]=4 73 B14R0.140 CCCC/C=C/CC(=O)NCC(O)CC 240690a_100011218483_200016282684 [0,0,0,0,0,0|2,0,2]=4 74 B14R0.140 CCCC/C=C/CC(=O)NCC(O)CC 527a_100011218483_200016282684 [0,0,0,0,0,0|2,0,2]=4 75 B14R0.140 CCCC/C=C/CC(=O)NC[C@@H](F)CO 240690a_100015665980_200016282684 [0,0,0,0,0,0|2,0,2]=4 76 B14R0.140 CCCC/C=C/CC(=O)NC[C@@H](F)CO 527a_100015665980_200016282684 [0,0,0,0,0,0|2,0,2]=4 77 B14R0.140 CCCC/C=C/CC(=O)NC[C@H](O)CO 240690a_100020644852_200016282684 [0,0,0,0,0,0|1,0,2]=3 78 B14R0.140 CCCC/C=C/CC(=O)NC[C@H](O)CO 527a_100020644852_200016282684 [0,0,0,0,0,0|1,0,2]=3 79 B14R0.140 CCCCCC#CC(=O)NCC(C)CO 240690a_100000744482_100011215388 [0,0,0,0,0,0|2,0,2]=4 80 B14R0.140 CCCCCC#CC(=O)NCC(O)CC 240690a_100011218483_100011215388 [0,0,0,0,0,0|2,0,2]=4 81 B14R0.140 CCCCCC#CC(=O)NC[C@@H](F)CO 240690a_100015665980_100011215388 [0,0,0,0,0,0|2,0,2]=4 82 B14R0.140 CCCCCC#CC(=O)NC[C@H](O)CO 240690a_100020644852_100011215388 [0,0,0,0,0,0|1,0,2]=3 83 B14R0.140 CCCCCC=CC(=O)NCC(C)CO 240690a_100000744482_100016263427 [0,0,0,0,0,0|2,0,2]=4 84 B14R0.140 CCCCCC=CC(=O)NCC(O)CC 11a_100011218483_100016263427 [0,0,0,0,0,0|2,0,2]=4 85 B14R0.140 CCCCCC=CC(=O)NCC(O)CC 240690a_100011218483_100016263427 [0,0,0,0,0,0|2,0,2]=4 86 B14R0.140 CCCCCC=CC(=O)NC[C@@H](F)CO 240690a_100015665980_100016263427 [0,0,0,0,0,0|2,0,2]=4 87 B14R0.140 CCCCCC=CC(=O)NC[C@H](O)CO 240690a_100020644852_100016263427 [0,0,0,0,0,0|1,0,2]=3 88 B14R0.140 CCCCCCCC(=O)CCC(C)CC 1458a_100000701222_100000210614 [0,0,0,0,0,0|3,0,0]=3 89 B14R0.140 CCCCCCCC(=O)CCN(C)CC 1458a_100000755305_100000210614 [0,0,0,0,0,0|4,0,0]=4 90 B14R0.140 CCCCCCCC(=O)CCS(=O)CC 1458a_100011387550_100000210614 [0,0,0,0,0,0|3,0,1]=4 91 B14R0.140 CCCCCCCC(=O)NCC(=O)CC 1458a_100000691742_100000210202 [0,0,0,0,0,0|2,0,2]=4 92 B14R0.140 CCCCCCCC(=O)NCC(=O)CF 1458a_100000691742_100015361967 [0,0,0,0,0,0|2,0,2]=4 93 B14R0.140 CCCCCCCC(=O)NCC(C)CC 11a_100020588543_100000211969 [0,0,0,0,0,0|3,0,0]=3 94 B14R0.140 CCCCCCCC(=O)NCC(C)CC 1626a_100020588543_100000211969 [0,0,0,0,0,0|3,0,0]=3 95 B14R0.140 CCCCCCCC(=O)NCC(C)CC 240690a_100020588543_100000211969 [0,0,0,0,0,0|3,0,0]=3 96 B14R0.140 CCCCCCCC(=O)NCC(C)CC 527a_100020588543_100000211969 [0,0,0,0,0,0|3,0,0]=3 97 B14R0.140 CCCCCCCC(=O)NCC(C)CO 240690a_100000744482_100000211969 [0,0,0,0,0,0|2,0,0]=2 98 B14R0.140 CCCCCCCC(=O)NCC(C)CO 527a_100000744482_100000211969 [0,0,0,0,0,0|2,0,0]=2 99 B14R0.140 CCCCCCCC(=O)NCC(O)CC 11a_100011218483_100000211969 [0,0,0,0,0,0|2,0,0]=2 100 B14R0.140 CCCCCCCC(=O)NCC(O)CC 240690a_100011218483_100000211969 [0,0,0,0,0,0|2,0,0]=2 101 B14R0.140 CCCCCCCC(=O)NCC(O)CC 527a_100011218483_100000211969 [0,0,0,0,0,0|2,0,0]=2 102 B14R0.140 CCCCCCCC(=O)NC[C@@H](C)OC 11a_100020591295_100000211969 [0,0,0,0,0,0|4,0,0]=4 103 B14R0.140 CCCCCCCC(=O)NC[C@@H](C)OC 1626a_100020591295_100000211969 [0,0,0,0,0,0|4,0,0]=4 104 B14R0.140 CCCCCCCC(=O)NC[C@@H](C)OC 240690a_100020591295_100000211969 [0,0,0,0,0,0|4,0,0]=4 105 B14R0.140 CCCCCCCC(=O)NC[C@@H](C)OC 527a_100020591295_100000211969 [0,0,0,0,0,0|4,0,0]=4 106 B14R0.140 CCCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000211969 [0,0,0,0,0,0|2,0,0]=2 107 B14R0.140 CCCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100000211969 [0,0,0,0,0,0|2,0,0]=2 108 B14R0.140 CCCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000211969 [0,0,0,0,0,0|1,0,0]=1 109 B14R0.140 CCCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000211969 [0,0,0,0,0,0|1,0,0]=1 110 B14R0.140 CCCCCCCC(=O)NN=C(C)CO 4a_100000181853_100000211253 [0,0,0,0,0,0|3,0,1]=4 111 B14R0.140 CCCCCCCC(=O)NNC(=O)CO 22a_100000181853_100000210174 [0,0,0,0,0,0|2,0,2]=4 112 B14R0.140 CCCCCCCC(=O)NNC(C)CC 22a_100000718999_100000211969 [0,0,0,0,0,0|4,0,0]=4 113 B14R0.140 CCCCCCCC(=O)OCC(=O)CC 1458a_100000210414_100009852258 [0,0,0,0,0,0|1,0,2]=3 114 B14R0.140 CCCCCCCC(=O)OCC(=O)CO 1458a_100000210174_100009852258 [0,0,0,0,0,0|0,0,2]=2 115 B14R0.140 CCCCCCCC(=O)OCN(C)CC 2230a_100000225621_100009852258 [0,0,0,0,0,0|3,0,0]=3 116 B14R0.140 CCCCCCCC(=O)OCN(C)CC 269982a_100000225621_100009852258 [0,0,0,0,0,0|3,0,0]=3 117 B14R0.140 CCCCCCCC(C)NCC(C)CO 34a_100000744482_200011218727 [0,0,0,0,0,0|3,0,1]=4 118 B14R0.140 CCCCCCCC(C)NCC(O)CC 2230a_100011218483_200011218727 [0,0,0,0,0,0|3,0,1]=4 119 B14R0.140 CCCCCCCC(C)NCC(O)CC 270004a_100011218483_100000210596 [0,0,0,0,0,0|3,0,1]=4 120 B14R0.140 CCCCCCCC(C)NC[C@@H](F)CO 270004a_100015665980_100000210596 [0,0,0,0,0,0|3,0,1]=4 121 B14R0.140 CCCCCCCC(C)NC[C@@H](F)CO 34a_100015665980_200011218727 [0,0,0,0,0,0|3,0,1]=4 122 B14R0.140 CCCCCCCC(C)NC[C@H](O)CO 2230a_100020644852_200011218727 [0,0,0,0,0,0|2,0,1]=3 123 B14R0.140 CCCCCCCC(C)OCC(C)CC 34a_200011215852_100000748023 [0,0,0,0,0,0|3,0,1]=4 124 B14R0.140 CCCCCCCC(C)OCC(C)CC 7a_200011215852_100000748023 [0,0,0,0,0,0|3,0,1]=4 125 B14R0.140 CCCCCCCC(C)OCC(C)CN 34a_100000744482_200011218727 [0,0,0,0,0,0|3,0,1]=4 126 B14R0.140 CCCCCCCC(C)OCC(Cl)CCl 34a_100000033668_200011218727 [0,0,0,0,0,0|3,0,1]=4 127 B14R0.140 CCCCCCCC(C)OCC(O)CC 34a_200011215852_100011218378 [0,0,0,0,0,0|2,0,1]=3 128 B14R0.140 CCCCCCCC(C)OCC(O)CC 7a_200011215852_100011218378 [0,0,0,0,0,0|2,0,1]=3 129 B14R0.140 CCCCCCCC(C)OCC(O)CO 34a_200011215852_100011219619 [0,0,0,0,0,0|1,0,1]=2 130 B14R0.140 CCCCCCCC(C)OCC(O)CO 7a_200011215852_100011219619 [0,0,0,0,0,0|1,0,1]=2 131 B14R0.140 CCCCCCCC(C)OC[C@@H](C)CC 34a_200011215852_100009816398 [0,0,0,0,0,0|3,0,1]=4 132 B14R0.140 CCCCCCCC(C)OC[C@@H](C)CC 7a_100009816381_200011218727 [0,0,0,0,0,0|3,0,1]=4 133 B14R0.140 CCCCCCCC(C)OC[C@@H](C)CC 7a_200011215852_100009816398 [0,0,0,0,0,0|3,0,1]=4 134 B14R0.140 CCCCCCCC(C)OC[C@@H](C)CO 34a_200011215852_100000059175 [0,0,0,0,0,0|2,0,1]=3 135 B14R0.140 CCCCCCCC(C)OC[C@@H](C)CO 7a_200011215852_100000059175 [0,0,0,0,0,0|2,0,1]=3 136 B14R0.140 CCCCCCCC(C)OC[C@@H](O)CF 34a_200011215852_100015614560 [0,0,0,0,0,0|2,0,1]=3 137 B14R0.140 CCCCCCCC(C)OC[C@@H](O)CF 7a_200011215852_100015614560 [0,0,0,0,0,0|2,0,1]=3 138 B14R0.140 CCCCCCCC(C)OC[C@@H](O)CO 34a_200011215852_100009815848 [0,0,0,0,0,0|1,0,1]=2 139 B14R0.140 CCCCCCCC(C)OC[C@@H](O)CO 7a_200011215852_100009815848 [0,0,0,0,0,0|1,0,1]=2 140 B14R0.140 CCCCCCCC(C)OC[C@H](F)CN 34a_100015665980_200011218727 [0,0,0,0,0,0|3,0,1]=4 141 B14R0.140 CCCCCCCC(C)SCC(O)CC 62a_100011218378_200011218727 [0,0,0,0,0,0|2,1,1]=4 142 B14R0.140 CCCCCCCC(C)SCC(O)CC 62a_200011218727_100011218378 [0,0,0,0,0,0|2,1,1]=4 143 B14R0.140 CCCCCCCC(C)SCC(O)CO 62a_100011219619_200011218727 [0,0,0,0,0,0|1,1,1]=3 144 B14R0.140 CCCCCCCC(C)SCC(O)CO 62a_200011218727_100011219619 [0,0,0,0,0,0|1,1,1]=3 145 B14R0.140 CCCCCCCC(C)SC[C@@H](C)CO 62a_100000059175_200011218727 [0,0,0,0,0,0|2,1,1]=4 146 B14R0.140 CCCCCCCC(C)SC[C@@H](C)CO 62a_200011218727_100000059175 [0,0,0,0,0,0|2,1,1]=4 147 B14R0.140 CCCCCCCC(C)SC[C@@H](O)CF 62a_100015614560_200011218727 [0,0,0,0,0,0|2,1,1]=4 148 B14R0.140 CCCCCCCC(C)SC[C@@H](O)CF 62a_200011218727_100015614560 [0,0,0,0,0,0|2,1,1]=4 149 B14R0.140 CCCCCCCC(C)SC[C@@H](O)CO 62a_100009815848_200011218727 [0,0,0,0,0,0|1,1,1]=3 150 B14R0.140 CCCCCCCC(C)SC[C@@H](O)CO 62a_200011218727_100009815848 [0,0,0,0,0,0|1,1,1]=3 151 B14R0.140 CCCCCCNC(=O)CCC(C)CC 11a_100000210581_100000701222 [0,0,0,0,0,0|4,0,0]=4 152 B14R0.140 CCCCCCNC(=O)CCC(C)CC 1626a_100000210581_100000701222 [0,0,0,0,0,0|4,0,0]=4 153 B14R0.140 CCCCCCNC(=O)CCC(C)CC 240690a_100000210581_100000701222 [0,0,0,0,0,0|4,0,0]=4 154 B14R0.140 CCCCCCNC(=O)CCC(C)CC 527a_100000210581_100000701222 [0,0,0,0,0,0|4,0,0]=4 155 B14R0.140 CCCCCCNC(=O)CCC(O)CC 1626a_100000210581_203496584001 [0,0,0,0,0,0|3,0,0]=3 156 B14R0.140 CCCCCCNC(=O)CCC(O)CC 240690a_100000210581_203496584001 [0,0,0,0,0,0|3,0,0]=3 157 B14R0.140 CCCCCCNC(=O)CN[C@H](C)CO 2230a_100000737577_100000230325 [0,0,0,0,0,0|4,0,0]=4 158 B14R0.140 CCCCCCNC(=O)CS[C@H](C)CO 62a_100000230325_100016084084 [0,0,0,0,0,0|4,0,0]=4 159 B14R0.140 CCCCCCNC(=O)NCC(C)CC 2708a_100000210581_100020588543 [0,0,0,0,0,0|4,0,0]=4 160 B14R0.140 CCCCCCNC(=O)NCC(C)CC 2708a_100020588543_100000210581 [0,0,0,0,0,0|4,0,0]=4 161 B14R0.140 CCCCCCNC(=O)NCC(C)CC 273464a_100000210581_100020588543 [0,0,0,0,0,0|4,0,0]=4 162 B14R0.140 CCCCCCNC(=O)NCC(C)CC 273464a_100020588543_100000210581 [0,0,0,0,0,0|4,0,0]=4 163 B14R0.140 CCCCCCNC(=O)NCC(C)CC 512a_100000210581_100020588543 [0,0,0,0,0,0|4,0,0]=4 164 B14R0.140 CCCCCCNC(=O)NCC(C)CC 512a_100020588543_100000210581 [0,0,0,0,0,0|4,0,0]=4 165 B14R0.140 CCCCCCNC(=O)NCC(C)CO 2708a_100000210581_100000744482 [0,0,0,0,0,0|3,0,0]=3 166 B14R0.140 CCCCCCNC(=O)NCC(C)CO 273464a_100000210581_100000744482 [0,0,0,0,0,0|3,0,0]=3 167 B14R0.140 CCCCCCNC(=O)NCC(C)CO 273464a_100000744482_100000210581 [0,0,0,0,0,0|3,0,0]=3 168 B14R0.140 CCCCCCNC(=O)NCC(C)CO 512a_100000210581_100000744482 [0,0,0,0,0,0|3,0,0]=3 169 B14R0.140 CCCCCCNC(=O)NCC(C)CO 512a_100000744482_100000210581 [0,0,0,0,0,0|3,0,0]=3 170 B14R0.140 CCCCCCNC(=O)NCC(O)CC 2708a_100000210581_100011218483 [0,0,0,0,0,0|3,0,0]=3 171 B14R0.140 CCCCCCNC(=O)NCC(O)CC 273464a_100000210581_100011218483 [0,0,0,0,0,0|3,0,0]=3 172 B14R0.140 CCCCCCNC(=O)NCC(O)CC 273464a_100011218483_100000210581 [0,0,0,0,0,0|3,0,0]=3 173 B14R0.140 CCCCCCNC(=O)NCC(O)CC 512a_100011218483_100000210581 [0,0,0,0,0,0|3,0,0]=3 174 B14R0.140 CCCCCCNC(=O)NC[C@@H](F)CO 2708a_100000210581_100015665980 [0,0,0,0,0,0|3,0,0]=3 175 B14R0.140 CCCCCCNC(=O)NC[C@@H](F)CO 273464a_100000210581_100015665980 [0,0,0,0,0,0|3,0,0]=3 176 B14R0.140 CCCCCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_100000210581 [0,0,0,0,0,0|3,0,0]=3 177 B14R0.140 CCCCCCNC(=O)NC[C@@H](F)CO 512a_100000210581_100015665980 [0,0,0,0,0,0|3,0,0]=3 178 B14R0.140 CCCCCCNC(=O)NC[C@@H](F)CO 512a_100015665980_100000210581 [0,0,0,0,0,0|3,0,0]=3 179 B14R0.140 CCCCCCNC(=O)NC[C@H](O)CO 2708a_100000210581_100020644852 [0,0,0,0,0,0|2,0,0]=2 180 B14R0.140 CCCCCCNC(=O)NC[C@H](O)CO 273464a_100000210581_100020644852 [0,0,0,0,0,0|2,0,0]=2 181 B14R0.140 CCCCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000210581 [0,0,0,0,0,0|2,0,0]=2 182 B14R0.140 CCCCCNCC(=O)NCC(O)CO 2230a_100000209983_200012027429 [0,0,0,0,0,0|2,0,0]=2 183 B14R0.140 CCCCCNNC(=O)CCC(O)CC 22a_100000694160_203496584001 [0,0,0,0,0,0|4,0,0]=4 184 B14R0.140 CCCCCNNC(=O)NCC(C)CO 273464a_100000744482_100000694160 [0,0,0,0,0,0|4,0,0]=4 185 B14R0.140 CCCCCNNC(=O)NCC(C)CO 512a_100000694160_100000744482 [0,0,0,0,0,0|4,0,0]=4 186 B14R0.140 CCCCCNNC(=O)NCC(C)CO 512a_100000744482_100000694160 [0,0,0,0,0,0|4,0,0]=4 187 B14R0.140 CCCCCNNC(=O)NCC(O)CC 273464a_100011218483_100000694160 [0,0,0,0,0,0|4,0,0]=4 188 B14R0.140 CCCCCNNC(=O)NCC(O)CC 512a_100011218483_100000694160 [0,0,0,0,0,0|4,0,0]=4 189 B14R0.140 CCCCCNNC(=O)NC[C@@H](F)CO 273464a_100015665980_100000694160 [0,0,0,0,0,0|4,0,0]=4 190 B14R0.140 CCCCCNNC(=O)NC[C@@H](F)CO 512a_100000694160_100015665980 [0,0,0,0,0,0|4,0,0]=4 191 B14R0.140 CCCCCNNC(=O)NC[C@@H](F)CO 512a_100015665980_100000694160 [0,0,0,0,0,0|4,0,0]=4 192 B14R0.140 CCCCCOCC(=O)NCC(O)CO 34a_100000210253_200012027429 [0,0,0,0,0,0|2,0,0]=2 193 B14R0.140 CCCCCOCC(=O)NCC(O)CO 7a_100000210253_200012027429 [0,0,0,0,0,0|2,0,0]=2 194 B14R0.140 CCCCCSCC(=O)NCC(O)CO 62a_100000210326_200012027429 [0,0,0,0,0,0|2,0,0]=2 195 B14R0.140 CCCCCSCC(=O)NCC(O)CO 62a_200012027429_100000210326 [0,0,0,0,0,0|2,0,0]=2 196 B14R0.140 CCCCOCCC(=O)CCC(C)CC 1458a_100000701222_100000743108 [0,0,0,0,0,0|4,0,0]=4 197 B14R0.140 CCCOCCNC(=O)CCC(O)CC 1626a_100161115042_203496584001 [0,0,0,0,0,0|4,0,0]=4 198 B14R0.140 CCCOCCNC(=O)CCC(O)CC 240690a_100161115042_203496584001 [0,0,0,0,0,0|4,0,0]=4 199 B14R0.140 CCCOCCNC(=O)NCC(C)CO 2708a_100161115042_100000744482 [0,0,0,0,0,0|4,0,0]=4 200 B14R0.140 CCCOCCNC(=O)NCC(C)CO 273464a_100000744482_100161115042 [0,0,0,0,0,0|4,0,0]=4 201 B14R0.140 CCCOCCNC(=O)NCC(C)CO 273464a_100161115042_100000744482 [0,0,0,0,0,0|4,0,0]=4 202 B14R0.140 CCCOCCNC(=O)NCC(C)CO 512a_100000744482_100161115042 [0,0,0,0,0,0|4,0,0]=4 203 B14R0.140 CCCOCCNC(=O)NCC(C)CO 512a_100161115042_100000744482 [0,0,0,0,0,0|4,0,0]=4 204 B14R0.140 CCCOCCNC(=O)NCC(O)CC 2708a_100161115042_100011218483 [0,0,0,0,0,0|4,0,0]=4 205 B14R0.140 CCCOCCNC(=O)NCC(O)CC 273464a_100011218483_100161115042 [0,0,0,0,0,0|4,0,0]=4 206 B14R0.140 CCCOCCNC(=O)NCC(O)CC 273464a_100161115042_100011218483 [0,0,0,0,0,0|4,0,0]=4 207 B14R0.140 CCCOCCNC(=O)NCC(O)CC 512a_100011218483_100161115042 [0,0,0,0,0,0|4,0,0]=4 208 B14R0.140 CCCOCCNC(=O)NC[C@@H](F)CO 2708a_100161115042_100015665980 [0,0,0,0,0,0|4,0,0]=4 209 B14R0.140 CCCOCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_100161115042 [0,0,0,0,0,0|4,0,0]=4 210 B14R0.140 CCCOCCNC(=O)NC[C@@H](F)CO 273464a_100161115042_100015665980 [0,0,0,0,0,0|4,0,0]=4 211 B14R0.140 CCCOCCNC(=O)NC[C@@H](F)CO 512a_100015665980_100161115042 [0,0,0,0,0,0|4,0,0]=4 212 B14R0.140 CCCOCCNC(=O)NC[C@@H](F)CO 512a_100161115042_100015665980 [0,0,0,0,0,0|4,0,0]=4 213 B14R0.140 CCCOCCNC(=O)NC[C@H](O)CO 2708a_100161115042_100020644852 [0,0,0,0,0,0|3,0,0]=3 214 B14R0.140 CCCOCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100161115042 [0,0,0,0,0,0|3,0,0]=3 215 B14R0.140 CCCOCCNC(=O)NC[C@H](O)CO 273464a_100161115042_100020644852 [0,0,0,0,0,0|3,0,0]=3 216 B14R0.140 CCCSCCNC(=O)CCC(O)CC 240690a_100020603323_203496584001 [0,0,0,0,0,0|4,0,0]=4 217 B14R0.140 CCCSCCNC(=O)NCC(C)CO 2708a_100020603323_100000744482 [0,0,0,0,0,0|4,0,0]=4 218 B14R0.140 CCCSCCNC(=O)NCC(C)CO 273464a_100000744482_100020603323 [0,0,0,0,0,0|4,0,0]=4 219 B14R0.140 CCCSCCNC(=O)NCC(C)CO 273464a_100020603323_100000744482 [0,0,0,0,0,0|4,0,0]=4 220 B14R0.140 CCCSCCNC(=O)NCC(C)CO 512a_100000744482_100020603323 [0,0,0,0,0,0|4,0,0]=4 221 B14R0.140 CCCSCCNC(=O)NCC(C)CO 512a_100020603323_100000744482 [0,0,0,0,0,0|4,0,0]=4 222 B14R0.140 CCCSCCNC(=O)NCC(O)CC 2708a_100020603323_100011218483 [0,0,0,0,0,0|4,0,0]=4 223 B14R0.140 CCCSCCNC(=O)NCC(O)CC 273464a_100011218483_100020603323 [0,0,0,0,0,0|4,0,0]=4 224 B14R0.140 CCCSCCNC(=O)NCC(O)CC 273464a_100020603323_100011218483 [0,0,0,0,0,0|4,0,0]=4 225 B14R0.140 CCCSCCNC(=O)NCC(O)CC 512a_100011218483_100020603323 [0,0,0,0,0,0|4,0,0]=4 226 B14R0.140 CCCSCCNC(=O)NC[C@@H](F)CO 2708a_100020603323_100015665980 [0,0,0,0,0,0|4,0,0]=4 227 B14R0.140 CCCSCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_100020603323 [0,0,0,0,0,0|4,0,0]=4 228 B14R0.140 CCCSCCNC(=O)NC[C@@H](F)CO 273464a_100020603323_100015665980 [0,0,0,0,0,0|4,0,0]=4 229 B14R0.140 CCCSCCNC(=O)NC[C@@H](F)CO 512a_100015665980_100020603323 [0,0,0,0,0,0|4,0,0]=4 230 B14R0.140 CCCSCCNC(=O)NC[C@@H](F)CO 512a_100020603323_100015665980 [0,0,0,0,0,0|4,0,0]=4 231 B14R0.140 CCCSCCNC(=O)NC[C@H](O)CO 2708a_100020603323_100020644852 [0,0,0,0,0,0|3,0,0]=3 232 B14R0.140 CCCSCCNC(=O)NC[C@H](O)CO 273464a_100020603323_100020644852 [0,0,0,0,0,0|3,0,0]=3 233 B14R0.140 CCCSCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100020603323 [0,0,0,0,0,0|3,0,0]=3 234 B14R0.140 CCOCCCNC(=O)CCC(O)CC 1626a_100000210961_203496584001 [0,0,0,0,0,0|4,0,0]=4 235 B14R0.140 CCOCCCNC(=O)CCC(O)CC 240690a_100000210961_203496584001 [0,0,0,0,0,0|4,0,0]=4 236 B14R0.140 CCOCCCNC(=O)NCC(C)CO 2708a_100000210961_100000744482 [0,0,0,0,0,0|4,0,0]=4 237 B14R0.140 CCOCCCNC(=O)NCC(C)CO 273464a_100000210961_100000744482 [0,0,0,0,0,0|4,0,0]=4 238 B14R0.140 CCOCCCNC(=O)NCC(C)CO 273464a_100000744482_100000210961 [0,0,0,0,0,0|4,0,0]=4 239 B14R0.140 CCOCCCNC(=O)NCC(C)CO 512a_100000210961_100000744482 [0,0,0,0,0,0|4,0,0]=4 240 B14R0.140 CCOCCCNC(=O)NCC(C)CO 512a_100000744482_100000210961 [0,0,0,0,0,0|4,0,0]=4 241 B14R0.140 CCOCCCNC(=O)NCC(O)CC 2708a_100000210961_100011218483 [0,0,0,0,0,0|4,0,0]=4 242 B14R0.140 CCOCCCNC(=O)NCC(O)CC 273464a_100000210961_100011218483 [0,0,0,0,0,0|4,0,0]=4 243 B14R0.140 CCOCCCNC(=O)NCC(O)CC 273464a_100011218483_100000210961 [0,0,0,0,0,0|4,0,0]=4 244 B14R0.140 CCOCCCNC(=O)NCC(O)CC 512a_100011218483_100000210961 [0,0,0,0,0,0|4,0,0]=4 245 B14R0.140 CCOCCCNC(=O)NC[C@@H](F)CO 2708a_100000210961_100015665980 [0,0,0,0,0,0|4,0,0]=4 246 B14R0.140 CCOCCCNC(=O)NC[C@@H](F)CO 273464a_100000210961_100015665980 [0,0,0,0,0,0|4,0,0]=4 247 B14R0.140 CCOCCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_100000210961 [0,0,0,0,0,0|4,0,0]=4 248 B14R0.140 CCOCCCNC(=O)NC[C@@H](F)CO 512a_100000210961_100015665980 [0,0,0,0,0,0|4,0,0]=4 249 B14R0.140 CCOCCCNC(=O)NC[C@@H](F)CO 512a_100015665980_100000210961 [0,0,0,0,0,0|4,0,0]=4 250 B14R0.140 CCOCCCNC(=O)NC[C@H](O)CO 2708a_100000210961_100020644852 [0,0,0,0,0,0|3,0,0]=3 251 B14R0.140 CCOCCCNC(=O)NC[C@H](O)CO 273464a_100000210961_100020644852 [0,0,0,0,0,0|3,0,0]=3 252 B14R0.140 CCOCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000210961 [0,0,0,0,0,0|3,0,0]=3 253 B14R0.140 CCOCCNCC(=O)NCC(O)CO 2230a_102516460346_200012027429 [0,0,0,0,0,0|3,0,0]=3 254 B14R0.140 CCOCCNCC(=O)NCC(O)CO 34a_102516460346_200012027429 [0,0,0,0,0,0|3,0,0]=3 255 B14R0.140 CCOCCOCC(=O)NCC(O)CO 34a_100000210136_200012027429 [0,0,0,0,0,0|3,0,0]=3 256 B14R0.140 CCOCCOCC(=O)NCC(O)CO 7a_100000210136_200012027429 [0,0,0,0,0,0|3,0,0]=3 257 B14R0.140 CCOCCSCC(=O)NCC(O)CO 62a_100000210147_200012027429 [0,0,0,0,0,0|3,0,0]=3 258 B14R0.140 CCOCCSCC(=O)NCC(O)CO 62a_200012027429_100011215890 [0,0,0,0,0,0|3,0,0]=3 259 B14R0.140 CCSCCNCC(=O)NCC(O)CO 2230a_100000106463_200012027429 [0,0,0,0,0,0|3,0,0]=3 260 B14R0.140 CCSCCOCC(=O)NCC(O)CO 34a_100000212035_200012027429 [0,0,0,0,0,0|3,0,0]=3 261 B14R0.140 CCSCCOCC(=O)NCC(O)CO 7a_100000212035_200012027429 [0,0,0,0,0,0|3,0,0]=3 262 B14R0.140 CCSCCSCC(=O)NCC(O)CO 62a_100000757381_200012027429 [0,0,0,0,0,0|3,0,0]=3 263 B14R0.140 CCSCCSCC(=O)NCC(O)CO 62a_200012027429_100000757381 [0,0,0,0,0,0|3,0,0]=3 264 B14R0.140 CNCCCOCC(=O)NCC(O)CO 34a_100000213112_200012027429 [0,0,0,0,0,0|3,0,0]=3 265 B14R0.140 COCCCCCC(=O)NCC(C)CO 240690a_100000744482_100011935119 [0,0,0,0,0,0|3,0,0]=3 266 B14R0.140 COCCCCCC(=O)NCC(C)CO 527a_100000744482_100011935119 [0,0,0,0,0,0|3,0,0]=3 267 B14R0.140 COCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100011935119 [0,0,0,0,0,0|3,0,0]=3 268 B14R0.140 COCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100011935119 [0,0,0,0,0,0|3,0,0]=3 269 B14R0.140 COCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100011935119 [0,0,0,0,0,0|2,0,0]=2 270 B14R0.140 COCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100011935119 [0,0,0,0,0,0|2,0,0]=2 271 B14R0.140 COCCCNCC(=O)NCC(O)CO 34a_100150723488_200012027429 [0,0,0,0,0,0|3,0,0]=3 272 B14R0.140 COCCCOCC(=O)NCC(O)CO 34a_100000740835_200012027429 [0,0,0,0,0,0|3,0,0]=3 273 B14R0.140 COCCCSCC(=O)NCC(O)CO 62a_100000709357_200012027429 [0,0,0,0,0,0|3,0,0]=3 274 B14R0.140 COCCCSCC(=O)NCC(O)CO 62a_200012027429_100000709357 [0,0,0,0,0,0|3,0,0]=3 275 B14R0.140 COCCOCCC(=O)NCC(C)CO 240690a_100000744482_100000745395 [0,0,0,0,0,0|4,0,0]=4 276 B14R0.140 COCCOCCC(=O)NCC(C)CO 527a_100000744482_100000745395 [0,0,0,0,0,0|4,0,0]=4 277 B14R0.140 COCCOCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000745395 [0,0,0,0,0,0|4,0,0]=4 278 B14R0.140 COCCOCCC(=O)NC[C@@H](F)CO 527a_100015665980_100000745395 [0,0,0,0,0,0|4,0,0]=4 279 B14R0.140 COCCOCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000745395 [0,0,0,0,0,0|3,0,0]=3 280 B14R0.140 COCCOCCC(=O)NC[C@H](O)CO 527a_100020644852_100000745395 [0,0,0,0,0,0|3,0,0]=3 281 B14R0.140 CSCCCNCC(=O)NCC(O)CO 2230a_100000749238_200012027429 [0,0,0,0,0,0|3,0,0]=3 282 B14R0.140 CSCCCOCC(=O)NCC(O)CO 34a_100000690336_200012027429 [0,0,0,0,0,0|3,0,0]=3 283 B14R0.140 CSCCCOCC(=O)NCC(O)CO 7a_100000690336_200012027429 [0,0,0,0,0,0|3,0,0]=3 284 B14R0.140 N#CCCCCNC(=O)NC[C@H](O)CO 2708a_100000751965_100020644852 [0,0,0,0,0,0|3,0,1]=4 285 B14R0.140 N#CCCCCNC(=O)NC[C@H](O)CO 273464a_100000751965_100020644852 [0,0,0,0,0,0|3,0,1]=4 286 B14R0.140 N#CCCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000751965 [0,0,0,0,0,0|3,0,1]=4 287 B14R0.140 N#CCCCSCC(=O)NCC(O)CO 62a_100000687738_200012027429 [0,0,0,0,0,0|3,0,1]=4 288 B14R0.140 N#CCCCSCC(=O)NCC(O)CO 62a_200012027429_100000687738 [0,0,0,0,0,0|3,0,1]=4 289 B14R0.140 NCCCCOCC(=O)NCC(O)CO 34a_100000750430_200012027429 [0,0,0,0,0,0|3,0,0]=3 290 B14R0.140 O=C(CCCCCCO)NC[C@@H](F)CO 240690a_100015665980_100011996774 [0,0,0,0,0,0|3,0,0]=3 291 B14R0.140 O=C(CCCCCCO)NC[C@H](O)CO 240690a_100020644852_100011996774 [0,0,0,0,0,0|2,0,0]=2 292 B14R0.140 O=C(COCCCCBr)NCC(O)CO 34a_100011216708_200012027429 [0,0,0,0,0,0|3,0,0]=3 293 B14R0.140 O=C(COCCCCCl)NCC(O)CO 34a_100000210776_200012027429 [0,0,0,0,0,0|3,0,0]=3 294 B14R0.140 O=C(COCCCCCl)NCC(O)CO 7a_100000210776_200012027429 [0,0,0,0,0,0|3,0,0]=3 295 B14R0.140 O=C(COCCCCF)NCC(O)CO 34a_100011995726_200012027429 [0,0,0,0,0,0|3,0,0]=3 296 B14R0.140 O=C(COCCCCF)NCC(O)CO 7a_100011995726_200012027429 [0,0,0,0,0,0|3,0,0]=3 297 B14R0.140 O=C(COCCCCI)NCC(O)CO 34a_200012148704_200012027429 [0,0,0,0,0,0|3,0,0]=3 298 B14R0.140 O=C(CSCCCCF)NCC(O)CO 62a_100000729493_200012027429 [0,0,0,0,0,0|3,0,0]=3 299 B14R0.140 O=C(CSCCCCF)NCC(O)CO 62a_200012027429_100000729493 [0,0,0,0,0,0|3,0,0]=3 300 B14R0.140 O=C(CSCCCCO)NCC(O)CO 62a_100000210776_200012027429 [0,0,0,0,0,0|3,0,0]=3 301 B14R0.140 O=C(CSCCCCO)NCC(O)CO 62a_200012027429_100000210776 [0,0,0,0,0,0|3,0,0]=3 302 B14R0.140 O=C(NCCCCCO)NC[C@@H](F)CO 273464a_100000762737_100015665980 [0,0,0,0,0,0|4,0,0]=4 303 B14R0.140 O=C(NCCCCCO)NC[C@@H](F)CO 273464a_100015665980_100000762737 [0,0,0,0,0,0|4,0,0]=4 304 B14R0.140 O=C(NCCCCCO)NC[C@@H](F)CO 512a_100000762737_100015665980 [0,0,0,0,0,0|4,0,0]=4 305 B14R0.140 O=C(NCCCCCO)NC[C@@H](F)CO 512a_100015665980_100000762737 [0,0,0,0,0,0|4,0,0]=4 306 B14R0.140 O=CCCCSCC(=O)NCC(O)CO 62a_200011292268_200012027429 [0,0,0,0,0,0|3,0,1]=4 307 B14R0.140 O=CCCCSCC(=O)NCC(O)CO 62a_200012027429_200011292268 [0,0,0,0,0,0|3,0,1]=4 308 B14R0.140 [N-]=[N+]=NCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000070148 [0,0,0,0,0,0|4,0,0]=4 309 B14R0.140 [N-]=[N+]=NCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000070148 [0,0,0,0,0,0|4,0,0]=4 310 B13R0.147 C#CCCCCCCOCC(O)CO 34a_100011217361_100011219619 [1,0,0,0,0,0|0,0,3]=4 311 B13R0.147 C#CCCCCCCOCC(O)CO 7a_100011217361_100011219619 [1,0,0,0,0,0|0,0,3]=4 312 B13R0.147 C#CCCCCCCOC[C@@H](O)CO 34a_100011217361_100009815848 [1,0,0,0,0,0|0,0,3]=4 313 B13R0.147 C#CCCCCCCOC[C@@H](O)CO 7a_100011217361_100009815848 [1,0,0,0,0,0|0,0,3]=4 314 B13R0.147 C=CC(O)COCCCCCCCC 34a_100000210232_100000730141 [1,0,0,0,0,0|1,0,2]=4 315 B13R0.147 C=CC(O)COCCCCCCCC 7a_100000210232_100000730141 [1,0,0,0,0,0|1,0,2]=4 316 B13R0.147 C=CCCCCCCOCC(O)CO 34a_200011216477_100011219619 [1,0,0,0,0,0|0,0,3]=4 317 B13R0.147 C=CCCCCCCOCC(O)CO 7a_200011216477_100011219619 [1,0,0,0,0,0|0,0,3]=4 318 B13R0.147 C=CCCCCCCOC[C@@H](O)CO 34a_200011216477_100009815848 [1,0,0,0,0,0|0,0,3]=4 319 B13R0.147 C=CCCCCCCOC[C@@H](O)CO 7a_200011216477_100009815848 [1,0,0,0,0,0|0,0,3]=4 320 B13R0.147 CC/C=C\CCCCOCC(O)CO 34a_100016287862_100011219619 [1,0,0,0,0,0|0,0,3]=4 321 B13R0.147 CC/C=C\CCCCOCC(O)CO 7a_100016287862_100011219619 [1,0,0,0,0,0|0,0,3]=4 322 B13R0.147 CC/C=C\CCCCOC[C@@H](O)CO 34a_100016287862_100009815848 [1,0,0,0,0,0|0,0,3]=4 323 B13R0.147 CC/C=C\CCCCOC[C@@H](O)CO 7a_100016287862_100009815848 [1,0,0,0,0,0|0,0,3]=4 324 B13R0.147 CCC(O)COCCCCCCCBr 34a_100000760002_100011218378 [1,0,0,0,0,0|2,0,1]=4 325 B13R0.147 CCC(O)COCCCCCCCBr 7a_100000760002_100011218378 [1,0,0,0,0,0|2,0,1]=4 326 B13R0.147 CCC(O)COCCCCCCCN 34a_100011996573_100011218378 [1,0,0,0,0,0|2,0,1]=4 327 B13R0.147 CCC(O)COCCCCCCOC 34a_200012092642_100011218378 [1,0,0,0,0,0|2,0,1]=4 328 B13R0.147 CCC(O)COCCCCCCOC 7a_200012092642_100011218378 [1,0,0,0,0,0|2,0,1]=4 329 B13R0.147 CCCC/C=C\CCOCC(O)CO 34a_200016286491_100011219619 [1,0,0,0,0,0|0,0,3]=4 330 B13R0.147 CCCC/C=C\CCOCC(O)CO 7a_200016286491_100011219619 [1,0,0,0,0,0|0,0,3]=4 331 B13R0.147 CCCC/C=C\CCOC[C@@H](O)CO 34a_200016286491_100009815848 [1,0,0,0,0,0|0,0,3]=4 332 B13R0.147 CCCC/C=C\CCOC[C@@H](O)CO 7a_200016286491_100009815848 [1,0,0,0,0,0|0,0,3]=4 333 B13R0.147 CCCCC#CCCOCC(O)CO 34a_100000037610_100011219619 [1,0,0,0,0,0|0,0,3]=4 334 B13R0.147 CCCCC#CCCOCC(O)CO 7a_100000037610_100011219619 [1,0,0,0,0,0|0,0,3]=4 335 B13R0.147 CCCCC#CCCOC[C@@H](O)CO 34a_100000037610_100009815848 [1,0,0,0,0,0|0,0,3]=4 336 B13R0.147 CCCCC#CCCOC[C@@H](O)CO 7a_100000037610_100009815848 [1,0,0,0,0,0|0,0,3]=4 337 B13R0.147 CCCCC/C=C/COCC(O)CO 34a_100016258190_100011219619 [1,0,0,0,0,0|0,0,3]=4 338 B13R0.147 CCCCC/C=C/COCC(O)CO 7a_100016258190_100011219619 [1,0,0,0,0,0|0,0,3]=4 339 B13R0.147 CCCCC/C=C/COC[C@@H](O)CO 34a_100016258190_100009815848 [1,0,0,0,0,0|0,0,3]=4 340 B13R0.147 CCCCC/C=C/COC[C@@H](O)CO 7a_100016258190_100009815848 [1,0,0,0,0,0|0,0,3]=4 341 B13R0.147 CCCCCC#CCOCC(O)CO 34a_200000033628_100011219619 [1,0,0,0,0,0|0,0,3]=4 342 B13R0.147 CCCCCC#CCOCC(O)CO 7a_200000033628_100011219619 [1,0,0,0,0,0|0,0,3]=4 343 B13R0.147 CCCCCC#CCOC[C@@H](O)CO 34a_200000033628_100009815848 [1,0,0,0,0,0|0,0,3]=4 344 B13R0.147 CCCCCC#CCOC[C@@H](O)CO 7a_200000033628_100009815848 [1,0,0,0,0,0|0,0,3]=4 345 B13R0.147 CCCCCCCCNCC(C)CO 34a_100000744482_100000210759 [1,0,0,0,0,0|2,0,1]=4 346 B13R0.147 CCCCCCCCNCC(O)CC 2230a_100000229939_100011218378 [1,0,0,0,0,0|2,0,1]=4 347 B13R0.147 CCCCCCCCNCC(O)CC 2230a_100011218483_100000210759 [1,0,0,0,0,0|2,0,1]=4 348 B13R0.147 CCCCCCCCNCC(O)CC 34a_100000229939_100011218378 [1,0,0,0,0,0|2,0,1]=4 349 B13R0.147 CCCCCCCCNCC(O)CO 2230a_100000229939_100011219619 [1,0,0,0,0,0|1,0,1]=3 350 B13R0.147 CCCCCCCCNCC(O)CO 34a_100000229939_100011219619 [1,0,0,0,0,0|1,0,1]=3 351 B13R0.147 CCCCCCCCNC[C@@H](C)CO 2230a_100000229939_100000059175 [1,0,0,0,0,0|2,0,1]=4 352 B13R0.147 CCCCCCCCNC[C@@H](C)CO 34a_100000229939_100000059175 [1,0,0,0,0,0|2,0,1]=4 353 B13R0.147 CCCCCCCCNC[C@@H](F)CO 34a_100015665980_100000210759 [1,0,0,0,0,0|2,0,1]=4 354 B13R0.147 CCCCCCCCNC[C@@H](O)CF 2230a_100000229939_100015614560 [1,0,0,0,0,0|2,0,1]=4 355 B13R0.147 CCCCCCCCNC[C@@H](O)CF 34a_100000229939_100015614560 [1,0,0,0,0,0|2,0,1]=4 356 B13R0.147 CCCCCCCCNC[C@@H](O)CO 2230a_100000229939_100009815848 [1,0,0,0,0,0|1,0,1]=3 357 B13R0.147 CCCCCCCCNC[C@@H](O)CO 34a_100000229939_100009815848 [1,0,0,0,0,0|1,0,1]=3 358 B13R0.147 CCCCCCCCNC[C@H](O)CO 2230a_100020644852_100000210759 [1,0,0,0,0,0|1,0,1]=3 359 B13R0.147 CCCCCCCCOCC(C)CC 34a_100000210232_100000748023 [1,0,0,0,0,0|2,0,1]=4 360 B13R0.147 CCCCCCCCOCC(C)CC 7a_100000210232_100000748023 [1,0,0,0,0,0|2,0,1]=4 361 B13R0.147 CCCCCCCCOCC(C)CN 34a_100000744482_100000210759 [1,0,0,0,0,0|2,0,1]=4 362 B13R0.147 CCCCCCCCOCC(Cl)CCl 34a_100000033668_100000210759 [1,0,0,0,0,0|2,0,1]=4 363 B13R0.147 CCCCCCCCOCC(O)CC 34a_100000210232_100011218378 [1,0,0,0,0,0|1,0,1]=3 364 B13R0.147 CCCCCCCCOCC(O)CC 7a_100000210232_100011218378 [1,0,0,0,0,0|1,0,1]=3 365 B13R0.147 CCCCCCCCOCC(O)CO 34a_100000210232_100011219619 [1,0,0,0,0,0|0,0,1]=2 366 B13R0.147 CCCCCCCCOCC(O)CO 7a_100000210232_100011219619 [1,0,0,0,0,0|0,0,1]=2 367 B13R0.147 CCCCCCCCOC[C@@H](C)CC 34a_100000210232_100009816398 [1,0,0,0,0,0|2,0,1]=4 368 B13R0.147 CCCCCCCCOC[C@@H](C)CC 7a_100000210232_100009816398 [1,0,0,0,0,0|2,0,1]=4 369 B13R0.147 CCCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210759 [1,0,0,0,0,0|2,0,1]=4 370 B13R0.147 CCCCCCCCOC[C@@H](C)CO 34a_100000210232_100000059175 [1,0,0,0,0,0|1,0,1]=3 371 B13R0.147 CCCCCCCCOC[C@@H](C)CO 7a_100000210232_100000059175 [1,0,0,0,0,0|1,0,1]=3 372 B13R0.147 CCCCCCCCOC[C@@H](O)CF 34a_100000210232_100015614560 [1,0,0,0,0,0|1,0,1]=3 373 B13R0.147 CCCCCCCCOC[C@@H](O)CF 7a_100000210232_100015614560 [1,0,0,0,0,0|1,0,1]=3 374 B13R0.147 CCCCCCCCOC[C@@H](O)CO 34a_100000210232_100009815848 [1,0,0,0,0,0|0,0,1]=2 375 B13R0.147 CCCCCCCCOC[C@@H](O)CO 7a_100000210232_100009815848 [1,0,0,0,0,0|0,0,1]=2 376 B13R0.147 CCCCCCCCOC[C@H](F)CN 34a_100015665980_100000210759 [1,0,0,0,0,0|2,0,1]=4 377 B13R0.147 CCCCCCCCSCC(O)CC 62a_100000210759_100011218378 [1,0,0,0,0,0|1,1,1]=4 378 B13R0.147 CCCCCCCCSCC(O)CC 62a_100011218378_100000210317 [1,0,0,0,0,0|1,1,1]=4 379 B13R0.147 CCCCCCCCSCC(O)CO 62a_100000210759_100011219619 [1,0,0,0,0,0|0,1,1]=3 380 B13R0.147 CCCCCCCCSCC(O)CO 62a_100011219619_100000210317 [1,0,0,0,0,0|0,1,1]=3 381 B13R0.147 CCCCCCCCSC[C@@H](C)CO 62a_100000059175_100000210317 [1,0,0,0,0,0|1,1,1]=4 382 B13R0.147 CCCCCCCCSC[C@@H](C)CO 62a_100000210759_100000059175 [1,0,0,0,0,0|1,1,1]=4 383 B13R0.147 CCCCCCCCSC[C@@H](O)CF 62a_100000210759_100015614560 [1,0,0,0,0,0|1,1,1]=4 384 B13R0.147 CCCCCCCCSC[C@@H](O)CF 62a_100015614560_100000210317 [1,0,0,0,0,0|1,1,1]=4 385 B13R0.147 CCCCCCCCSC[C@@H](O)CO 62a_100000210759_100009815848 [1,0,0,0,0,0|0,1,1]=3 386 B13R0.147 CCCCCCCCSC[C@@H](O)CO 62a_100009815848_100000210317 [1,0,0,0,0,0|0,1,1]=3 387 B13R0.147 CCCCCCCNCCC(C)CO 2230a_106354213184_100000210681 [1,0,0,0,0,0|3,0,0]=4 388 B13R0.147 CCCCCCCNCCC(C)CO 34a_106354213184_100000210614 [1,0,0,0,0,0|3,0,0]=4 389 B13R0.147 CCCCCNCCOCC(O)CC 34a_100000224656_100011218378 [1,0,0,0,0,0|2,0,1]=4 390 B13R0.147 CCCCCNCCOCC(O)CO 34a_100000224656_100011219619 [1,0,0,0,0,0|1,0,1]=3 391 B13R0.147 CCCCCNCCOC[C@@H](C)CO 34a_100000224656_100000059175 [1,0,0,0,0,0|2,0,1]=4 392 B13R0.147 CCCCCNCCOC[C@@H](O)CF 34a_100000224656_100015614560 [1,0,0,0,0,0|2,0,1]=4 393 B13R0.147 CCCCCNCCOC[C@@H](O)CO 34a_100000224656_100009815848 [1,0,0,0,0,0|1,0,1]=3 394 B13R0.147 CCCCCOCCOCC(O)CC 34a_100011215259_100011218378 [1,0,0,0,0,0|2,0,1]=4 395 B13R0.147 CCCCCOCCOCC(O)CC 7a_100011215259_100011218378 [1,0,0,0,0,0|2,0,1]=4 396 B13R0.147 CCCCCOCCOCC(O)CO 34a_100011215259_100011219619 [1,0,0,0,0,0|1,0,1]=3 397 B13R0.147 CCCCCOCCOCC(O)CO 7a_100011215259_100011219619 [1,0,0,0,0,0|1,0,1]=3 398 B13R0.147 CCCCCOCCOC[C@@H](C)CO 34a_100011215259_100000059175 [1,0,0,0,0,0|2,0,1]=4 399 B13R0.147 CCCCCOCCOC[C@@H](C)CO 7a_100011215259_100000059175 [1,0,0,0,0,0|2,0,1]=4 400 B13R0.147 CCCCCOCCOC[C@@H](O)CF 34a_100011215259_100015614560 [1,0,0,0,0,0|2,0,1]=4 401 B13R0.147 CCCCCOCCOC[C@@H](O)CF 7a_100011215259_100015614560 [1,0,0,0,0,0|2,0,1]=4 402 B13R0.147 CCCCCOCCOC[C@@H](O)CO 34a_100011215259_100009815848 [1,0,0,0,0,0|1,0,1]=3 403 B13R0.147 CCCCCOCCOC[C@@H](O)CO 7a_100011215259_100009815848 [1,0,0,0,0,0|1,0,1]=3 404 B13R0.147 CCCCOCCCNCC(O)CO 2230a_200000211371_100011219619 [1,0,0,0,0,0|2,0,1]=4 405 B13R0.147 CCCCOCCCNCC(O)CO 34a_200000211371_100011219619 [1,0,0,0,0,0|2,0,1]=4 406 B13R0.147 CCCCOCCCNC[C@@H](O)CO 2230a_200000211371_100009815848 [1,0,0,0,0,0|2,0,1]=4 407 B13R0.147 CCCCOCCCNC[C@@H](O)CO 34a_200000211371_100009815848 [1,0,0,0,0,0|2,0,1]=4 408 B13R0.147 CCCCOCCCOCC(O)CC 34a_200011215613_100011218378 [1,0,0,0,0,0|2,0,1]=4 409 B13R0.147 CCCCOCCCOCC(O)CC 7a_200011215613_100011218378 [1,0,0,0,0,0|2,0,1]=4 410 B13R0.147 CCCCOCCCOCC(O)CO 34a_200011215613_100011219619 [1,0,0,0,0,0|1,0,1]=3 411 B13R0.147 CCCCOCCCOCC(O)CO 7a_200011215613_100011219619 [1,0,0,0,0,0|1,0,1]=3 412 B13R0.147 CCCCOCCCOC[C@@H](C)CO 34a_200011215613_100000059175 [1,0,0,0,0,0|2,0,1]=4 413 B13R0.147 CCCCOCCCOC[C@@H](C)CO 7a_200011215613_100000059175 [1,0,0,0,0,0|2,0,1]=4 414 B13R0.147 CCCCOCCCOC[C@@H](O)CF 34a_200011215613_100015614560 [1,0,0,0,0,0|2,0,1]=4 415 B13R0.147 CCCCOCCCOC[C@@H](O)CF 7a_200011215613_100015614560 [1,0,0,0,0,0|2,0,1]=4 416 B13R0.147 CCCCOCCCOC[C@@H](O)CO 34a_200011215613_100009815848 [1,0,0,0,0,0|1,0,1]=3 417 B13R0.147 CCCCOCCCOC[C@@H](O)CO 7a_200011215613_100009815848 [1,0,0,0,0,0|1,0,1]=3 418 B13R0.147 CCOCCOCCOCC(O)CO 34a_100000210240_100011219619 [1,0,0,0,0,0|2,0,1]=4 419 B13R0.147 CCOCCOCCOCC(O)CO 7a_100000210240_100011219619 [1,0,0,0,0,0|2,0,1]=4 420 B13R0.147 CCOCCOCCOC[C@@H](O)CO 34a_100000210240_100009815848 [1,0,0,0,0,0|2,0,1]=4 421 B13R0.147 CCOCCOCCOC[C@@H](O)CO 7a_100000210240_100009815848 [1,0,0,0,0,0|2,0,1]=4 422 B13R0.147 COCCCCCCNC[C@H](O)CO 2230a_100020644852_100011998445 [1,0,0,0,0,0|2,0,1]=4 423 B13R0.147 COCCCCCCOCC(O)CO 34a_200012092642_100011219619 [1,0,0,0,0,0|1,0,1]=3 424 B13R0.147 COCCCCCCOCC(O)CO 7a_200012092642_100011219619 [1,0,0,0,0,0|1,0,1]=3 425 B13R0.147 COCCCCCCOC[C@@H](C)CO 34a_200012092642_100000059175 [1,0,0,0,0,0|2,0,1]=4 426 B13R0.147 COCCCCCCOC[C@@H](C)CO 7a_200012092642_100000059175 [1,0,0,0,0,0|2,0,1]=4 427 B13R0.147 COCCCCCCOC[C@@H](O)CF 34a_200012092642_100015614560 [1,0,0,0,0,0|2,0,1]=4 428 B13R0.147 COCCCCCCOC[C@@H](O)CF 7a_200012092642_100015614560 [1,0,0,0,0,0|2,0,1]=4 429 B13R0.147 COCCCCCCOC[C@@H](O)CO 34a_200012092642_100009815848 [1,0,0,0,0,0|1,0,1]=3 430 B13R0.147 COCCCCCCOC[C@@H](O)CO 7a_200012092642_100009815848 [1,0,0,0,0,0|1,0,1]=3 431 B13R0.147 COCCCCCCSCC(O)CO 62a_100011219619_100011998445 [1,0,0,0,0,0|1,1,1]=4 432 B13R0.147 COCCCCCCSCC(O)CO 62a_100011998445_100011219619 [1,0,0,0,0,0|1,1,1]=4 433 B13R0.147 COCCCCCCSC[C@@H](O)CO 62a_100009815848_100011998445 [1,0,0,0,0,0|1,1,1]=4 434 B13R0.147 COCCCCCCSC[C@@H](O)CO 62a_100011998445_100009815848 [1,0,0,0,0,0|1,1,1]=4 435 B13R0.147 C[C@@H](CO)COCCCCCCCBr 34a_100000760002_100000059175 [1,0,0,0,0,0|2,0,1]=4 436 B13R0.147 C[C@@H](CO)COCCCCCCCBr 7a_100000760002_100000059175 [1,0,0,0,0,0|2,0,1]=4 437 B13R0.147 C[C@@H](CO)COCCCCCCCN 34a_100011996573_100000059175 [1,0,0,0,0,0|2,0,1]=4 438 B13R0.147 NCCCCCCCOCC(O)CO 34a_100011996573_100011219619 [1,0,0,0,0,0|1,0,1]=3 439 B13R0.147 NCCCCCCCOC[C@@H](O)CF 34a_100011996573_100015614560 [1,0,0,0,0,0|2,0,1]=4 440 B13R0.147 NCCCCCCCOC[C@@H](O)CO 34a_100011996573_100009815848 [1,0,0,0,0,0|1,0,1]=3 441 B13R0.147 NCCCOCCCOCC(O)CO 34a_100011310245_100011219619 [1,0,0,0,0,0|2,0,1]=4 442 B13R0.147 NCCCOCCCOC[C@@H](O)CO 34a_100011310245_100009815848 [1,0,0,0,0,0|2,0,1]=4 443 B13R0.147 OCC(O)COCCCCCCCBr 34a_100000760002_100011219619 [1,0,0,0,0,0|1,0,1]=3 444 B13R0.147 OCC(O)COCCCCCCCBr 7a_100000760002_100011219619 [1,0,0,0,0,0|1,0,1]=3 445 B13R0.147 OCCCCCCCNCC(O)CO 2230a_100011996573_100011219619 [1,0,0,0,0,0|2,0,1]=4 446 B13R0.147 OCCCCCCCNCC(O)CO 34a_100011996573_100011219619 [1,0,0,0,0,0|2,0,1]=4 447 B13R0.147 OCCCCCCCNC[C@@H](O)CO 2230a_100011996573_100009815848 [1,0,0,0,0,0|2,0,1]=4 448 B13R0.147 OCCCCCCCNC[C@@H](O)CO 34a_100011996573_100009815848 [1,0,0,0,0,0|2,0,1]=4 449 B13R0.147 OCCCCCCCNC[C@H](O)CO 2230a_100020644852_100000760002 [1,0,0,0,0,0|2,0,1]=4 450 B13R0.147 OCCCCCCCSCC(O)CO 62a_100000760002_100011219619 [1,0,0,0,0,0|1,1,1]=4 451 B13R0.147 OCCCCCCCSCC(O)CO 62a_100011219619_100000760002 [1,0,0,0,0,0|1,1,1]=4 452 B13R0.147 OCCCCCCCSC[C@@H](O)CO 62a_100000760002_100009815848 [1,0,0,0,0,0|1,1,1]=4 453 B13R0.147 OCCCCCCCSC[C@@H](O)CO 62a_100009815848_100000760002 [1,0,0,0,0,0|1,1,1]=4 454 B13R0.147 OC[C@H](O)COCCCCCCCBr 34a_100000760002_100009815848 [1,0,0,0,0,0|1,0,1]=3 455 B13R0.147 OC[C@H](O)COCCCCCCCBr 7a_100000760002_100009815848 [1,0,0,0,0,0|1,0,1]=3 456 B13R0.147 O[C@@H](CF)COCCCCCCCBr 34a_100000760002_100015614560 [1,0,0,0,0,0|2,0,1]=4 457 B13R0.147 O[C@@H](CF)COCCCCCCCBr 7a_100000760002_100015614560 [1,0,0,0,0,0|2,0,1]=4 458 B13R0.154 C#CCCCCCC(=O)CCC(C)O 1458a_100000694772_100012276601 [1,0,0,0,0,0|1,0,2]=4 459 B13R0.154 C#CCCCCCC(=O)NCC(C)O 11a_100000210904_100000694772 [1,0,0,0,0,0|1,0,2]=4 460 B13R0.154 C#CCCCCCC(=O)NCC(C)O 240690a_100000210904_100000694772 [1,0,0,0,0,0|1,0,2]=4 461 B13R0.154 C#CCCCCCC(=O)NCC(C)O 527a_100000210904_100000694772 [1,0,0,0,0,0|1,0,2]=4 462 B13R0.154 C=C(C)CCC(=O)CCCCCCC 1458a_100000211969_100000730704 [1,0,0,0,0,0|2,0,1]=4 463 B13R0.154 C=C(C)CCC(=O)CCCCCCC 1458a_200000688413_100000210614 [1,0,0,0,0,0|2,0,1]=4 464 B13R0.154 C=C(C)CNC(=O)CCCCCCC 11a_100000765925_100000211969 [1,0,0,0,0,0|2,0,1]=4 465 B13R0.154 C=C(C)CNC(=O)CCCCCCC 1626a_100000765925_100000211969 [1,0,0,0,0,0|2,0,1]=4 466 B13R0.154 C=C(C)CNC(=O)CCCCCCC 240690a_100000765925_100000211969 [1,0,0,0,0,0|2,0,1]=4 467 B13R0.154 C=C(C)CNC(=O)CCCCCCC 527a_100000765925_100000211969 [1,0,0,0,0,0|2,0,1]=4 468 B13R0.154 C=CCCCCCC(=O)CCC(C)O 1458a_100011934241_100012276601 [1,0,0,0,0,0|1,0,2]=4 469 B13R0.154 C=CCCCCCC(=O)NCC(C)O 11a_100000210904_100011934241 [1,0,0,0,0,0|1,0,2]=4 470 B13R0.154 C=CCCCCCC(=O)NCC(C)O 240690a_100000210904_100011934241 [1,0,0,0,0,0|1,0,2]=4 471 B13R0.154 C=CCCCCCC(=O)NCC(C)O 527a_100000210904_100011934241 [1,0,0,0,0,0|1,0,2]=4 472 B13R0.154 CC(C)CCC(=O)CCCCCCF 1458a_100000181311_100015922095 [1,0,0,0,0,0|3,0,0]=4 473 B13R0.154 CC(C)CCC(=O)CCCCCCO 1458a_100000181311_100000766143 [1,0,0,0,0,0|3,0,0]=4 474 B13R0.154 CC(C)CCC(=O)CCCCCCO 1458a_100011996774_100000210312 [1,0,0,0,0,0|3,0,0]=4 475 B13R0.154 CC(C)CNC(=O)CCCCCCO 240690a_100000210953_100011996774 [1,0,0,0,0,0|3,0,0]=4 476 B13R0.154 CC(O)CCC(=O)CCCCCCO 1458a_100011996774_100012276601 [1,0,0,0,0,0|2,0,0]=3 477 B13R0.154 CC(O)CNC(=O)CCCCCCO 240690a_100000210904_100011996774 [1,0,0,0,0,0|2,0,0]=3 478 B13R0.154 CC(O)CNC(=O)NCCCCCO 273464a_100000210904_100000762737 [1,0,0,0,0,0|3,0,0]=4 479 B13R0.154 CC(O)CNC(=O)NCCCCCO 273464a_100000762737_100000210904 [1,0,0,0,0,0|3,0,0]=4 480 B13R0.154 CC(O)CNC(=O)NCCCCCO 512a_100000210904_100000762737 [1,0,0,0,0,0|3,0,0]=4 481 B13R0.154 CC(O)CNC(=O)NCCCCCO 512a_100000762737_100000210904 [1,0,0,0,0,0|3,0,0]=4 482 B13R0.154 CCCC/C=C/CC(=O)CCC(C)O 1458a_200016282684_100012276601 [1,0,0,0,0,0|1,0,2]=4 483 B13R0.154 CCCC/C=C/CC(=O)NCC(C)O 11a_100000210904_200016282684 [1,0,0,0,0,0|1,0,2]=4 484 B13R0.154 CCCC/C=C/CC(=O)NCC(C)O 240690a_100000210904_200016282684 [1,0,0,0,0,0|1,0,2]=4 485 B13R0.154 CCCC/C=C/CC(=O)NCC(C)O 527a_100000210904_200016282684 [1,0,0,0,0,0|1,0,2]=4 486 B13R0.154 CCCCCC#CC(=O)CCC(C)O 1458a_100011215388_100012276601 [1,0,0,0,0,0|1,0,2]=4 487 B13R0.154 CCCCCC#CC(=O)NCC(C)O 240690a_100000210904_100011215388 [1,0,0,0,0,0|1,0,2]=4 488 B13R0.154 CCCCCC=CC(=O)CCC(C)O 1458a_100016263427_100012276601 [1,0,0,0,0,0|1,0,2]=4 489 B13R0.154 CCCCCC=CC(=O)NCC(C)O 11a_100000210904_100016263427 [1,0,0,0,0,0|1,0,2]=4 490 B13R0.154 CCCCCC=CC(=O)NCC(C)O 240690a_100000210904_100016263427 [1,0,0,0,0,0|1,0,2]=4 491 B13R0.154 CCCCCCCC(=O)C=CC(C)C 1458a_100016268746_100000210614 [1,0,0,0,0,0|2,0,1]=4 492 B13R0.154 CCCCCCCC(=O)CCC(C)C 1458a_100000181311_100000210614 [1,0,0,0,0,0|2,0,0]=3 493 B13R0.154 CCCCCCCC(=O)CCC(C)C 1458a_100000211969_100000210312 [1,0,0,0,0,0|2,0,0]=3 494 B13R0.154 CCCCCCCC(=O)CCC(C)O 1458a_100000211969_100012276601 [1,0,0,0,0,0|1,0,0]=2 495 B13R0.154 CCCCCCCC(=O)CC[S+](C)C 1458a_100009452791_100000210614 [1,0,0,0,0,0|3,0,0]=4 496 B13R0.154 CCCCCCCC(=O)COC(C)C 1458a_100000745533_100000210614 [1,0,0,0,0,0|3,0,0]=4 497 B13R0.154 CCCCCCCC(=O)CSC(C)C 1458a_100000241585_100000210614 [1,0,0,0,0,0|3,0,0]=4 498 B13R0.154 CCCCCCCC(=O)NCC(=O)C 1458a_100000691742_200000210301 [1,0,0,0,0,0|1,0,2]=4 499 B13R0.154 CCCCCCCC(=O)NCC(=O)[13CH3] 1458a_100000691742_200025704644 [1,0,0,0,0,0|1,0,2]=4 500 B13R0.154 CCCCCCCC(=O)NCC(C)C 11a_100000210953_100000211969 [1,0,0,0,0,0|2,0,0]=3 501 B13R0.154 CCCCCCCC(=O)NCC(C)C 1626a_100000210953_100000211969 [1,0,0,0,0,0|2,0,0]=3 502 B13R0.154 CCCCCCCC(=O)NCC(C)C 240690a_100000210953_100000211969 [1,0,0,0,0,0|2,0,0]=3 503 B13R0.154 CCCCCCCC(=O)NCC(C)C 527a_100000210953_100000211969 [1,0,0,0,0,0|2,0,0]=3 504 B13R0.154 CCCCCCCC(=O)NCC(C)O 11a_100000210904_100000211969 [1,0,0,0,0,0|1,0,0]=2 505 B13R0.154 CCCCCCCC(=O)NCC(C)O 240690a_100000210904_100000211969 [1,0,0,0,0,0|1,0,0]=2 506 B13R0.154 CCCCCCCC(=O)NCC(C)O 527a_100000210904_100000211969 [1,0,0,0,0,0|1,0,0]=2 507 B13R0.154 CCCCCCCC(=O)NCC(F)F 11a_100000765723_100000211969 [1,0,0,0,0,0|3,0,0]=4 508 B13R0.154 CCCCCCCC(=O)NCC(F)F 1626a_100000765723_100000211969 [1,0,0,0,0,0|3,0,0]=4 509 B13R0.154 CCCCCCCC(=O)NCC(F)F 240690a_100000765723_100000211969 [1,0,0,0,0,0|3,0,0]=4 510 B13R0.154 CCCCCCCC(=O)NCC(F)F 527a_100000765723_100000211969 [1,0,0,0,0,0|3,0,0]=4 511 B13R0.154 CCCCCCCC(=O)NNC(C)C 22a_100000741168_100000211969 [1,0,0,0,0,0|3,0,0]=4 512 B13R0.154 CCCCCCCC(=O)OCC(=O)C 1458a_100000070787_100009852258 [1,0,0,0,0,0|0,0,2]=3 513 B13R0.154 CCCCCCCC(=O)OCN(C)C 2230a_100102631434_100009852258 [1,0,0,0,0,0|2,0,0]=3 514 B13R0.154 CCCCCCCC(=O)OCN(C)C 269982a_100102631434_100009852258 [1,0,0,0,0,0|2,0,0]=3 515 B13R0.154 CCCCCCCC(C)NCC(C)O 2230a_100000210904_200011218727 [1,0,0,0,0,0|2,0,1]=4 516 B13R0.154 CCCCCCCC(C)NCC(C)O 270004a_100000210904_100000210596 [1,0,0,0,0,0|2,0,1]=4 517 B13R0.154 CCCCCCCC(C)NCC(C)O 34a_100000210904_200011218727 [1,0,0,0,0,0|2,0,1]=4 518 B13R0.154 CCCCCCCC(C)OCC(C)Br 34a_100012180447_200011218727 [1,0,0,0,0,0|2,0,1]=4 519 B13R0.154 CCCCCCCC(C)OCC(C)C 34a_100000210257_200011218727 [1,0,0,0,0,0|2,0,1]=4 520 B13R0.154 CCCCCCCC(C)OCC(C)C 34a_200011215852_100000210624 [1,0,0,0,0,0|2,0,1]=4 521 B13R0.154 CCCCCCCC(C)OCC(C)C 7a_200011215852_100000210760 [1,0,0,0,0,0|2,0,1]=4 522 B13R0.154 CCCCCCCC(C)OCC(C)F 34a_100015925927_200011218727 [1,0,0,0,0,0|2,0,1]=4 523 B13R0.154 CCCCCCCC(C)OCC(C)O 34a_200011215852_100011218427 [1,0,0,0,0,0|1,0,1]=3 524 B13R0.154 CCCCCCCC(C)OCC(C)O 7a_200011215852_100011218427 [1,0,0,0,0,0|1,0,1]=3 525 B13R0.154 CCCCCCCC(C)OC[C@@H](C)Cl 34a_100016084084_200011218727 [1,0,0,0,0,0|2,0,1]=4 526 B13R0.154 CCCCCCCC(C)OC[C@@H](C)N 34a_100000737577_200011218727 [1,0,0,0,0,0|2,0,1]=4 527 B13R0.154 CCCCCCCC(C)OC[C@@H](C)O 34a_200011215852_100009817552 [1,0,0,0,0,0|1,0,1]=3 528 B13R0.154 CCCCCCCC(C)OC[C@@H](C)O 7a_200011215852_100009817552 [1,0,0,0,0,0|1,0,1]=3 529 B13R0.154 CCCCCCCC(C)SCC(C)O 62a_100011218427_200011218727 [1,0,0,0,0,0|1,1,1]=4 530 B13R0.154 CCCCCCCC(C)SCC(C)O 62a_200011218727_100011218427 [1,0,0,0,0,0|1,1,1]=4 531 B13R0.154 CCCCCCCC(C)SC[C@@H](C)O 62a_100009817552_200011218727 [1,0,0,0,0,0|1,1,1]=4 532 B13R0.154 CCCCCCCC(C)SC[C@@H](C)O 62a_200011218727_100009817552 [1,0,0,0,0,0|1,1,1]=4 533 B13R0.154 CCCCCCCN(C)CCC(C)O 2230a_100000228206_100012276601 [1,0,0,0,0,0|3,0,0]=4 534 B13R0.154 CCCCCCCN(C)CCC(C)O 269982a_100000228206_100012276601 [1,0,0,0,0,0|3,0,0]=4 535 B13R0.154 CCCCCCNC(=O)CCC(C)C 11a_100000210581_100000181311 [1,0,0,0,0,0|3,0,0]=4 536 B13R0.154 CCCCCCNC(=O)CCC(C)C 1626a_100000210581_100000181311 [1,0,0,0,0,0|3,0,0]=4 537 B13R0.154 CCCCCCNC(=O)CCC(C)C 240690a_100000210581_100000181311 [1,0,0,0,0,0|3,0,0]=4 538 B13R0.154 CCCCCCNC(=O)CCC(C)C 527a_100000210581_100000181311 [1,0,0,0,0,0|3,0,0]=4 539 B13R0.154 CCCCCCNC(=O)CCC(C)O 1626a_100000210581_100000718519 [1,0,0,0,0,0|2,0,0]=3 540 B13R0.154 CCCCCCNC(=O)NCC(C)C 2708a_100000210581_100000210953 [1,0,0,0,0,0|3,0,0]=4 541 B13R0.154 CCCCCCNC(=O)NCC(C)C 2708a_100000210953_100000210581 [1,0,0,0,0,0|3,0,0]=4 542 B13R0.154 CCCCCCNC(=O)NCC(C)C 273464a_100000210581_100000210953 [1,0,0,0,0,0|3,0,0]=4 543 B13R0.154 CCCCCCNC(=O)NCC(C)C 273464a_100000210953_100000210581 [1,0,0,0,0,0|3,0,0]=4 544 B13R0.154 CCCCCCNC(=O)NCC(C)C 512a_100000210581_100000210953 [1,0,0,0,0,0|3,0,0]=4 545 B13R0.154 CCCCCCNC(=O)NCC(C)C 512a_100000210953_100000210581 [1,0,0,0,0,0|3,0,0]=4 546 B13R0.154 CCCCCCNC(=O)NCC(C)O 2708a_100000210581_100000210904 [1,0,0,0,0,0|2,0,0]=3 547 B13R0.154 CCCCCCNC(=O)NCC(C)O 273464a_100000210581_100000210904 [1,0,0,0,0,0|2,0,0]=3 548 B13R0.154 CCCCCCNC(=O)NCC(C)O 273464a_100000210904_100000210581 [1,0,0,0,0,0|2,0,0]=3 549 B13R0.154 CCCCCCNC(=O)NCC(C)O 512a_100000210581_100000210904 [1,0,0,0,0,0|2,0,0]=3 550 B13R0.154 CCCCCCNC(=O)NCC(C)O 512a_100000210904_100000210581 [1,0,0,0,0,0|2,0,0]=3 551 B13R0.154 CCCCCNCC(=O)NCC(C)C 2230a_100000209983_100000183291 [1,0,0,0,0,0|3,0,0]=4 552 B13R0.154 CCCCCNNC(=O)NCC(C)O 273464a_100000210904_100000694160 [1,0,0,0,0,0|3,0,0]=4 553 B13R0.154 CCCCCNNC(=O)NCC(C)O 512a_100000210904_100000694160 [1,0,0,0,0,0|3,0,0]=4 554 B13R0.154 CCCCCNNC(=O)NCC(C)O 512a_100000694160_100000210904 [1,0,0,0,0,0|3,0,0]=4 555 B13R0.154 CCCCCOCC(=O)NCC(C)C 34a_100000210253_100000183291 [1,0,0,0,0,0|3,0,0]=4 556 B13R0.154 CCCCCOCC(=O)NCC(C)C 7a_100000210253_100000183291 [1,0,0,0,0,0|3,0,0]=4 557 B13R0.154 CCCCCSCC(=O)NCC(C)C 62a_100000183291_100000210326 [1,0,0,0,0,0|3,0,0]=4 558 B13R0.154 CCCCCSCC(=O)NCC(C)C 62a_100000210326_100000183291 [1,0,0,0,0,0|3,0,0]=4 559 B13R0.154 CCCCOCCC(=O)CCC(C)C 1458a_100000181311_100000743108 [1,0,0,0,0,0|3,0,0]=4 560 B13R0.154 CCCOCCCC(=O)NCC(C)C 34a_100000210258_100011194448 [1,0,0,0,0,0|3,0,0]=4 561 B13R0.154 CCCOCCNC(=O)CCC(C)O 1626a_100161115042_100000718519 [1,0,0,0,0,0|3,0,0]=4 562 B13R0.154 CCCOCCNC(=O)NCC(C)O 2708a_100161115042_100000210904 [1,0,0,0,0,0|3,0,0]=4 563 B13R0.154 CCCOCCNC(=O)NCC(C)O 273464a_100000210904_100161115042 [1,0,0,0,0,0|3,0,0]=4 564 B13R0.154 CCCOCCNC(=O)NCC(C)O 273464a_100161115042_100000210904 [1,0,0,0,0,0|3,0,0]=4 565 B13R0.154 CCCOCCNC(=O)NCC(C)O 512a_100000210904_100161115042 [1,0,0,0,0,0|3,0,0]=4 566 B13R0.154 CCCOCCNC(=O)NCC(C)O 512a_100161115042_100000210904 [1,0,0,0,0,0|3,0,0]=4 567 B13R0.154 CCCSCCCC(=O)NCC(C)C 62a_100000210303_100011194448 [1,0,0,0,0,0|3,0,0]=4 568 B13R0.154 CCCSCCCC(=O)NCC(C)C 62a_100011194448_100000210303 [1,0,0,0,0,0|3,0,0]=4 569 B13R0.154 CCCSCCNC(=O)NCC(C)O 2708a_100020603323_100000210904 [1,0,0,0,0,0|3,0,0]=4 570 B13R0.154 CCCSCCNC(=O)NCC(C)O 273464a_100000210904_100020603323 [1,0,0,0,0,0|3,0,0]=4 571 B13R0.154 CCCSCCNC(=O)NCC(C)O 273464a_100020603323_100000210904 [1,0,0,0,0,0|3,0,0]=4 572 B13R0.154 CCCSCCNC(=O)NCC(C)O 512a_100000210904_100020603323 [1,0,0,0,0,0|3,0,0]=4 573 B13R0.154 CCCSCCNC(=O)NCC(C)O 512a_100020603323_100000210904 [1,0,0,0,0,0|3,0,0]=4 574 B13R0.154 CCOCCCNC(=O)CCC(C)O 1626a_100000210961_100000718519 [1,0,0,0,0,0|3,0,0]=4 575 B13R0.154 CCOCCCNC(=O)NCC(C)O 2708a_100000210961_100000210904 [1,0,0,0,0,0|3,0,0]=4 576 B13R0.154 CCOCCCNC(=O)NCC(C)O 273464a_100000210904_100000210961 [1,0,0,0,0,0|3,0,0]=4 577 B13R0.154 CCOCCCNC(=O)NCC(C)O 273464a_100000210961_100000210904 [1,0,0,0,0,0|3,0,0]=4 578 B13R0.154 CCOCCCNC(=O)NCC(C)O 512a_100000210904_100000210961 [1,0,0,0,0,0|3,0,0]=4 579 B13R0.154 CCOCCCNC(=O)NCC(C)O 512a_100000210961_100000210904 [1,0,0,0,0,0|3,0,0]=4 580 B13R0.154 COCCCCCC(=O)CCC(C)C 1458a_100011935119_100000210312 [1,0,0,0,0,0|3,0,0]=4 581 B13R0.154 COCCCCCC(=O)CCC(C)O 1458a_100011935119_100012276601 [1,0,0,0,0,0|2,0,0]=3 582 B13R0.154 COCCCCCC(=O)NCC(C)C 11a_100000210953_100011935119 [1,0,0,0,0,0|3,0,0]=4 583 B13R0.154 COCCCCCC(=O)NCC(C)C 1626a_100000210953_100011935119 [1,0,0,0,0,0|3,0,0]=4 584 B13R0.154 COCCCCCC(=O)NCC(C)C 240690a_100000210953_100011935119 [1,0,0,0,0,0|3,0,0]=4 585 B13R0.154 COCCCCCC(=O)NCC(C)C 527a_100000210953_100011935119 [1,0,0,0,0,0|3,0,0]=4 586 B13R0.154 COCCCCCC(=O)NCC(C)O 11a_100000210904_100011935119 [1,0,0,0,0,0|2,0,0]=3 587 B13R0.154 COCCCCCC(=O)NCC(C)O 240690a_100000210904_100011935119 [1,0,0,0,0,0|2,0,0]=3 588 B13R0.154 COCCCCCC(=O)NCC(C)O 527a_100000210904_100011935119 [1,0,0,0,0,0|2,0,0]=3 589 B13R0.154 COCCOCCC(=O)CCC(C)O 1458a_100000745395_100012276601 [1,0,0,0,0,0|3,0,0]=4 590 B13R0.154 COCCOCCC(=O)NCC(C)O 11a_100000210904_100000745395 [1,0,0,0,0,0|3,0,0]=4 591 B13R0.154 COCCOCCC(=O)NCC(C)O 240690a_100000210904_100000745395 [1,0,0,0,0,0|3,0,0]=4 592 B13R0.154 COCCOCCC(=O)NCC(C)O 527a_100000210904_100000745395 [1,0,0,0,0,0|3,0,0]=4 593 B13R0.338 C#CCCCC(=O)CCCCCCC 1458a_100000211969_100000731252 [1,0,0,0,0,0|2,0,1]=4 594 B13R0.338 C#CCCCC(=O)CCCCCCC 1458a_100000690238_100000210614 [1,0,0,0,0,0|2,0,1]=4 595 B13R0.338 C#CCCCCCC(=O)CCCCO 1458a_100000694772_100000210776 [1,0,0,0,0,0|1,0,2]=4 596 B13R0.338 C#CCCCCCC(=O)CCCCO 1458a_100000695505_100012094781 [1,0,0,0,0,0|1,0,2]=4 597 B13R0.338 C#CCCCCCC(=O)NCCCO 240690a_100000182051_100000694772 [1,0,0,0,0,0|1,0,2]=4 598 B13R0.338 C#CCCCCCC(=O)NCCCO 527a_100000182051_100000694772 [1,0,0,0,0,0|1,0,2]=4 599 B13R0.338 C#CCCNC(=O)CCCCCCC 11a_100000755551_100000211969 [1,0,0,0,0,0|2,0,1]=4 600 B13R0.338 C#CCCNC(=O)CCCCCCC 1626a_100000755551_100000211969 [1,0,0,0,0,0|2,0,1]=4 601 B13R0.338 C#CCCNC(=O)CCCCCCC 240690a_100000755551_100000211969 [1,0,0,0,0,0|2,0,1]=4 602 B13R0.338 C#CCCNC(=O)CCCCCCC 527a_100000755551_100000211969 [1,0,0,0,0,0|2,0,1]=4 603 B13R0.338 C=CCCCC(=O)CCCCCCC 1458a_100000211969_100000757094 [1,0,0,0,0,0|2,0,1]=4 604 B13R0.338 C=CCCCC(=O)CCCCCCC 1458a_100000766728_100000210614 [1,0,0,0,0,0|2,0,1]=4 605 B13R0.338 C=CCCCCCC(=O)CCCCO 1458a_100000695505_100000700193 [1,0,0,0,0,0|1,0,2]=4 606 B13R0.338 C=CCCCCCC(=O)CCCCO 1458a_100011934241_100000210776 [1,0,0,0,0,0|1,0,2]=4 607 B13R0.338 C=CCCCCCC(=O)NCCCO 240690a_100000182051_100011934241 [1,0,0,0,0,0|1,0,2]=4 608 B13R0.338 C=CCCCCCC(=O)NCCCO 527a_100000182051_100011934241 [1,0,0,0,0,0|1,0,2]=4 609 B13R0.338 C=CCCNC(=O)CCCCCCC 11a_100015191253_100000211969 [1,0,0,0,0,0|2,0,1]=4 610 B13R0.338 C=CCCNC(=O)CCCCCCC 1626a_100015191253_100000211969 [1,0,0,0,0,0|2,0,1]=4 611 B13R0.338 C=CCCNC(=O)CCCCCCC 240690a_100015191253_100000211969 [1,0,0,0,0,0|2,0,1]=4 612 B13R0.338 C=CCCNC(=O)CCCCCCC 527a_100015191253_100000211969 [1,0,0,0,0,0|2,0,1]=4 613 B13R0.338 CCCC#CC(=O)CCCCCCC 1458a_200011218047_100000210614 [1,0,0,0,0,0|2,0,1]=4 614 B13R0.338 CCCC/C=C/CC(=O)CCCCO 1458a_200016282684_100000210776 [1,0,0,0,0,0|1,0,2]=4 615 B13R0.338 CCCC/C=C/CC(=O)NCCCO 240690a_100000182051_200016282684 [1,0,0,0,0,0|1,0,2]=4 616 B13R0.338 CCCC/C=C/CC(=O)NCCCO 527a_100000182051_200016282684 [1,0,0,0,0,0|1,0,2]=4 617 B13R0.338 CCCC=CC(=O)CCCCCCC 1458a_100000212230_100000210614 [1,0,0,0,0,0|2,0,1]=4 618 B13R0.338 CCCCCC#CC(=O)CCCCO 1458a_100011215388_100000210776 [1,0,0,0,0,0|1,0,2]=4 619 B13R0.338 CCCCCC#CC(=O)NCCCO 240690a_100000182051_100011215388 [1,0,0,0,0,0|1,0,2]=4 620 B13R0.338 CCCCCC(=O)CCCCCCF 1458a_100000212188_100015922095 [1,0,0,0,0,0|3,0,0]=4 621 B13R0.338 CCCCCC(=O)CCCCCCO 1458a_100000212188_100000766143 [1,0,0,0,0,0|3,0,0]=4 622 B13R0.338 CCCCCC(=O)CCCCCCO 1458a_100011996774_100000210326 [1,0,0,0,0,0|3,0,0]=4 623 B13R0.338 CCCCCC(=O)CCCCCOC 1458a_100011935119_100000210326 [1,0,0,0,0,0|3,0,0]=4 624 B13R0.338 CCCCCC(=O)CCOCCCC 1458a_100000212188_100000743108 [1,0,0,0,0,0|3,0,0]=4 625 B13R0.338 CCCCCC=CC(=O)CCCCO 1458a_100016263427_100000210776 [1,0,0,0,0,0|1,0,2]=4 626 B13R0.338 CCCCCC=CC(=O)NCCCO 240690a_100000182051_100016263427 [1,0,0,0,0,0|1,0,2]=4 627 B13R0.338 CCCCCCCC(=NNCCO)C 4a_100000210001_100000210596 [1,0,0,0,0,0|3,0,0]=4 628 B13R0.338 CCCCCCCC(=O)CC#CCO 1458a_100000211969_200000047223 [1,0,0,0,0,0|1,0,2]=4 629 B13R0.338 CCCCCCCC(=O)CCCC#N 1458a_100000075515_100000210614 [1,0,0,0,0,0|2,0,1]=4 630 B13R0.338 CCCCCCCC(=O)CCCC#N 1458a_100000211969_100000211468 [1,0,0,0,0,0|2,0,1]=4 631 B13R0.338 CCCCCCCC(=O)CCCCC 1458a_100000211969_100000210326 [1,0,0,0,0,0|2,0,0]=3 632 B13R0.338 CCCCCCCC(=O)CCCCC 1458a_100000212188_100000210614 [1,0,0,0,0,0|2,0,0]=3 633 B13R0.338 CCCCCCCC(=O)CCCCF 1458a_100000211969_100000729493 [1,0,0,0,0,0|2,0,0]=3 634 B13R0.338 CCCCCCCC(=O)CCCCO 1458a_100000211969_100000210776 [1,0,0,0,0,0|1,0,0]=2 635 B13R0.338 CCCCCCCC(=O)CCCCO 1458a_100000695505_100000210614 [1,0,0,0,0,0|1,0,0]=2 636 B13R0.338 CCCCCCCC(=O)CCCOC 1458a_100000211969_100000740836 [1,0,0,0,0,0|3,0,0]=4 637 B13R0.338 CCCCCCCC(=O)CCCOC 1458a_100000741012_100000210614 [1,0,0,0,0,0|3,0,0]=4 638 B13R0.338 CCCCCCCC(=O)CCCSC 1458a_100000173376_100000210614 [1,0,0,0,0,0|3,0,0]=4 639 B13R0.338 CCCCCCCC(=O)CCOCC 1458a_100000211969_100011215890 [1,0,0,0,0,0|3,0,0]=4 640 B13R0.338 CCCCCCCC(=O)CCOCC 1458a_100000749530_100000210614 [1,0,0,0,0,0|3,0,0]=4 641 B13R0.338 CCCCCCCC(=O)CCSCC 1458a_100000211969_100000757381 [1,0,0,0,0,0|3,0,0]=4 642 B13R0.338 CCCCCCCC(=O)CCSCC 1458a_100000230768_100000210614 [1,0,0,0,0,0|3,0,0]=4 643 B13R0.338 CCCCCCCC(=O)COCCC 1458a_100000745993_100000210614 [1,0,0,0,0,0|3,0,0]=4 644 B13R0.338 CCCCCCCC(=O)COCCO 1458a_100000708028_100000210614 [1,0,0,0,0,0|2,0,0]=3 645 B13R0.338 CCCCCCCC(=O)CSCCC 1458a_100000217233_100000210614 [1,0,0,0,0,0|3,0,0]=4 646 B13R0.338 CCCCCCCC(=O)NCCC#N 11a_100000720768_100000211969 [1,0,0,0,0,0|2,0,1]=4 647 B13R0.338 CCCCCCCC(=O)NCCC#N 1626a_100000720768_100000211969 [1,0,0,0,0,0|2,0,1]=4 648 B13R0.338 CCCCCCCC(=O)NCCC#N 240690a_100000720768_100000211969 [1,0,0,0,0,0|2,0,1]=4 649 B13R0.338 CCCCCCCC(=O)NCCC#N 527a_100000720768_100000211969 [1,0,0,0,0,0|2,0,1]=4 650 B13R0.338 CCCCCCCC(=O)NCCCC 11a_100000102301_100000211969 [1,0,0,0,0,0|2,0,0]=3 651 B13R0.338 CCCCCCCC(=O)NCCCC 1626a_100000102301_100000211969 [1,0,0,0,0,0|2,0,0]=3 652 B13R0.338 CCCCCCCC(=O)NCCCC 240690a_100000102301_100000211969 [1,0,0,0,0,0|2,0,0]=3 653 B13R0.338 CCCCCCCC(=O)NCCCC 527a_100000102301_100000211969 [1,0,0,0,0,0|2,0,0]=3 654 B13R0.338 CCCCCCCC(=O)NCCCF 11a_100015189416_100000211969 [1,0,0,0,0,0|2,0,0]=3 655 B13R0.338 CCCCCCCC(=O)NCCCF 1626a_100015189416_100000211969 [1,0,0,0,0,0|2,0,0]=3 656 B13R0.338 CCCCCCCC(=O)NCCCF 240690a_100015189416_100000211969 [1,0,0,0,0,0|2,0,0]=3 657 B13R0.338 CCCCCCCC(=O)NCCCF 527a_100015189416_100000211969 [1,0,0,0,0,0|2,0,0]=3 658 B13R0.338 CCCCCCCC(=O)NCCCO 240690a_100000182051_100000211969 [1,0,0,0,0,0|1,0,0]=2 659 B13R0.338 CCCCCCCC(=O)NCCCO 527a_100000182051_100000211969 [1,0,0,0,0,0|1,0,0]=2 660 B13R0.338 CCCCCCCC(=O)NCCOC 1626a_100000209980_100000211969 [1,0,0,0,0,0|3,0,0]=4 661 B13R0.338 CCCCCCCC(=O)NCCOC 240690a_100000209980_100000211969 [1,0,0,0,0,0|3,0,0]=4 662 B13R0.338 CCCCCCCC(=O)NCCOC 527a_100000209980_100000211969 [1,0,0,0,0,0|3,0,0]=4 663 B13R0.338 CCCCCCCC(=O)NCCSC 11a_100020590264_100000211969 [1,0,0,0,0,0|3,0,0]=4 664 B13R0.338 CCCCCCCC(=O)NCCSC 1626a_100020590264_100000211969 [1,0,0,0,0,0|3,0,0]=4 665 B13R0.338 CCCCCCCC(=O)NCCSC 240690a_100020590264_100000211969 [1,0,0,0,0,0|3,0,0]=4 666 B13R0.338 CCCCCCCC(=O)NCCSC 527a_100020590264_100000211969 [1,0,0,0,0,0|3,0,0]=4 667 B13R0.338 CCCCCCCC(=O)NNCCC 22a_100000740057_100000211969 [1,0,0,0,0,0|3,0,0]=4 668 B13R0.338 CCCCCCCC(=O)NNCCO 22a_100000210001_100000211969 [1,0,0,0,0,0|2,0,0]=3 669 B13R0.338 CCCCCCCC(=O)OCNCC 2230a_100015525214_100009852258 [1,0,0,0,0,0|2,0,0]=3 670 B13R0.338 CCCCCCCC(=O)OCOCC 34a_100121572206_100009852258 [1,0,0,0,0,0|2,0,0]=3 671 B13R0.338 CCCCCCCC(=O)OCSCC 62a_100000210202_100009852258 [1,0,0,0,0,0|2,0,0]=3 672 B13R0.338 CCCCCCCC(=O)OCSCF 62a_100015361967_100009852258 [1,0,0,0,0,0|2,0,0]=3 673 B13R0.338 CCCCCCCC(C)NCCCO 270004a_100000182051_100000210596 [1,0,0,0,0,0|2,0,1]=4 674 B13R0.338 CCCCCCCC(C)OCCCBr 34a_100011217188_200011218727 [1,0,0,0,0,0|2,0,1]=4 675 B13R0.338 CCCCCCCC(C)OCCCC 34a_100000210227_200011218727 [1,0,0,0,0,0|2,0,1]=4 676 B13R0.338 CCCCCCCC(C)OCCCC 34a_200011215852_100000210210 [1,0,0,0,0,0|2,0,1]=4 677 B13R0.338 CCCCCCCC(C)OCCCC 7a_100000210227_200011218727 [1,0,0,0,0,0|2,0,1]=4 678 B13R0.338 CCCCCCCC(C)OCCCC 7a_200011215852_100000210211 [1,0,0,0,0,0|2,0,1]=4 679 B13R0.338 CCCCCCCC(C)OCCCCl 34a_100000230001_200011218727 [1,0,0,0,0,0|2,0,1]=4 680 B13R0.338 CCCCCCCC(C)OCCCF 34a_100000759539_200011218727 [1,0,0,0,0,0|2,0,1]=4 681 B13R0.338 CCCCCCCC(C)OCCCF 34a_200011215852_100011934791 [1,0,0,0,0,0|2,0,1]=4 682 B13R0.338 CCCCCCCC(C)OCCCF 7a_200011215852_100011934791 [1,0,0,0,0,0|2,0,1]=4 683 B13R0.338 CCCCCCCC(C)OCCCN 34a_100000182051_200011218727 [1,0,0,0,0,0|2,0,1]=4 684 B13R0.338 CCCCCCCC(C)OCCCO 34a_200011215852_100000230001 [1,0,0,0,0,0|1,0,1]=3 685 B13R0.338 CCCCCCCC(C)OCCCO 7a_200011215852_100011215043 [1,0,0,0,0,0|1,0,1]=3 686 B13R0.338 CCCCCCCC(C)SCCCO 62a_100011215043_200011218727 [1,0,0,0,0,0|1,1,1]=4 687 B13R0.338 CCCCCCCC(C)SCCCO 62a_200011218727_100011215043 [1,0,0,0,0,0|1,1,1]=4 688 B13R0.338 CCCCCCCN(C)CCCCO 2230a_100000228206_100000210776 [1,0,0,0,0,0|3,0,0]=4 689 B13R0.338 CCCCCCCN(C)CCCCO 2230a_100000717598_100000210681 [1,0,0,0,0,0|3,0,0]=4 690 B13R0.338 CCCCCCCN(C)CCCCO 269982a_100000228206_100000210776 [1,0,0,0,0,0|3,0,0]=4 691 B13R0.338 CCCCCCCN(C)CCCCO 269982a_100000717598_100000210681 [1,0,0,0,0,0|3,0,0]=4 692 B13R0.338 CCCCCCNC(=O)CCCCC 11a_100000210581_100000212188 [1,0,0,0,0,0|3,0,0]=4 693 B13R0.338 CCCCCCNC(=O)CCCCC 1626a_100000210581_100000212188 [1,0,0,0,0,0|3,0,0]=4 694 B13R0.338 CCCCCCNC(=O)CCCCC 240690a_100000210581_100000212188 [1,0,0,0,0,0|3,0,0]=4 695 B13R0.338 CCCCCCNC(=O)CCCCC 527a_100000210581_100000212188 [1,0,0,0,0,0|3,0,0]=4 696 B13R0.338 CCCCCCNC(=O)CCCCO 1626a_100000210581_100000695505 [1,0,0,0,0,0|2,0,0]=3 697 B13R0.338 CCCCCCNC(=O)CNCCO 2230a_100016997473_100000230325 [1,0,0,0,0,0|3,0,0]=4 698 B13R0.338 CCCCCCNC(=O)CNCCO 34a_100016990907_100000230325 [1,0,0,0,0,0|3,0,0]=4 699 B13R0.338 CCCCCCNC(=O)COCCO 1626a_100000210581_100000708028 [1,0,0,0,0,0|3,0,0]=4 700 B13R0.338 CCCCCCNC(=O)COCCO 240690a_100000210581_100000708028 [1,0,0,0,0,0|3,0,0]=4 701 B13R0.338 CCCCCCNC(=O)CSCCO 62a_100000230325_100000211926 [1,0,0,0,0,0|3,0,0]=4 702 B13R0.338 CCCCCCNC(=O)NCCCC 2708a_100000102301_100000210581 [1,0,0,0,0,0|3,0,0]=4 703 B13R0.338 CCCCCCNC(=O)NCCCC 2708a_100000210581_100000102301 [1,0,0,0,0,0|3,0,0]=4 704 B13R0.338 CCCCCCNC(=O)NCCCC 273464a_100000102301_100000210581 [1,0,0,0,0,0|3,0,0]=4 705 B13R0.338 CCCCCCNC(=O)NCCCC 273464a_100000210581_100000102301 [1,0,0,0,0,0|3,0,0]=4 706 B13R0.338 CCCCCCNC(=O)NCCCC 512a_100000102301_100000210581 [1,0,0,0,0,0|3,0,0]=4 707 B13R0.338 CCCCCCNC(=O)NCCCC 512a_100000210581_100000102301 [1,0,0,0,0,0|3,0,0]=4 708 B13R0.338 CCCCCCNC(=O)NCCCF 2708a_100000210581_100015189416 [1,0,0,0,0,0|3,0,0]=4 709 B13R0.338 CCCCCCNC(=O)NCCCF 2708a_100015189416_100000210581 [1,0,0,0,0,0|3,0,0]=4 710 B13R0.338 CCCCCCNC(=O)NCCCF 273464a_100000210581_100015189416 [1,0,0,0,0,0|3,0,0]=4 711 B13R0.338 CCCCCCNC(=O)NCCCF 273464a_100015189416_100000210581 [1,0,0,0,0,0|3,0,0]=4 712 B13R0.338 CCCCCCNC(=O)NCCCF 512a_100000210581_100015189416 [1,0,0,0,0,0|3,0,0]=4 713 B13R0.338 CCCCCCNC(=O)NCCCF 512a_100015189416_100000210581 [1,0,0,0,0,0|3,0,0]=4 714 B13R0.338 CCCCCCNC(=O)NCCCO 2708a_100000210581_100000182051 [1,0,0,0,0,0|2,0,0]=3 715 B13R0.338 CCCCCCNC(=O)NCCCO 273464a_100000182051_100000210581 [1,0,0,0,0,0|2,0,0]=3 716 B13R0.338 CCCCCCNC(=O)NCCCO 273464a_100000210581_100000182051 [1,0,0,0,0,0|2,0,0]=3 717 B13R0.338 CCCCCCNC(=O)NCCCO 512a_100000210581_100000182051 [1,0,0,0,0,0|2,0,0]=3 718 B13R0.338 CCCCCCNC(=O)NNCCO 273464a_100000210581_100000210001 [1,0,0,0,0,0|3,0,0]=4 719 B13R0.338 CCCCCCNC(=O)NNCCO 512a_100000210581_100000210001 [1,0,0,0,0,0|3,0,0]=4 720 B13R0.338 CCCCCNCC(=O)CCCCC 2230a_100000209983_200012276598 [1,0,0,0,0,0|3,0,0]=4 721 B13R0.338 CCCCCNCC(=O)NCCCC 2230a_100000209983_100000182744 [1,0,0,0,0,0|3,0,0]=4 722 B13R0.338 CCCCCNCC(=O)OCCCC 2230a_100000209983_100000211628 [1,0,0,0,0,0|2,0,0]=3 723 B13R0.338 CCCCCNCC(=O)OCCOC 2230a_100000209983_200000040189 [1,0,0,0,0,0|3,0,0]=4 724 B13R0.338 CCCCCNNC(=O)NCCCO 273464a_100000182051_100000694160 [1,0,0,0,0,0|3,0,0]=4 725 B13R0.338 CCCCCNNC(=O)NCCCO 512a_100000694160_100000182051 [1,0,0,0,0,0|3,0,0]=4 726 B13R0.338 CCCCCOCC(=O)CCCCC 34a_100000210253_200012276598 [1,0,0,0,0,0|3,0,0]=4 727 B13R0.338 CCCCCOCC(=O)CCCCC 7a_100000210253_200012276598 [1,0,0,0,0,0|3,0,0]=4 728 B13R0.338 CCCCCOCC(=O)NCCCC 34a_100000210253_100000182744 [1,0,0,0,0,0|3,0,0]=4 729 B13R0.338 CCCCCOCC(=O)NCCCC 7a_100000210253_100000182744 [1,0,0,0,0,0|3,0,0]=4 730 B13R0.338 CCCCCOCC(=O)OCCCC 34a_100000210253_100000211628 [1,0,0,0,0,0|2,0,0]=3 731 B13R0.338 CCCCCOCC(=O)OCCCC 7a_100000210253_100000211628 [1,0,0,0,0,0|2,0,0]=3 732 B13R0.338 CCCCCOCC(=O)OCCOC 34a_100000210253_200000040189 [1,0,0,0,0,0|3,0,0]=4 733 B13R0.338 CCCCCOCC(=O)OCCOC 7a_100000210253_200000040189 [1,0,0,0,0,0|3,0,0]=4 734 B13R0.338 CCCCCSCC(=O)CCCCC 62a_100000210326_200012276598 [1,0,0,0,0,0|3,0,0]=4 735 B13R0.338 CCCCCSCC(=O)CCCCC 62a_200012276598_100000210326 [1,0,0,0,0,0|3,0,0]=4 736 B13R0.338 CCCCCSCC(=O)NCCCC 62a_100000182744_100000210326 [1,0,0,0,0,0|3,0,0]=4 737 B13R0.338 CCCCCSCC(=O)NCCCC 62a_100000210326_100000182744 [1,0,0,0,0,0|3,0,0]=4 738 B13R0.338 CCCCCSCC(=O)OCCCC 62a_100000210326_100000211628 [1,0,0,0,0,0|2,0,0]=3 739 B13R0.338 CCCCCSCC(=O)OCCCC 62a_100000211628_100000210326 [1,0,0,0,0,0|2,0,0]=3 740 B13R0.338 CCCCCSCC(=O)OCCOC 62a_100000210326_200000040189 [1,0,0,0,0,0|3,0,0]=4 741 B13R0.338 CCCCCSCC(=O)OCCOC 62a_200000040189_100000210326 [1,0,0,0,0,0|3,0,0]=4 742 B13R0.338 CCCCNC(=O)CCCCCCO 240690a_100000102301_100011996774 [1,0,0,0,0,0|3,0,0]=4 743 B13R0.338 CCCCNC(=O)CCCCCOC 11a_100000102301_100011935119 [1,0,0,0,0,0|3,0,0]=4 744 B13R0.338 CCCCNC(=O)CCCCCOC 1626a_100000102301_100011935119 [1,0,0,0,0,0|3,0,0]=4 745 B13R0.338 CCCCNC(=O)CCCCCOC 240690a_100000102301_100011935119 [1,0,0,0,0,0|3,0,0]=4 746 B13R0.338 CCCCNC(=O)CCCCCOC 527a_100000102301_100011935119 [1,0,0,0,0,0|3,0,0]=4 747 B13R0.338 CCCCOC(=O)CNCCCCO 2230a_100000750430_100000211628 [1,0,0,0,0,0|3,0,0]=4 748 B13R0.338 CCCCOC(=O)CNCCCCO 34a_100000750430_100000211628 [1,0,0,0,0,0|3,0,0]=4 749 B13R0.338 CCCCOC(=O)CNCCCOC 34a_100150723488_100000211628 [1,0,0,0,0,0|3,0,0]=4 750 B13R0.338 CCCCOC(=O)CNCCCSC 2230a_100000749238_100000211628 [1,0,0,0,0,0|3,0,0]=4 751 B13R0.338 CCCCOC(=O)CNCCOCC 2230a_102516460346_100000211628 [1,0,0,0,0,0|3,0,0]=4 752 B13R0.338 CCCCOC(=O)CNCCOCC 34a_102516460346_100000211628 [1,0,0,0,0,0|3,0,0]=4 753 B13R0.338 CCCCOC(=O)CNCCSCC 2230a_100000106463_100000211628 [1,0,0,0,0,0|3,0,0]=4 754 B13R0.338 CCCCOC(=O)COCCCCBr 34a_100011216708_100000211628 [1,0,0,0,0,0|3,0,0]=4 755 B13R0.338 CCCCOC(=O)COCCCCCl 34a_100000210776_100000211628 [1,0,0,0,0,0|3,0,0]=4 756 B13R0.338 CCCCOC(=O)COCCCCCl 7a_100000210776_100000211628 [1,0,0,0,0,0|3,0,0]=4 757 B13R0.338 CCCCOC(=O)COCCCCF 34a_100011995726_100000211628 [1,0,0,0,0,0|3,0,0]=4 758 B13R0.338 CCCCOC(=O)COCCCCF 7a_100011995726_100000211628 [1,0,0,0,0,0|3,0,0]=4 759 B13R0.338 CCCCOC(=O)COCCCCI 34a_200012148704_100000211628 [1,0,0,0,0,0|3,0,0]=4 760 B13R0.338 CCCCOC(=O)COCCCCN 34a_100000750430_100000211628 [1,0,0,0,0,0|3,0,0]=4 761 B13R0.338 CCCCOC(=O)COCCCNC 34a_100000213112_100000211628 [1,0,0,0,0,0|3,0,0]=4 762 B13R0.338 CCCCOC(=O)COCCCOC 34a_100000740835_100000211628 [1,0,0,0,0,0|3,0,0]=4 763 B13R0.338 CCCCOC(=O)COCCCSC 34a_100000690336_100000211628 [1,0,0,0,0,0|3,0,0]=4 764 B13R0.338 CCCCOC(=O)COCCCSC 7a_100000690336_100000211628 [1,0,0,0,0,0|3,0,0]=4 765 B13R0.338 CCCCOC(=O)COCCOCC 34a_100000210136_100000211628 [1,0,0,0,0,0|3,0,0]=4 766 B13R0.338 CCCCOC(=O)COCCOCC 7a_100000210136_100000211628 [1,0,0,0,0,0|3,0,0]=4 767 B13R0.338 CCCCOC(=O)COCCSCC 34a_100000212035_100000211628 [1,0,0,0,0,0|3,0,0]=4 768 B13R0.338 CCCCOC(=O)COCCSCC 7a_100000212035_100000211628 [1,0,0,0,0,0|3,0,0]=4 769 B13R0.338 CCCCOC(=O)CSCCCCF 62a_100000211628_100000729493 [1,0,0,0,0,0|3,0,0]=4 770 B13R0.338 CCCCOC(=O)CSCCCCF 62a_100000729493_100000211628 [1,0,0,0,0,0|3,0,0]=4 771 B13R0.338 CCCCOC(=O)CSCCCCO 62a_100000210776_100000211628 [1,0,0,0,0,0|3,0,0]=4 772 B13R0.338 CCCCOC(=O)CSCCCCO 62a_100000211628_100000210776 [1,0,0,0,0,0|3,0,0]=4 773 B13R0.338 CCCCOC(=O)CSCCCOC 62a_100000211628_100000709357 [1,0,0,0,0,0|3,0,0]=4 774 B13R0.338 CCCCOC(=O)CSCCCOC 62a_100000709357_100000211628 [1,0,0,0,0,0|3,0,0]=4 775 B13R0.338 CCCCOC(=O)CSCCOCC 62a_100000210147_100000211628 [1,0,0,0,0,0|3,0,0]=4 776 B13R0.338 CCCCOC(=O)CSCCOCC 62a_100000211628_100011215890 [1,0,0,0,0,0|3,0,0]=4 777 B13R0.338 CCCCOC(=O)CSCCSCC 62a_100000211628_100000757381 [1,0,0,0,0,0|3,0,0]=4 778 B13R0.338 CCCCOC(=O)CSCCSCC 62a_100000757381_100000211628 [1,0,0,0,0,0|3,0,0]=4 779 B13R0.338 CCCCOCCC(=O)CCCCO 1458a_100000695505_100000743108 [1,0,0,0,0,0|2,0,0]=3 780 B13R0.338 CCCCOCCC(=O)COCCO 1458a_100000708028_100000743108 [1,0,0,0,0,0|3,0,0]=4 781 B13R0.338 CCCOCCNC(=O)CCCCO 1626a_100161115042_100000695505 [1,0,0,0,0,0|3,0,0]=4 782 B13R0.338 CCCOCCNC(=O)NCCCO 2708a_100161115042_100000182051 [1,0,0,0,0,0|3,0,0]=4 783 B13R0.338 CCCOCCNC(=O)NCCCO 273464a_100000182051_100161115042 [1,0,0,0,0,0|3,0,0]=4 784 B13R0.338 CCCOCCNC(=O)NCCCO 273464a_100161115042_100000182051 [1,0,0,0,0,0|3,0,0]=4 785 B13R0.338 CCCOCCNC(=O)NCCCO 512a_100161115042_100000182051 [1,0,0,0,0,0|3,0,0]=4 786 B13R0.338 CCCSCCNC(=O)NCCCO 2708a_100020603323_100000182051 [1,0,0,0,0,0|3,0,0]=4 787 B13R0.338 CCCSCCNC(=O)NCCCO 273464a_100000182051_100020603323 [1,0,0,0,0,0|3,0,0]=4 788 B13R0.338 CCCSCCNC(=O)NCCCO 273464a_100020603323_100000182051 [1,0,0,0,0,0|3,0,0]=4 789 B13R0.338 CCCSCCNC(=O)NCCCO 512a_100020603323_100000182051 [1,0,0,0,0,0|3,0,0]=4 790 B13R0.338 CCOCCCNC(=O)CCCCO 1626a_100000210961_100000695505 [1,0,0,0,0,0|3,0,0]=4 791 B13R0.338 CCOCCCNC(=O)NCCCO 2708a_100000210961_100000182051 [1,0,0,0,0,0|3,0,0]=4 792 B13R0.338 CCOCCCNC(=O)NCCCO 273464a_100000182051_100000210961 [1,0,0,0,0,0|3,0,0]=4 793 B13R0.338 CCOCCCNC(=O)NCCCO 273464a_100000210961_100000182051 [1,0,0,0,0,0|3,0,0]=4 794 B13R0.338 CCOCCCNC(=O)NCCCO 512a_100000210961_100000182051 [1,0,0,0,0,0|3,0,0]=4 795 B13R0.338 COCCCCCC(=O)CCCCF 1458a_100011935119_100000729493 [1,0,0,0,0,0|3,0,0]=4 796 B13R0.338 COCCCCCC(=O)CCCCO 1458a_100011935119_100000210776 [1,0,0,0,0,0|2,0,0]=3 797 B13R0.338 COCCCCCC(=O)NCCCF 11a_100015189416_100011935119 [1,0,0,0,0,0|3,0,0]=4 798 B13R0.338 COCCCCCC(=O)NCCCF 1626a_100015189416_100011935119 [1,0,0,0,0,0|3,0,0]=4 799 B13R0.338 COCCCCCC(=O)NCCCF 240690a_100015189416_100011935119 [1,0,0,0,0,0|3,0,0]=4 800 B13R0.338 COCCCCCC(=O)NCCCF 527a_100015189416_100011935119 [1,0,0,0,0,0|3,0,0]=4 801 B13R0.338 COCCCCCC(=O)NCCCO 240690a_100000182051_100011935119 [1,0,0,0,0,0|2,0,0]=3 802 B13R0.338 COCCCCCC(=O)NCCCO 527a_100000182051_100011935119 [1,0,0,0,0,0|2,0,0]=3 803 B13R0.338 COCCCCCC(=O)NNCCO 22a_100000210001_100011935119 [1,0,0,0,0,0|3,0,0]=4 804 B13R0.338 COCCOCCC(=O)CCCCO 1458a_100000695505_100000695917 [1,0,0,0,0,0|3,0,0]=4 805 B13R0.338 COCCOCCC(=O)CCCCO 1458a_100000745395_100000210776 [1,0,0,0,0,0|3,0,0]=4 806 B13R0.338 COCCOCCC(=O)NCCCO 240690a_100000182051_100000745395 [1,0,0,0,0,0|3,0,0]=4 807 B13R0.338 COCCOCCC(=O)NCCCO 527a_100000182051_100000745395 [1,0,0,0,0,0|3,0,0]=4 808 B13R0.338 N#CCCCCCC(=O)CCCCO 1458a_100000695505_100009813376 [1,0,0,0,0,0|2,0,1]=4 809 B13R0.338 O=C(CCCCCCF)COCCO 1458a_100000708028_100015922095 [1,0,0,0,0,0|3,0,0]=4 810 B13R0.338 O=C(CCCCCCO)COCCO 1458a_100000708028_100000766143 [1,0,0,0,0,0|3,0,0]=4 811 B13R0.338 O=C(CCCCCCO)NCCCF 240690a_100015189416_100011996774 [1,0,0,0,0,0|3,0,0]=4 812 B13R0.338 O=C(CCCCCCO)NCCCO 240690a_100000182051_100011996774 [1,0,0,0,0,0|2,0,0]=3 813 B13R0.338 O=C(CCCCF)CCCCCCO 1458a_100011996774_100000729493 [1,0,0,0,0,0|3,0,0]=4 814 B13R0.338 O=C(CCCCO)CCCCCCF 1458a_100000695505_100015922095 [1,0,0,0,0,0|2,0,0]=3 815 B13R0.338 O=C(CCCCO)CCCCCCO 1458a_100000695505_100000766143 [1,0,0,0,0,0|2,0,0]=3 816 B13R0.338 O=C(CCCCO)CCCCCCO 1458a_100011996774_100000210776 [1,0,0,0,0,0|2,0,0]=3 817 B13R0.338 O=C(NCCCO)NCCCCCO 273464a_100000182051_100000762737 [1,0,0,0,0,0|3,0,0]=4 818 B13R0.338 O=C(NCCCO)NCCCCCO 273464a_100000762737_100000182051 [1,0,0,0,0,0|3,0,0]=4 819 B13R0.338 O=C(NCCCO)NCCCCCO 512a_100000762737_100000182051 [1,0,0,0,0,0|3,0,0]=4 820 B13R0.1170 C#CCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000696528 [1,0,0,0,0,0|1,0,2]=4 821 B13R0.1170 C#CCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000696528 [1,0,0,0,0,0|1,0,2]=4 822 B13R0.1170 C=CCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100011215552 [1,0,0,0,0,0|1,0,2]=4 823 B13R0.1170 C=CCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100011215552 [1,0,0,0,0,0|1,0,2]=4 824 B13R0.1170 CC(CO)CNC(=O)CCCCCO 240690a_100000744482_100102619762 [1,0,0,0,0,0|3,0,0]=4 825 B13R0.1170 CCC(O)CNC(=O)CCCCCO 240690a_100011218483_100102619762 [1,0,0,0,0,0|3,0,0]=4 826 B13R0.1170 CCC/C=C/CC(=O)NC[C@H](O)CO 240690a_100020644852_200016266809 [1,0,0,0,0,0|1,0,2]=4 827 B13R0.1170 CCC/C=C/CC(=O)NC[C@H](O)CO 527a_100020644852_200016266809 [1,0,0,0,0,0|1,0,2]=4 828 B13R0.1170 CCCCC=CC(=O)NC[C@H](O)CO 240690a_100020644852_100016266645 [1,0,0,0,0,0|1,0,2]=4 829 B13R0.1170 CCCCCCC(=O)CCC(C)CC 1458a_100000701222_100000210757 [1,0,0,0,0,0|3,0,0]=4 830 B13R0.1170 CCCCCCC(=O)NCC(C)CC 11a_100020588543_100102632555 [1,0,0,0,0,0|3,0,0]=4 831 B13R0.1170 CCCCCCC(=O)NCC(C)CC 1626a_100020588543_100102632555 [1,0,0,0,0,0|3,0,0]=4 832 B13R0.1170 CCCCCCC(=O)NCC(C)CC 240690a_100020588543_100102632555 [1,0,0,0,0,0|3,0,0]=4 833 B13R0.1170 CCCCCCC(=O)NCC(C)CC 527a_100020588543_100102632555 [1,0,0,0,0,0|3,0,0]=4 834 B13R0.1170 CCCCCCC(=O)NCC(C)CO 240690a_100000744482_100102632555 [1,0,0,0,0,0|2,0,0]=3 835 B13R0.1170 CCCCCCC(=O)NCC(C)CO 527a_100000744482_100102632555 [1,0,0,0,0,0|2,0,0]=3 836 B13R0.1170 CCCCCCC(=O)NCC(O)CC 11a_100011218483_100102632555 [1,0,0,0,0,0|2,0,0]=3 837 B13R0.1170 CCCCCCC(=O)NCC(O)CC 240690a_100011218483_100102632555 [1,0,0,0,0,0|2,0,0]=3 838 B13R0.1170 CCCCCCC(=O)NCC(O)CC 527a_100011218483_100102632555 [1,0,0,0,0,0|2,0,0]=3 839 B13R0.1170 CCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100102632555 [1,0,0,0,0,0|2,0,0]=3 840 B13R0.1170 CCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100102632555 [1,0,0,0,0,0|2,0,0]=3 841 B13R0.1170 CCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100102632555 [1,0,0,0,0,0|1,0,0]=2 842 B13R0.1170 CCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100102632555 [1,0,0,0,0,0|1,0,0]=2 843 B13R0.1170 CCCCCCC(C)NCC(O)CO 2230a_100000210919_100011219619 [1,0,0,0,0,0|2,0,1]=4 844 B13R0.1170 CCCCCCC(C)NCC(O)CO 34a_100000210919_100011219619 [1,0,0,0,0,0|2,0,1]=4 845 B13R0.1170 CCCCCCC(C)NC[C@@H](O)CO 2230a_100000210919_100009815848 [1,0,0,0,0,0|2,0,1]=4 846 B13R0.1170 CCCCCCC(C)NC[C@@H](O)CO 34a_100000210919_100009815848 [1,0,0,0,0,0|2,0,1]=4 847 B13R0.1170 CCCCCCC(C)NC[C@H](O)CO 2230a_100020644852_100011215978 [1,0,0,0,0,0|2,0,1]=4 848 B13R0.1170 CCCCCCC(C)OCC(O)CC 34a_100000210265_100011218378 [1,0,0,0,0,0|2,0,1]=4 849 B13R0.1170 CCCCCCC(C)OCC(O)CC 7a_100000210265_100011218378 [1,0,0,0,0,0|2,0,1]=4 850 B13R0.1170 CCCCCCC(C)OCC(O)CO 34a_100000210265_100011219619 [1,0,0,0,0,0|1,0,1]=3 851 B13R0.1170 CCCCCCC(C)OCC(O)CO 7a_100000210265_100011219619 [1,0,0,0,0,0|1,0,1]=3 852 B13R0.1170 CCCCCCC(C)OC[C@@H](C)CO 34a_100000210265_100000059175 [1,0,0,0,0,0|2,0,1]=4 853 B13R0.1170 CCCCCCC(C)OC[C@@H](C)CO 7a_100000210265_100000059175 [1,0,0,0,0,0|2,0,1]=4 854 B13R0.1170 CCCCCCC(C)OC[C@@H](O)CF 34a_100000210265_100015614560 [1,0,0,0,0,0|2,0,1]=4 855 B13R0.1170 CCCCCCC(C)OC[C@@H](O)CF 7a_100000210265_100015614560 [1,0,0,0,0,0|2,0,1]=4 856 B13R0.1170 CCCCCCC(C)OC[C@@H](O)CO 34a_100000210265_100009815848 [1,0,0,0,0,0|1,0,1]=3 857 B13R0.1170 CCCCCCC(C)OC[C@@H](O)CO 7a_100000210265_100009815848 [1,0,0,0,0,0|1,0,1]=3 858 B13R0.1170 CCCCCCC(C)SCC(O)CO 62a_100011215978_100011219619 [1,0,0,0,0,0|1,1,1]=4 859 B13R0.1170 CCCCCCC(C)SCC(O)CO 62a_100011219619_100011215978 [1,0,0,0,0,0|1,1,1]=4 860 B13R0.1170 CCCCCCC(C)SC[C@@H](O)CO 62a_100009815848_100011215978 [1,0,0,0,0,0|1,1,1]=4 861 B13R0.1170 CCCCCCC(C)SC[C@@H](O)CO 62a_100011215978_100009815848 [1,0,0,0,0,0|1,1,1]=4 862 B13R0.1170 CCCCCNC(=O)CCC(O)CC 1626a_100000209983_203496584001 [1,0,0,0,0,0|3,0,0]=4 863 B13R0.1170 CCCCCNC(=O)CCC(O)CC 240690a_100000209983_203496584001 [1,0,0,0,0,0|3,0,0]=4 864 B13R0.1170 CCCCCNC(=O)NCC(C)CO 2708a_100000209983_100000744482 [1,0,0,0,0,0|3,0,0]=4 865 B13R0.1170 CCCCCNC(=O)NCC(C)CO 273464a_100000209983_100000744482 [1,0,0,0,0,0|3,0,0]=4 866 B13R0.1170 CCCCCNC(=O)NCC(C)CO 273464a_100000744482_100000209983 [1,0,0,0,0,0|3,0,0]=4 867 B13R0.1170 CCCCCNC(=O)NCC(C)CO 512a_100000209983_100000744482 [1,0,0,0,0,0|3,0,0]=4 868 B13R0.1170 CCCCCNC(=O)NCC(C)CO 512a_100000744482_100000209983 [1,0,0,0,0,0|3,0,0]=4 869 B13R0.1170 CCCCCNC(=O)NCC(O)CC 2708a_100000209983_100011218483 [1,0,0,0,0,0|3,0,0]=4 870 B13R0.1170 CCCCCNC(=O)NCC(O)CC 273464a_100000209983_100011218483 [1,0,0,0,0,0|3,0,0]=4 871 B13R0.1170 CCCCCNC(=O)NCC(O)CC 273464a_100011218483_100000209983 [1,0,0,0,0,0|3,0,0]=4 872 B13R0.1170 CCCCCNC(=O)NCC(O)CC 512a_100011218483_100000209983 [1,0,0,0,0,0|3,0,0]=4 873 B13R0.1170 CCCCCNC(=O)NC[C@@H](F)CO 2708a_100000209983_100015665980 [1,0,0,0,0,0|3,0,0]=4 874 B13R0.1170 CCCCCNC(=O)NC[C@@H](F)CO 273464a_100000209983_100015665980 [1,0,0,0,0,0|3,0,0]=4 875 B13R0.1170 CCCCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_100000209983 [1,0,0,0,0,0|3,0,0]=4 876 B13R0.1170 CCCCCNC(=O)NC[C@@H](F)CO 512a_100000209983_100015665980 [1,0,0,0,0,0|3,0,0]=4 877 B13R0.1170 CCCCCNC(=O)NC[C@@H](F)CO 512a_100015665980_100000209983 [1,0,0,0,0,0|3,0,0]=4 878 B13R0.1170 CCCCCNC(=O)NC[C@H](O)CO 2708a_100000209983_100020644852 [1,0,0,0,0,0|2,0,0]=3 879 B13R0.1170 CCCCCNC(=O)NC[C@H](O)CO 273464a_100000209983_100020644852 [1,0,0,0,0,0|2,0,0]=3 880 B13R0.1170 CCCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000209983 [1,0,0,0,0,0|2,0,0]=3 881 B13R0.1170 CCCCNCC(=O)NCC(O)CO 2230a_100000102301_200012027429 [1,0,0,0,0,0|2,0,0]=3 882 B13R0.1170 CCCCNCC(=O)NCC(O)CO 7a_106832991798_200012027429 [1,0,0,0,0,0|2,0,0]=3 883 B13R0.1170 CCCCOCC(=O)NCC(C)CO 240690a_100000744482_100000757543 [1,0,0,0,0,0|3,0,0]=4 884 B13R0.1170 CCCCOCC(=O)NCC(C)CO 527a_100000744482_100000757543 [1,0,0,0,0,0|3,0,0]=4 885 B13R0.1170 CCCCOCC(=O)NCC(O)CC 11a_100011218483_100000757543 [1,0,0,0,0,0|3,0,0]=4 886 B13R0.1170 CCCCOCC(=O)NCC(O)CC 240690a_100011218483_100000757543 [1,0,0,0,0,0|3,0,0]=4 887 B13R0.1170 CCCCOCC(=O)NCC(O)CC 527a_100011218483_100000757543 [1,0,0,0,0,0|3,0,0]=4 888 B13R0.1170 CCCCOCC(=O)NCC(O)CO 34a_100000210227_200012027429 [1,0,0,0,0,0|2,0,0]=3 889 B13R0.1170 CCCCOCC(=O)NCC(O)CO 7a_100000210227_200012027429 [1,0,0,0,0,0|2,0,0]=3 890 B13R0.1170 CCCCOCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000757543 [1,0,0,0,0,0|3,0,0]=4 891 B13R0.1170 CCCCOCC(=O)NC[C@@H](F)CO 527a_100015665980_100000757543 [1,0,0,0,0,0|3,0,0]=4 892 B13R0.1170 CCCCOCC(=O)NC[C@H](O)CO 240690a_100020644852_100000757543 [1,0,0,0,0,0|2,0,0]=3 893 B13R0.1170 CCCCOCC(=O)NC[C@H](O)CO 527a_100020644852_100000757543 [1,0,0,0,0,0|2,0,0]=3 894 B13R0.1170 CCCCOCC(C)OCC(O)CO 34a_100011217071_100011219619 [1,0,0,0,0,0|2,0,1]=4 895 B13R0.1170 CCCCOCC(C)OCC(O)CO 7a_100011217071_100011219619 [1,0,0,0,0,0|2,0,1]=4 896 B13R0.1170 CCCCOCC(C)OC[C@@H](O)CO 34a_100011217071_100009815848 [1,0,0,0,0,0|2,0,1]=4 897 B13R0.1170 CCCCOCC(C)OC[C@@H](O)CO 7a_100011217071_100009815848 [1,0,0,0,0,0|2,0,1]=4 898 B13R0.1170 CCCCSCC(=O)NCC(C)CO 240690a_100000744482_100000191162 [1,0,0,0,0,0|3,0,0]=4 899 B13R0.1170 CCCCSCC(=O)NCC(C)CO 527a_100000744482_100000191162 [1,0,0,0,0,0|3,0,0]=4 900 B13R0.1170 CCCCSCC(=O)NCC(O)CC 11a_100011218483_100000191162 [1,0,0,0,0,0|3,0,0]=4 901 B13R0.1170 CCCCSCC(=O)NCC(O)CC 240690a_100011218483_100000191162 [1,0,0,0,0,0|3,0,0]=4 902 B13R0.1170 CCCCSCC(=O)NCC(O)CC 527a_100011218483_100000191162 [1,0,0,0,0,0|3,0,0]=4 903 B13R0.1170 CCCCSCC(=O)NCC(O)CO 62a_100000210211_200012027429 [1,0,0,0,0,0|2,0,0]=3 904 B13R0.1170 CCCCSCC(=O)NCC(O)CO 62a_200012027429_100000210210 [1,0,0,0,0,0|2,0,0]=3 905 B13R0.1170 CCCCSCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000191162 [1,0,0,0,0,0|3,0,0]=4 906 B13R0.1170 CCCCSCC(=O)NC[C@@H](F)CO 527a_100015665980_100000191162 [1,0,0,0,0,0|3,0,0]=4 907 B13R0.1170 CCCCSCC(=O)NC[C@H](O)CO 240690a_100020644852_100000191162 [1,0,0,0,0,0|2,0,0]=3 908 B13R0.1170 CCCCSCC(=O)NC[C@H](O)CO 527a_100020644852_100000191162 [1,0,0,0,0,0|2,0,0]=3 909 B13R0.1170 CCOCCNC(=O)NC[C@H](O)CO 2708a_100011200944_100020644852 [1,0,0,0,0,0|3,0,0]=4 910 B13R0.1170 CCOCCNC(=O)NC[C@H](O)CO 273464a_100020644852_102516460346 [1,0,0,0,0,0|3,0,0]=4 911 B13R0.1170 CCOCCNC(=O)NC[C@H](O)CO 273464a_102516460346_100020644852 [1,0,0,0,0,0|3,0,0]=4 912 B13R0.1170 CCOCSCC(=O)NCC(O)CO 62a_100000739092_200012027429 [1,0,0,0,0,0|3,0,0]=4 913 B13R0.1170 CCOCSCC(=O)NCC(O)CO 62a_200012027429_100000739092 [1,0,0,0,0,0|3,0,0]=4 914 B13R0.1170 CCSCCNC(=O)NC[C@H](O)CO 2708a_100000106463_100020644852 [1,0,0,0,0,0|3,0,0]=4 915 B13R0.1170 CCSCCNC(=O)NC[C@H](O)CO 273464a_100000106463_100020644852 [1,0,0,0,0,0|3,0,0]=4 916 B13R0.1170 CCSCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000106463 [1,0,0,0,0,0|3,0,0]=4 917 B13R0.1170 COCCCNC(=O)NC[C@H](O)CO 2708a_100150723488_100020644852 [1,0,0,0,0,0|3,0,0]=4 918 B13R0.1170 COCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100150723488 [1,0,0,0,0,0|3,0,0]=4 919 B13R0.1170 COCCCNC(=O)NC[C@H](O)CO 273464a_100150723488_100020644852 [1,0,0,0,0,0|3,0,0]=4 920 B13R0.1170 COCCNCC(=O)NCC(O)CO 2230a_100000209980_200012027429 [1,0,0,0,0,0|3,0,0]=4 921 B13R0.1170 COCCOCC(=O)NCC(O)CO 34a_100000210237_200012027429 [1,0,0,0,0,0|3,0,0]=4 922 B13R0.1170 COCCOCC(=O)NC[C@H](O)CO 240690a_100020644852_100000211095 [1,0,0,0,0,0|3,0,0]=4 923 B13R0.1170 COCCOCC(=O)NC[C@H](O)CO 527a_100020644852_100000211095 [1,0,0,0,0,0|3,0,0]=4 924 B13R0.1170 COCCSCC(=O)NCC(O)CO 62a_100000233755_200012027429 [1,0,0,0,0,0|3,0,0]=4 925 B13R0.1170 COCCSCC(=O)NCC(O)CO 62a_200012027429_100000233755 [1,0,0,0,0,0|3,0,0]=4 926 B13R0.1170 CSCCCNC(=O)NC[C@H](O)CO 2708a_100000749238_100020644852 [1,0,0,0,0,0|3,0,0]=4 927 B13R0.1170 CSCCCNC(=O)NC[C@H](O)CO 273464a_100000749238_100020644852 [1,0,0,0,0,0|3,0,0]=4 928 B13R0.1170 CSCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000749238 [1,0,0,0,0,0|3,0,0]=4 929 B13R0.1170 CSCCNCC(=O)NCC(O)CO 2230a_100020590264_200012027429 [1,0,0,0,0,0|3,0,0]=4 930 B13R0.1170 CSCCOCC(=O)NCC(O)CO 34a_100000230434_200012027429 [1,0,0,0,0,0|3,0,0]=4 931 B13R0.1170 CSCCOCC(=O)NCC(O)CO 7a_100000230434_200012027429 [1,0,0,0,0,0|3,0,0]=4 932 B13R0.1170 CSCCSCC(=O)NCC(O)CO 62a_100000212216_200012027429 [1,0,0,0,0,0|3,0,0]=4 933 B13R0.1170 CSCCSCC(=O)NCC(O)CO 62a_200012027429_100000751147 [1,0,0,0,0,0|3,0,0]=4 934 B13R0.1170 NCCCOCC(=O)NCC(O)CO 34a_100000182051_200012027429 [1,0,0,0,0,0|3,0,0]=4 935 B13R0.1170 O=C(CCCCCO)NC[C@@H](F)CO 240690a_100015665980_100102619762 [1,0,0,0,0,0|3,0,0]=4 936 B13R0.1170 O=C(CCCCCO)NC[C@H](O)CO 240690a_100020644852_100102619762 [1,0,0,0,0,0|2,0,0]=3 937 B13R0.1170 O=C(CCOCCO)NC[C@H](O)CO 240690a_100020644852_100011229844 [1,0,0,0,0,0|3,0,0]=4 938 B13R0.1170 O=C(CNCCCF)NCC(O)CO 2230a_100015189416_200012027429 [1,0,0,0,0,0|3,0,0]=4 939 B13R0.1170 O=C(CNCCCF)NCC(O)CO 34a_100015189416_200012027429 [1,0,0,0,0,0|3,0,0]=4 940 B13R0.1170 O=C(COCCCBr)NCC(O)CO 34a_100011217188_200012027429 [1,0,0,0,0,0|3,0,0]=4 941 B13R0.1170 O=C(COCCCCl)NCC(O)CO 34a_100000230001_200012027429 [1,0,0,0,0,0|3,0,0]=4 942 B13R0.1170 O=C(COCCCF)NCC(O)CO 34a_100000759539_200012027429 [1,0,0,0,0,0|3,0,0]=4 943 B13R0.1170 O=C(CSCCCF)NCC(O)CO 62a_100011934791_200012027429 [1,0,0,0,0,0|3,0,0]=4 944 B13R0.1170 O=C(CSCCCF)NCC(O)CO 62a_200012027429_100011934791 [1,0,0,0,0,0|3,0,0]=4 945 B13R0.1170 O=C(CSCCCO)NCC(O)CO 62a_100011215043_200012027429 [1,0,0,0,0,0|3,0,0]=4 946 B13R0.1170 O=C(CSCCCO)NCC(O)CO 62a_200012027429_100011215043 [1,0,0,0,0,0|3,0,0]=4 947 B15R0.85 C#CCCCCCC(=O)N(C)CC(O)CO 240690a_100011216503_100000694772 [0,1,0,0,0,0|1,0,2]=4 948 B15R0.85 C#CCCCCCC(=O)N(C)CC(O)CO 527a_100011216503_100000694772 [0,1,0,0,0,0|1,0,2]=4 949 B15R0.85 C=CCCCCCC(=O)N(C)CC(O)CO 240690a_100011216503_100011934241 [0,1,0,0,0,0|1,0,2]=4 950 B15R0.85 C=CCCCCCC(=O)N(C)CC(O)CO 527a_100011216503_100011934241 [0,1,0,0,0,0|1,0,2]=4 951 B15R0.85 CCCC/C=C/CC(=O)N(C)CC(O)CO 240690a_100011216503_200016282684 [0,1,0,0,0,0|1,0,2]=4 952 B15R0.85 CCCC/C=C/CC(=O)N(C)CC(O)CO 527a_100011216503_200016282684 [0,1,0,0,0,0|1,0,2]=4 953 B15R0.85 CCCCCC#CC(=O)N(C)CC(O)CO 240690a_100011216503_100011215388 [0,1,0,0,0,0|1,0,2]=4 954 B15R0.85 CCCCCC=CC(=O)N(C)CC(O)CO 240690a_100011216503_100016263427 [0,1,0,0,0,0|1,0,2]=4 955 B15R0.85 CCCCCCCC(=O)N(C)CC(C)CC 11a_100000753921_100000211969 [0,1,0,0,0,0|3,0,0]=4 956 B15R0.85 CCCCCCCC(=O)N(C)CC(C)CC 1626a_100000753921_100000211969 [0,1,0,0,0,0|3,0,0]=4 957 B15R0.85 CCCCCCCC(=O)N(C)CC(C)CC 240690a_100000753921_100000211969 [0,1,0,0,0,0|3,0,0]=4 958 B15R0.85 CCCCCCCC(=O)N(C)CC(C)CC 527a_100000753921_100000211969 [0,1,0,0,0,0|3,0,0]=4 959 B15R0.85 CCCCCCCC(=O)N(C)CC(O)CO 240690a_100011216503_100000211969 [0,1,0,0,0,0|1,0,0]=2 960 B15R0.85 CCCCCCCC(=O)N(C)CC(O)CO 527a_100011216503_100000211969 [0,1,0,0,0,0|1,0,0]=2 961 B15R0.85 CCCCCCCC(C)N(C)CC(O)CO 2230a_100011216503_200011218727 [0,1,0,0,0,0|2,0,1]=4 962 B15R0.85 CCCCCCCC(C)N(C)CC(O)CO 269982a_100011216503_200011218727 [0,1,0,0,0,0|2,0,1]=4 963 B15R0.85 CCCCCCCC(C)N(C)CC(O)CO 270004a_100011216503_100000210596 [0,1,0,0,0,0|2,0,1]=4 964 B15R0.85 CCCCCCNC(=O)N(C)CC(O)CO 2708a_100000210581_100011216503 [0,1,0,0,0,0|2,0,0]=3 965 B15R0.85 CCCOCCNC(=O)N(C)CC(O)CO 2708a_100161115042_100011216503 [0,1,0,0,0,0|3,0,0]=4 966 B15R0.85 CCCSCCNC(=O)N(C)CC(O)CO 2708a_100020603323_100011216503 [0,1,0,0,0,0|3,0,0]=4 967 B15R0.85 CCOCCCNC(=O)N(C)CC(O)CO 2708a_100000210961_100011216503 [0,1,0,0,0,0|3,0,0]=4 968 B15R0.85 CN(CC(O)CO)C(=O)CCCCCCO 240690a_100011216503_100011996774 [0,1,0,0,0,0|2,0,0]=3 969 B15R0.85 COCCCCCC(=O)N(C)CC(O)CO 240690a_100011216503_100011935119 [0,1,0,0,0,0|2,0,0]=3 970 B15R0.85 COCCCCCC(=O)N(C)CC(O)CO 527a_100011216503_100011935119 [0,1,0,0,0,0|2,0,0]=3 971 B15R0.85 COCCOCCC(=O)N(C)CC(O)CO 240690a_100011216503_100000745395 [0,1,0,0,0,0|3,0,0]=4 972 B15R0.85 COCCOCCC(=O)N(C)CC(O)CO 527a_100011216503_100000745395 [0,1,0,0,0,0|3,0,0]=4 973 B15R0.136 C#CCC(=O)COC(=O)CCCCCCC 1458a_100011220946_100009852258 [0,1,0,0,0,0|1,0,2]=4 974 B15R0.136 C#CCCCCCC(=O)NCC(O)COC 240690a_100000756049_100000694772 [0,1,0,0,0,0|1,0,2]=4 975 B15R0.136 C#CCCCCCC(=O)NCC(O)COC 527a_100000756049_100000694772 [0,1,0,0,0,0|1,0,2]=4 976 B15R0.136 C#CCN(C)COC(=O)CCCCCCC 2230a_100000225692_100009852258 [0,1,0,0,0,0|3,0,0]=4 977 B15R0.136 C#CCN(C)COC(=O)CCCCCCC 34a_100000225692_100009852258 [0,1,0,0,0,0|3,0,0]=4 978 B15R0.136 C=CCC(=O)COC(=O)CCCCCCC 1458a_100000210193_100009852258 [0,1,0,0,0,0|1,0,2]=4 979 B15R0.136 C=CCCCCCC(=O)NCC(O)COC 240690a_100000756049_100011934241 [0,1,0,0,0,0|1,0,2]=4 980 B15R0.136 C=CCCCCCC(=O)NCC(O)COC 527a_100000756049_100011934241 [0,1,0,0,0,0|1,0,2]=4 981 B15R0.136 C=CCN(C)COC(=O)CCCCCCC 2230a_100000225617_100009852258 [0,1,0,0,0,0|3,0,0]=4 982 B15R0.136 C=CCN(C)COC(=O)CCCCCCC 269982a_100000225617_100009852258 [0,1,0,0,0,0|3,0,0]=4 983 B15R0.136 CCCC/C=C/CC(=O)NCC(O)COC 240690a_100000756049_200016282684 [0,1,0,0,0,0|1,0,2]=4 984 B15R0.136 CCCC/C=C/CC(=O)NCC(O)COC 527a_100000756049_200016282684 [0,1,0,0,0,0|1,0,2]=4 985 B15R0.136 CCCCCC#CC(=O)NCC(O)COC 240690a_100000756049_100011215388 [0,1,0,0,0,0|1,0,2]=4 986 B15R0.136 CCCCCC=CC(=O)NCC(O)COC 240690a_100000756049_100016263427 [0,1,0,0,0,0|1,0,2]=4 987 B15R0.136 CCCCCCCC(=O)NCC(=O)CCO 1458a_100000691742_100000211926 [0,1,0,0,0,0|1,0,2]=4 988 B15R0.136 CCCCCCCC(=O)NCC(O)COC 240690a_100000756049_100000211969 [0,1,0,0,0,0|1,0,0]=2 989 B15R0.136 CCCCCCCC(=O)NCC(O)COC 527a_100000756049_100000211969 [0,1,0,0,0,0|1,0,0]=2 990 B15R0.136 CCCCCCCC(=O)OCC(=O)CC#N 1458a_100051588842_100009852258 [0,1,0,0,0,0|1,0,2]=4 991 B15R0.136 CCCCCCCC(=O)OCC(=O)CCC 1458a_100000211992_100009852258 [0,1,0,0,0,0|1,0,2]=4 992 B15R0.136 CCCCCCCC(=O)OCC(=O)CCO 1458a_100011216618_100009852258 [0,1,0,0,0,0|0,0,2]=3 993 B15R0.136 CCCCCCCC(=O)OCC(=O)COC 1458a_100000210968_100009852258 [0,1,0,0,0,0|0,0,2]=3 994 B15R0.136 CCCCCCCC(=O)OCC(=O)CSC 1458a_100000184570_100009852258 [0,1,0,0,0,0|0,1,2]=4 995 B15R0.136 CCCCCCCC(=O)OCN(C)CC#N 2230a_100000748184_100009852258 [0,1,0,0,0,0|3,0,0]=4 996 B15R0.136 CCCCCCCC(=O)OCN(C)CCC 2230a_100000747261_100009852258 [0,1,0,0,0,0|3,0,0]=4 997 B15R0.136 CCCCCCCC(=O)OCN(C)CCC 269982a_100000747261_100009852258 [0,1,0,0,0,0|3,0,0]=4 998 B15R0.136 CCCCCCCC(=O)OCN(C)CCO 2230a_100000210263_100009852258 [0,1,0,0,0,0|2,0,0]=3 999 B15R0.136 CCCCCCCC(=O)OCN(C)CCO 269982a_100000210263_100009852258 [0,1,0,0,0,0|2,0,0]=3 1000 B15R0.136 CCCCCCCC(C)NCC(O)COC 2230a_100000756049_200011218727 [0,1,0,0,0,0|2,0,1]=4 1001 B15R0.136 CCCCCCCC(C)NCC(O)COC 270004a_100000756049_100000210596 [0,1,0,0,0,0|2,0,1]=4 1002 B15R0.136 CCCCCCCC(C)NCC(O)COC 34a_100000756049_200011218727 [0,1,0,0,0,0|2,0,1]=4 1003 B15R0.136 CCCCCCCC(C)OCC(N)COC 34a_100000724102_200011218727 [0,1,0,0,0,0|2,0,1]=4 1004 B15R0.136 CCCCCCCC(C)OCC(O)COC 34a_200011215852_100011215053 [0,1,0,0,0,0|1,0,1]=3 1005 B15R0.136 CCCCCCCC(C)OCC(O)COC 7a_200011215852_100011215053 [0,1,0,0,0,0|1,0,1]=3 1006 B15R0.136 CCCCCCCC(C)OC[C@@H](O)CC#N 7a_200011215852_100000001066 [0,1,0,0,0,0|2,0,1]=4 1007 B15R0.136 CCCCCCCC(C)SCC(O)COC 62a_100011215053_200011218727 [0,1,0,0,0,0|1,1,1]=4 1008 B15R0.136 CCCCCCCC(C)SCC(O)COC 62a_200011218727_100011215053 [0,1,0,0,0,0|1,1,1]=4 1009 B15R0.136 CCCCCCNC(=O)NCC(O)COC 2708a_100000210581_100000756049 [0,1,0,0,0,0|2,0,0]=3 1010 B15R0.136 CCCCCCNC(=O)NCC(O)COC 273464a_100000210581_100000756049 [0,1,0,0,0,0|2,0,0]=3 1011 B15R0.136 CCCCCCNC(=O)NCC(O)COC 273464a_100000756049_100000210581 [0,1,0,0,0,0|2,0,0]=3 1012 B15R0.136 CCCCCCNC(=O)NCC(O)COC 512a_100000210581_100000756049 [0,1,0,0,0,0|2,0,0]=3 1013 B15R0.136 CCCCCCNC(=O)NCC(O)COC 512a_100000756049_100000210581 [0,1,0,0,0,0|2,0,0]=3 1014 B15R0.136 CCCCCNNC(=O)NCC(O)COC 273464a_100000756049_100000694160 [0,1,0,0,0,0|3,0,0]=4 1015 B15R0.136 CCCCCNNC(=O)NCC(O)COC 512a_100000694160_100000756049 [0,1,0,0,0,0|3,0,0]=4 1016 B15R0.136 CCCCCNNC(=O)NCC(O)COC 512a_100000756049_100000694160 [0,1,0,0,0,0|3,0,0]=4 1017 B15R0.136 CCCOCCNC(=O)NCC(O)COC 2708a_100161115042_100000756049 [0,1,0,0,0,0|3,0,0]=4 1018 B15R0.136 CCCOCCNC(=O)NCC(O)COC 273464a_100000756049_100161115042 [0,1,0,0,0,0|3,0,0]=4 1019 B15R0.136 CCCOCCNC(=O)NCC(O)COC 273464a_100161115042_100000756049 [0,1,0,0,0,0|3,0,0]=4 1020 B15R0.136 CCCOCCNC(=O)NCC(O)COC 512a_100000756049_100161115042 [0,1,0,0,0,0|3,0,0]=4 1021 B15R0.136 CCCOCCNC(=O)NCC(O)COC 512a_100161115042_100000756049 [0,1,0,0,0,0|3,0,0]=4 1022 B15R0.136 CCCSCCNC(=O)NCC(O)COC 2708a_100020603323_100000756049 [0,1,0,0,0,0|3,0,0]=4 1023 B15R0.136 CCCSCCNC(=O)NCC(O)COC 273464a_100000756049_100020603323 [0,1,0,0,0,0|3,0,0]=4 1024 B15R0.136 CCCSCCNC(=O)NCC(O)COC 273464a_100020603323_100000756049 [0,1,0,0,0,0|3,0,0]=4 1025 B15R0.136 CCCSCCNC(=O)NCC(O)COC 512a_100000756049_100020603323 [0,1,0,0,0,0|3,0,0]=4 1026 B15R0.136 CCCSCCNC(=O)NCC(O)COC 512a_100020603323_100000756049 [0,1,0,0,0,0|3,0,0]=4 1027 B15R0.136 CCOCCCNC(=O)NCC(O)COC 2708a_100000210961_100000756049 [0,1,0,0,0,0|3,0,0]=4 1028 B15R0.136 CCOCCCNC(=O)NCC(O)COC 273464a_100000210961_100000756049 [0,1,0,0,0,0|3,0,0]=4 1029 B15R0.136 CCOCCCNC(=O)NCC(O)COC 273464a_100000756049_100000210961 [0,1,0,0,0,0|3,0,0]=4 1030 B15R0.136 CCOCCCNC(=O)NCC(O)COC 512a_100000210961_100000756049 [0,1,0,0,0,0|3,0,0]=4 1031 B15R0.136 CCOCCCNC(=O)NCC(O)COC 512a_100000756049_100000210961 [0,1,0,0,0,0|3,0,0]=4 1032 B15R0.136 COCC(O)CNC(=O)CCCCCCO 240690a_100000756049_100011996774 [0,1,0,0,0,0|2,0,0]=3 1033 B15R0.136 COCC(O)CNC(=O)NCCCCCO 273464a_100000756049_100000762737 [0,1,0,0,0,0|3,0,0]=4 1034 B15R0.136 COCC(O)CNC(=O)NCCCCCO 273464a_100000762737_100000756049 [0,1,0,0,0,0|3,0,0]=4 1035 B15R0.136 COCC(O)CNC(=O)NCCCCCO 512a_100000756049_100000762737 [0,1,0,0,0,0|3,0,0]=4 1036 B15R0.136 COCC(O)CNC(=O)NCCCCCO 512a_100000762737_100000756049 [0,1,0,0,0,0|3,0,0]=4 1037 B15R0.136 COCCCCCC(=O)NCC(O)COC 240690a_100000756049_100011935119 [0,1,0,0,0,0|2,0,0]=3 1038 B15R0.136 COCCCCCC(=O)NCC(O)COC 527a_100000756049_100011935119 [0,1,0,0,0,0|2,0,0]=3 1039 B15R0.136 COCCOCCC(=O)NCC(O)COC 240690a_100000756049_100000745395 [0,1,0,0,0,0|3,0,0]=4 1040 B15R0.136 COCCOCCC(=O)NCC(O)COC 527a_100000756049_100000745395 [0,1,0,0,0,0|3,0,0]=4 1041 B15R0.323 CC(C)C(O)CNC(=O)CCCCCCO 240690a_100000759067_100011996774 [0,1,0,0,0,0|3,0,0]=4 1042 B15R0.323 CCCCCCCC(=O)NCC(O)C(C)C 11a_100000759067_100000211969 [0,1,0,0,0,0|2,0,0]=3 1043 B15R0.323 CCCCCCCC(=O)NCC(O)C(C)C 240690a_100000759067_100000211969 [0,1,0,0,0,0|2,0,0]=3 1044 B15R0.323 CCCCCCCC(=O)NCC(O)C(C)C 527a_100000759067_100000211969 [0,1,0,0,0,0|2,0,0]=3 1045 B15R0.323 CCCCCCCC(=O)OCC(=O)C(C)C 1458a_100000210198_100009852258 [0,1,0,0,0,0|1,0,2]=4 1046 B15R0.323 CCCCCCCC(=O)OCC(=O)C(C)F 1458a_100000062450_100009852258 [0,1,0,0,0,0|1,0,2]=4 1047 B15R0.323 CCCCCCCC(=O)OCC(=O)C(O)O 1458a_100000233687_100009852258 [0,1,0,0,0,0|0,0,2]=3 1048 B15R0.323 CCCCCCCC(=O)OCC(=O)[C@@H](C)O 1458a_100000717761_100009852258 [0,1,0,0,0,0|0,0,2]=3 1049 B15R0.323 CCCCCCCC(=O)OCC(=O)[C@H](C)O 1458a_217856618621_100009852258 [0,1,0,0,0,0|0,0,2]=3 1050 B15R0.323 CCCCCCCC(=O)OCN(C)C(C)C 269982a_200000211004_100009852258 [0,1,0,0,0,0|3,0,0]=4 1051 B15R0.323 CCCCCCNC(=O)NCC(O)C(C)C 2708a_100000210581_100000759067 [0,1,0,0,0,0|3,0,0]=4 1052 B15R0.323 CCCCCCNC(=O)NCC(O)C(C)C 273464a_100000210581_100000759067 [0,1,0,0,0,0|3,0,0]=4 1053 B15R0.323 CCCCCCNC(=O)NCC(O)C(C)C 273464a_100000759067_100000210581 [0,1,0,0,0,0|3,0,0]=4 1054 B15R0.323 CCCCCCNC(=O)NCC(O)C(C)C 512a_100000210581_100000759067 [0,1,0,0,0,0|3,0,0]=4 1055 B15R0.323 CCCCCCNC(=O)NCC(O)C(C)C 512a_100000759067_100000210581 [0,1,0,0,0,0|3,0,0]=4 1056 B15R0.323 COCCCCCC(=O)NCC(O)C(C)C 11a_100000759067_100011935119 [0,1,0,0,0,0|3,0,0]=4 1057 B15R0.323 COCCCCCC(=O)NCC(O)C(C)C 240690a_100000759067_100011935119 [0,1,0,0,0,0|3,0,0]=4 1058 B15R0.323 COCCCCCC(=O)NCC(O)C(C)C 527a_100000759067_100011935119 [0,1,0,0,0,0|3,0,0]=4 1059 B15R0.959 CC(=O)CCCOCC(=O)NCC(O)CO 34a_100000759063_200012027429 [0,1,0,0,0,0|2,0,1]=4 1060 B15R0.959 CC(=O)CCCOCC(=O)NCC(O)CO 7a_100000759063_200012027429 [0,1,0,0,0,0|2,0,1]=4 1061 B15R0.959 CC(=O)CCCSCC(=O)NCC(O)CO 62a_100011215641_200012027429 [0,1,0,0,0,0|2,0,1]=4 1062 B15R0.959 CC(=O)CCCSCC(=O)NCC(O)CO 62a_200012027429_100011215641 [0,1,0,0,0,0|2,0,1]=4 1063 B15R0.959 CC(C)CCCCCC(=O)NCC(C)CO 240690a_100000744482_100000766313 [0,1,0,0,0,0|2,0,0]=3 1064 B15R0.959 CC(C)CCCCCC(=O)NCC(C)CO 527a_100000744482_100000766313 [0,1,0,0,0,0|2,0,0]=3 1065 B15R0.959 CC(C)CCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000766313 [0,1,0,0,0,0|2,0,0]=3 1066 B15R0.959 CC(C)CCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100000766313 [0,1,0,0,0,0|2,0,0]=3 1067 B15R0.959 CC(C)CCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000766313 [0,1,0,0,0,0|1,0,0]=2 1068 B15R0.959 CC(C)CCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000766313 [0,1,0,0,0,0|1,0,0]=2 1069 B15R0.959 CC(C)CCCNCC(=O)NCC(O)CO 2230a_200000737386_200012027429 [0,1,0,0,0,0|2,0,0]=3 1070 B15R0.959 CC(C)CCCNCC(=O)NCC(O)CO 34a_200000737386_200012027429 [0,1,0,0,0,0|2,0,0]=3 1071 B15R0.959 CC(C)CCCOCC(=O)NCC(O)CO 34a_100000210774_200012027429 [0,1,0,0,0,0|2,0,0]=3 1072 B15R0.959 CC(C)CCCOCC(=O)NCC(O)CO 7a_100000210774_200012027429 [0,1,0,0,0,0|2,0,0]=3 1073 B15R0.959 CC(C)CCCSCC(=O)NCC(O)CO 62a_100011214892_200012027429 [0,1,0,0,0,0|2,0,0]=3 1074 B15R0.959 CC(C)CCCSCC(=O)NCC(O)CO 62a_200012027429_100011214892 [0,1,0,0,0,0|2,0,0]=3 1075 B15R0.959 CC(C)NCCOCC(=O)NCC(O)CO 34a_100000224655_200012027429 [0,1,0,0,0,0|3,0,0]=4 1076 B15R0.959 CC(C)OCCCNC(=O)NC[C@H](O)CO 2708a_100000737246_100020644852 [0,1,0,0,0,0|3,0,0]=4 1077 B15R0.959 CC(C)OCCCNC(=O)NC[C@H](O)CO 273464a_100000737246_100020644852 [0,1,0,0,0,0|3,0,0]=4 1078 B15R0.959 CC(C)OCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000737246 [0,1,0,0,0,0|3,0,0]=4 1079 B15R0.959 CC(C)OCCNCC(=O)NCC(O)CO 2230a_100000701111_200012027429 [0,1,0,0,0,0|3,0,0]=4 1080 B15R0.959 CC(C)OCCNCC(=O)NCC(O)CO 34a_100000701111_200012027429 [0,1,0,0,0,0|3,0,0]=4 1081 B15R0.959 CC(C)OCCOCC(=O)NCC(O)CO 34a_100000211219_200012027429 [0,1,0,0,0,0|3,0,0]=4 1082 B15R0.959 CC(C)OCCOCC(=O)NCC(O)CO 7a_100000211219_200012027429 [0,1,0,0,0,0|3,0,0]=4 1083 B15R0.959 CC(C)OCCSCC(=O)NCC(O)CO 62a_100000211751_200012027429 [0,1,0,0,0,0|3,0,0]=4 1084 B15R0.959 CC(C)OCCSCC(=O)NCC(O)CO 62a_200012027429_100000211751 [0,1,0,0,0,0|3,0,0]=4 1085 B15R0.959 CC(C)SCCNCC(=O)NCC(O)CO 2230a_100000731138_200012027429 [0,1,0,0,0,0|3,0,0]=4 1086 B15R0.959 CC(C)SCCNCC(=O)NCC(O)CO 34a_100000731138_200012027429 [0,1,0,0,0,0|3,0,0]=4 1087 B15R0.959 CC(C)SCCOCC(=O)NCC(O)CO 34a_200011212901_200012027429 [0,1,0,0,0,0|3,0,0]=4 1088 B15R0.959 CC(C)SCCOCC(=O)NCC(O)CO 7a_200011212901_200012027429 [0,1,0,0,0,0|3,0,0]=4 1089 B15R0.959 CC(C)SCCSCC(=O)NCC(O)CO 62a_100000730970_200012027429 [0,1,0,0,0,0|3,0,0]=4 1090 B15R0.959 CC(C)SCCSCC(=O)NCC(O)CO 62a_200012027429_100000730970 [0,1,0,0,0,0|3,0,0]=4 1091 B15R0.959 CC(O)CCCSCC(=O)NCC(O)CO 62a_200000718107_200012027429 [0,1,0,0,0,0|2,0,0]=3 1092 B15R0.959 CC(O)CCCSCC(=O)NCC(O)CO 62a_200012027429_200000718107 [0,1,0,0,0,0|2,0,0]=3 1093 B15R0.959 CCC(C)CCC(=O)CCCCCC(C)C 1458a_100000701222_100000210682 [0,1,0,0,0,0|3,0,0]=4 1094 B15R0.959 CCC(C)CNC(=O)CCCCCC(C)C 11a_100020588543_100000766313 [0,1,0,0,0,0|3,0,0]=4 1095 B15R0.959 CCC(C)CNC(=O)CCCCCC(C)C 1626a_100020588543_100000766313 [0,1,0,0,0,0|3,0,0]=4 1096 B15R0.959 CCC(C)CNC(=O)CCCCCC(C)C 240690a_100020588543_100000766313 [0,1,0,0,0,0|3,0,0]=4 1097 B15R0.959 CCC(C)CNC(=O)CCCCCC(C)C 527a_100020588543_100000766313 [0,1,0,0,0,0|3,0,0]=4 1098 B15R0.959 CCC(O)CNC(=O)CCCCCC(C)C 11a_100011218483_100000766313 [0,1,0,0,0,0|2,0,0]=3 1099 B15R0.959 CCC(O)CNC(=O)CCCCCC(C)C 240690a_100011218483_100000766313 [0,1,0,0,0,0|2,0,0]=3 1100 B15R0.959 CCC(O)CNC(=O)CCCCCC(C)C 527a_100011218483_100000766313 [0,1,0,0,0,0|2,0,0]=3 1101 B15R0.959 CN(C)CCCCNC(=O)NC[C@H](O)CO 2708a_100025707445_100020644852 [0,1,0,0,0,0|3,0,0]=4 1102 B15R0.959 CN(C)CCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100025707445 [0,1,0,0,0,0|3,0,0]=4 1103 B15R0.959 CN(C)CCCCNC(=O)NC[C@H](O)CO 273464a_100025707445_100020644852 [0,1,0,0,0,0|3,0,0]=4 1104 B15R0.959 CN(C)CCCSCC(=O)NCC(O)CO 62a_200012027429_100000757444 [0,1,0,0,0,0|3,0,0]=4 1105 B15R0.959 CS(=O)CCCNCC(=O)NCC(O)CO 2230a_200000753449_200012027429 [0,1,0,0,0,0|3,0,0]=4 1106 B15R0.959 O=C(CCCCC[N+](=O)[O-])NC[C@H](O)CO 240690a_100020644852_100000043470 [0,1,0,0,0,0|3,0,0]=4 1107 B15R0.959 O=C(CCCCC[N+](=O)[O-])NC[C@H](O)CO 527a_100020644852_100000043470 [0,1,0,0,0,0|3,0,0]=4 1108 B15R0.974 CCC(C)CCNCC(=O)NCC(O)CO 2230a_100020591266_200012027429 [0,1,0,0,0,0|2,0,0]=3 1109 B15R0.974 CCC(C)CCOCC(=O)NCC(O)CO 7a_100011215188_200012027429 [0,1,0,0,0,0|2,0,0]=3 1110 B15R0.974 COC(=O)CCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000695723 [0,1,0,0,0,0|2,0,1]=4 1111 B15R0.974 COC(=O)CCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000695723 [0,1,0,0,0,0|2,0,1]=4 1112 B15R0.974 COC(C)CCOCC(=O)NCC(O)CO 7a_100000764861_200012027429 [0,1,0,0,0,0|3,0,0]=4 1113 B15R0.1722 CCC(CNC(=O)CCCCCCO)OC 240690a_100000731041_100011996774 [0,1,0,0,0,0|3,0,0]=4 1114 B15R0.1722 CCC(CNC(=O)CCCCCOC)OC 11a_100000731041_100011935119 [0,1,0,0,0,0|3,0,0]=4 1115 B15R0.1722 CCC(CNC(=O)CCCCCOC)OC 1626a_100000731041_100011935119 [0,1,0,0,0,0|3,0,0]=4 1116 B15R0.1722 CCC(CNC(=O)CCCCCOC)OC 240690a_100000731041_100011935119 [0,1,0,0,0,0|3,0,0]=4 1117 B15R0.1722 CCC(CNC(=O)CCCCCOC)OC 527a_100000731041_100011935119 [0,1,0,0,0,0|3,0,0]=4 1118 B15R0.1722 CCCCCCCC(=O)CCC(OC)OC 1458a_100000211969_100000139399 [0,1,0,0,0,0|3,0,0]=4 1119 B15R0.1722 CCCCCCCC(=O)CCC(OC)OC 1458a_200000082759_100000210614 [0,1,0,0,0,0|3,0,0]=4 1120 B15R0.1722 CCCCCCCC(=O)NCC(CC)CC 11a_100102946423_100000211969 [0,1,0,0,0,0|3,0,0]=4 1121 B15R0.1722 CCCCCCCC(=O)NCC(CC)CC 1626a_100102946423_100000211969 [0,1,0,0,0,0|3,0,0]=4 1122 B15R0.1722 CCCCCCCC(=O)NCC(CC)CC 240690a_100102946423_100000211969 [0,1,0,0,0,0|3,0,0]=4 1123 B15R0.1722 CCCCCCCC(=O)NCC(CC)CC 527a_100102946423_100000211969 [0,1,0,0,0,0|3,0,0]=4 1124 B15R0.1722 CCCCCCCC(=O)NCC(CC)OC 11a_100000731041_100000211969 [0,1,0,0,0,0|2,0,0]=3 1125 B15R0.1722 CCCCCCCC(=O)NCC(CC)OC 1626a_100000731041_100000211969 [0,1,0,0,0,0|2,0,0]=3 1126 B15R0.1722 CCCCCCCC(=O)NCC(CC)OC 240690a_100000731041_100000211969 [0,1,0,0,0,0|2,0,0]=3 1127 B15R0.1722 CCCCCCCC(=O)NCC(CC)OC 527a_100000731041_100000211969 [0,1,0,0,0,0|2,0,0]=3 1128 B15R0.1722 CCCCCCCC(=O)NCC(OC)OC 11a_100000210479_100000211969 [0,1,0,0,0,0|3,0,0]=4 1129 B15R0.1722 CCCCCCCC(=O)NCC(OC)OC 1626a_100000210479_100000211969 [0,1,0,0,0,0|3,0,0]=4 1130 B15R0.1722 CCCCCCCC(=O)NCC(OC)OC 240690a_100000210479_100000211969 [0,1,0,0,0,0|3,0,0]=4 1131 B15R0.1722 CCCCCCCC(=O)NCC(OC)OC 527a_100000210479_100000211969 [0,1,0,0,0,0|3,0,0]=4 1132 B15R0.1722 CCCCCCCC(=O)NN=C(CO)CO 4a_100000181853_100000036256 [0,1,0,0,0,0|2,0,1]=4 1133 B15R0.1722 CCCCCCCC(=O)OCN(CC)CC 2230a_100000724800_100009852258 [0,1,0,0,0,0|3,0,0]=4 1134 B15R0.1722 CCCCCCCC(=O)OCN(CC)CC 269956a_100000042499_100009852258 [0,1,0,0,0,0|3,0,0]=4 1135 B15R0.1722 CCCCCCCC(=O)OCN(CC)CC 269982a_100000724800_100009852258 [0,1,0,0,0,0|3,0,0]=4 1136 B15R0.1722 CCCCCCCC(C)OCC(CC)OC 34a_100011934954_200011218727 [0,1,0,0,0,0|2,0,1]=4 1137 B15R0.1722 CCCCCCCC(C)OCC(CC)OC 7a_100011934954_200011218727 [0,1,0,0,0,0|2,0,1]=4 1138 B15R0.1722 CCCCCCNC(=O)CNC(CO)CO 2230a_100000759517_100000230325 [0,1,0,0,0,0|3,0,0]=4 1139 B15R0.1722 CCCCCCNC(=O)NCC(CC)OC 2708a_100000210581_100000731041 [0,1,0,0,0,0|3,0,0]=4 1140 B15R0.1722 CCCCCCNC(=O)NCC(CC)OC 2708a_100000731041_100000210581 [0,1,0,0,0,0|3,0,0]=4 1141 B15R0.1722 CCCCCCNC(=O)NCC(CC)OC 273464a_100000210581_100000731041 [0,1,0,0,0,0|3,0,0]=4 1142 B15R0.1722 CCCCCCNC(=O)NCC(CC)OC 273464a_100000731041_100000210581 [0,1,0,0,0,0|3,0,0]=4 1143 B15R0.1722 CCCCCCNC(=O)NCC(CC)OC 512a_100000210581_100000731041 [0,1,0,0,0,0|3,0,0]=4 1144 B15R0.1722 CCCCCCNC(=O)NCC(CC)OC 512a_100000731041_100000210581 [0,1,0,0,0,0|3,0,0]=4 1145 B15R0.1957 CCCCCCC(C)C(=O)CCC(C)CC 1458a_100000701222_100011215978 [0,1,0,0,0,0|3,0,0]=4 1146 B15R0.1957 CCCCCCC(O)C(=O)NCC(C)CC 240690a_100020588543_100011215828 [0,1,0,0,0,0|3,0,0]=4 1147 B15R0.1957 CCCCCCC(O)C(=O)NCC(C)CO 240690a_100000744482_100011215828 [0,1,0,0,0,0|2,0,0]=3 1148 B15R0.1957 CCCCCCC(O)C(=O)NCC(O)CC 240690a_100011218483_100011215828 [0,1,0,0,0,0|2,0,0]=3 1149 B15R0.1957 CCCCCCC(O)C(=O)NC[C@@H](F)CO 240690a_100015665980_100011215828 [0,1,0,0,0,0|2,0,0]=3 1150 B15R0.1957 CCCCCCC(O)C(=O)NC[C@H](O)CO 240690a_100020644852_100011215828 [0,1,0,0,0,0|1,0,0]=2 1151 B15R0.1957 CCCCCCN(C)C(=O)CCC(O)CC 1626a_106256046315_203496584001 [0,1,0,0,0,0|3,0,0]=4 1152 B15R0.1957 CCCCCCN(C)C(=O)CCC(O)CC 240690a_106256046315_203496584001 [0,1,0,0,0,0|3,0,0]=4 1153 B15R0.1957 CCCCCCN(C)C(=O)NCC(C)CO 273464a_100000744482_106256046315 [0,1,0,0,0,0|3,0,0]=4 1154 B15R0.1957 CCCCCCN(C)C(=O)NCC(O)CC 273464a_100011218483_106256046315 [0,1,0,0,0,0|3,0,0]=4 1155 B15R0.1957 CCCCCCN(C)C(=O)NC[C@@H](F)CO 273464a_100015665980_106256046315 [0,1,0,0,0,0|3,0,0]=4 1156 B15R0.1957 CCCCCCN(C)C(=O)NC[C@H](O)CO 273464a_100020644852_106256046315 [0,1,0,0,0,0|2,0,0]=3 1157 B15R0.1957 CCOCCOC(C)C(=O)NC[C@H](O)CO 240690a_100020644852_100000743585 [0,1,0,0,0,0|3,0,0]=4 1158 B15R0.1957 CCOCCOC(C)C(=O)NC[C@H](O)CO 527a_100020644852_100000743585 [0,1,0,0,0,0|3,0,0]=4 1159 B15R0.1957 CN(CCCCCO)C(=O)NC[C@H](O)CO 273464a_100020644852_100000722520 [0,1,0,0,0,0|3,0,0]=4 1160 B15R0.2243 C=CC(CCCCCCC)OCC(O)CC 34a_200011934235_100011218378 [0,1,0,0,0,0|2,0,1]=4 1161 B15R0.2243 C=CC(CCCCCCC)OCC(O)CC 7a_200011934235_100011218378 [0,1,0,0,0,0|2,0,1]=4 1162 B15R0.2243 C=CC(CCCCCCC)OCC(O)CO 34a_200011934235_100011219619 [0,1,0,0,0,0|1,0,1]=3 1163 B15R0.2243 C=CC(CCCCCCC)OCC(O)CO 7a_200011934235_100011219619 [0,1,0,0,0,0|1,0,1]=3 1164 B15R0.2243 C=CC(CCCCCCC)OC[C@@H](C)CO 34a_200011934235_100000059175 [0,1,0,0,0,0|2,0,1]=4 1165 B15R0.2243 C=CC(CCCCCCC)OC[C@@H](C)CO 7a_200011934235_100000059175 [0,1,0,0,0,0|2,0,1]=4 1166 B15R0.2243 C=CC(CCCCCCC)OC[C@@H](O)CF 34a_200011934235_100015614560 [0,1,0,0,0,0|2,0,1]=4 1167 B15R0.2243 C=CC(CCCCCCC)OC[C@@H](O)CF 7a_200011934235_100015614560 [0,1,0,0,0,0|2,0,1]=4 1168 B15R0.2243 C=CC(CCCCCCC)OC[C@@H](O)CO 34a_200011934235_100009815848 [0,1,0,0,0,0|1,0,1]=3 1169 B15R0.2243 C=CC(CCCCCCC)OC[C@@H](O)CO 7a_200011934235_100009815848 [0,1,0,0,0,0|1,0,1]=3 1170 B15R0.2243 CCCCCCCC(CC)OCC(O)CC 34a_200011217053_100011218378 [0,1,0,0,0,0|2,0,1]=4 1171 B15R0.2243 CCCCCCCC(CC)OCC(O)CC 7a_200011217053_100011218378 [0,1,0,0,0,0|2,0,1]=4 1172 B15R0.2243 CCCCCCCC(CC)OCC(O)CO 34a_200011217053_100011219619 [0,1,0,0,0,0|1,0,1]=3 1173 B15R0.2243 CCCCCCCC(CC)OCC(O)CO 7a_200011217053_100011219619 [0,1,0,0,0,0|1,0,1]=3 1174 B15R0.2243 CCCCCCCC(CC)OC[C@@H](C)CO 34a_200011217053_100000059175 [0,1,0,0,0,0|2,0,1]=4 1175 B15R0.2243 CCCCCCCC(CC)OC[C@@H](C)CO 7a_200011217053_100000059175 [0,1,0,0,0,0|2,0,1]=4 1176 B15R0.2243 CCCCCCCC(CC)OC[C@@H](O)CF 34a_200011217053_100015614560 [0,1,0,0,0,0|2,0,1]=4 1177 B15R0.2243 CCCCCCCC(CC)OC[C@@H](O)CF 7a_200011217053_100015614560 [0,1,0,0,0,0|2,0,1]=4 1178 B15R0.2243 CCCCCCCC(CC)OC[C@@H](O)CO 34a_200011217053_100009815848 [0,1,0,0,0,0|1,0,1]=3 1179 B15R0.2243 CCCCCCCC(CC)OC[C@@H](O)CO 7a_200011217053_100009815848 [0,1,0,0,0,0|1,0,1]=3 1180 B15R0.2405 C#CCCCCCCC(=O)NCC(C)CO 240690a_100000744482_100000034748 [0,1,0,0,0,0|2,0,1]=4 1181 B15R0.2405 C#CCCCCCCC(=O)NCC(C)CO 527a_100000744482_100000034748 [0,1,0,0,0,0|2,0,1]=4 1182 B15R0.2405 C#CCCCCCCC(=O)NCC(O)CC 11a_100011218483_100000034748 [0,1,0,0,0,0|2,0,1]=4 1183 B15R0.2405 C#CCCCCCCC(=O)NCC(O)CC 240690a_100011218483_100000034748 [0,1,0,0,0,0|2,0,1]=4 1184 B15R0.2405 C#CCCCCCCC(=O)NCC(O)CC 527a_100011218483_100000034748 [0,1,0,0,0,0|2,0,1]=4 1185 B15R0.2405 C#CCCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000034748 [0,1,0,0,0,0|2,0,1]=4 1186 B15R0.2405 C#CCCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100000034748 [0,1,0,0,0,0|2,0,1]=4 1187 B15R0.2405 C#CCCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000034748 [0,1,0,0,0,0|1,0,1]=3 1188 B15R0.2405 C#CCCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000034748 [0,1,0,0,0,0|1,0,1]=3 1189 B15R0.2405 C#CCCCCNCC(=O)NCC(O)CO 2230a_100000706060_200012027429 [0,1,0,0,0,0|1,0,2]=4 1190 B15R0.2405 C#CCCCCNCC(=O)NCC(O)CO 34a_100000706060_200012027429 [0,1,0,0,0,0|1,0,2]=4 1191 B15R0.2405 C#CCCCCOCC(=O)NCC(O)CO 34a_100000766709_200012027429 [0,1,0,0,0,0|1,0,2]=4 1192 B15R0.2405 C#CCCCCOCC(=O)NCC(O)CO 7a_100000766709_200012027429 [0,1,0,0,0,0|1,0,2]=4 1193 B15R0.2405 C#CCCCCSCC(=O)NCC(O)CO 62a_100010269958_200012027429 [0,1,0,0,0,0|1,0,2]=4 1194 B15R0.2405 C#CCCCCSCC(=O)NCC(O)CO 62a_200012027429_100010269958 [0,1,0,0,0,0|1,0,2]=4 1195 B15R0.2405 C=CCCCCCCC(=O)NCC(C)CO 240690a_100000744482_100011809334 [0,1,0,0,0,0|2,0,1]=4 1196 B15R0.2405 C=CCCCCCCC(=O)NCC(C)CO 527a_100000744482_100011809334 [0,1,0,0,0,0|2,0,1]=4 1197 B15R0.2405 C=CCCCCCCC(=O)NCC(O)CC 11a_100011218483_100011809334 [0,1,0,0,0,0|2,0,1]=4 1198 B15R0.2405 C=CCCCCCCC(=O)NCC(O)CC 240690a_100011218483_100011809334 [0,1,0,0,0,0|2,0,1]=4 1199 B15R0.2405 C=CCCCCCCC(=O)NCC(O)CC 527a_100011218483_100011809334 [0,1,0,0,0,0|2,0,1]=4 1200 B15R0.2405 C=CCCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100011809334 [0,1,0,0,0,0|2,0,1]=4 1201 B15R0.2405 C=CCCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100011809334 [0,1,0,0,0,0|2,0,1]=4 1202 B15R0.2405 C=CCCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100011809334 [0,1,0,0,0,0|1,0,1]=3 1203 B15R0.2405 C=CCCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100011809334 [0,1,0,0,0,0|1,0,1]=3 1204 B15R0.2405 C=CCCCCNCC(=O)NCC(O)CO 2230a_100000703577_200012027429 [0,1,0,0,0,0|1,0,2]=4 1205 B15R0.2405 C=CCCCCNCC(=O)NCC(O)CO 34a_100000703577_200012027429 [0,1,0,0,0,0|1,0,2]=4 1206 B15R0.2405 C=CCCCCOCC(=O)NCC(O)CO 34a_100000766645_200012027429 [0,1,0,0,0,0|1,0,2]=4 1207 B15R0.2405 C=CCCCCOCC(=O)NCC(O)CO 7a_100000766645_200012027429 [0,1,0,0,0,0|1,0,2]=4 1208 B15R0.2405 C=CCCCCSCC(=O)NCC(O)CO 62a_100011215482_200012027429 [0,1,0,0,0,0|1,0,2]=4 1209 B15R0.2405 C=CCCCCSCC(=O)NCC(O)CO 62a_200012027429_100011215482 [0,1,0,0,0,0|1,0,2]=4 1210 B15R0.2405 CC(CO)CNC(=O)CCCCCCCO 240690a_100000744482_100011219782 [0,1,0,0,0,0|2,0,0]=3 1211 B15R0.2405 CC(CO)CNC(=O)NCCCCCCO 273464a_100000686447_100000744482 [0,1,0,0,0,0|3,0,0]=4 1212 B15R0.2405 CC(CO)CNC(=O)NCCCCCCO 273464a_100000744482_100000686447 [0,1,0,0,0,0|3,0,0]=4 1213 B15R0.2405 CC(CO)CNC(=O)NCCCCCCO 512a_100000686447_100000744482 [0,1,0,0,0,0|3,0,0]=4 1214 B15R0.2405 CC(CO)CNC(=O)NCCCCCCO 512a_100000744482_100000686447 [0,1,0,0,0,0|3,0,0]=4 1215 B15R0.2405 CC/C=C\CCOCC(=O)NCC(O)CO 34a_100016288707_200012027429 [0,1,0,0,0,0|1,0,2]=4 1216 B15R0.2405 CC/C=C\CCOCC(=O)NCC(O)CO 7a_100016288707_200012027429 [0,1,0,0,0,0|1,0,2]=4 1217 B15R0.2405 CC/C=C\CCSCC(=O)NCC(O)CO 62a_100015370543_200012027429 [0,1,0,0,0,0|1,0,2]=4 1218 B15R0.2405 CC/C=C\CCSCC(=O)NCC(O)CO 62a_200012027429_100015370543 [0,1,0,0,0,0|1,0,2]=4 1219 B15R0.2405 CC=CCCCOCC(=O)NCC(O)CO 34a_100020645299_200012027429 [0,1,0,0,0,0|1,0,2]=4 1220 B15R0.2405 CCC#CCCOCC(=O)NCC(O)CO 34a_100000036655_200012027429 [0,1,0,0,0,0|1,0,2]=4 1221 B15R0.2405 CCC#CCCOCC(=O)NCC(O)CO 7a_100000036655_200012027429 [0,1,0,0,0,0|1,0,2]=4 1222 B15R0.2405 CCC(C)CCC(=O)CCCCCCCO 1458a_100000701222_100000760002 [0,1,0,0,0,0|3,0,0]=4 1223 B15R0.2405 CCC(C)CCC(=O)CCCCCCOC 1458a_100000701222_100011998445 [0,1,0,0,0,0|3,0,0]=4 1224 B15R0.2405 CCC(C)CNC(=O)CCCCCCCO 240690a_100020588543_100011219782 [0,1,0,0,0,0|3,0,0]=4 1225 B15R0.2405 CCC(O)CCC(=O)NCCCCCCO 240690a_100000686447_203496584001 [0,1,0,0,0,0|3,0,0]=4 1226 B15R0.2405 CCC(O)CCC(=O)NCCCCCOC 1626a_100000747528_203496584001 [0,1,0,0,0,0|3,0,0]=4 1227 B15R0.2405 CCC(O)CCC(=O)NCCCCCOC 240690a_100000747528_203496584001 [0,1,0,0,0,0|3,0,0]=4 1228 B15R0.2405 CCC(O)CNC(=O)CCCCCCCO 240690a_100011218483_100011219782 [0,1,0,0,0,0|2,0,0]=3 1229 B15R0.2405 CCC(O)CNC(=O)NCCCCCCO 273464a_100000686447_100011218483 [0,1,0,0,0,0|3,0,0]=4 1230 B15R0.2405 CCC(O)CNC(=O)NCCCCCCO 273464a_100011218483_100000686447 [0,1,0,0,0,0|3,0,0]=4 1231 B15R0.2405 CCC(O)CNC(=O)NCCCCCCO 512a_100011218483_100000686447 [0,1,0,0,0,0|3,0,0]=4 1232 B15R0.2405 CCC(O)CNC(=O)NCCCCCOC 2708a_100000747528_100011218483 [0,1,0,0,0,0|3,0,0]=4 1233 B15R0.2405 CCC(O)CNC(=O)NCCCCCOC 273464a_100000747528_100011218483 [0,1,0,0,0,0|3,0,0]=4 1234 B15R0.2405 CCC(O)CNC(=O)NCCCCCOC 273464a_100011218483_100000747528 [0,1,0,0,0,0|3,0,0]=4 1235 B15R0.2405 CCC(O)CNC(=O)NCCCCCOC 512a_100011218483_100000747528 [0,1,0,0,0,0|3,0,0]=4 1236 B15R0.2405 CCC/C=C/COCC(=O)NCC(O)CO 34a_100016278788_200012027429 [0,1,0,0,0,0|1,0,2]=4 1237 B15R0.2405 CCC/C=C/COCC(=O)NCC(O)CO 7a_100016278788_200012027429 [0,1,0,0,0,0|1,0,2]=4 1238 B15R0.2405 CCCC#CCOCC(=O)NCC(O)CO 34a_100000034806_200012027429 [0,1,0,0,0,0|1,0,2]=4 1239 B15R0.2405 CCCC#CCOCC(=O)NCC(O)CO 7a_100000034806_200012027429 [0,1,0,0,0,0|1,0,2]=4 1240 B15R0.2405 CCCCC/C=C/CC(=O)NCC(C)CO 240690a_100000744482_100020675968 [0,1,0,0,0,0|2,0,1]=4 1241 B15R0.2405 CCCCC/C=C/CC(=O)NCC(O)CC 11a_100011218483_100020675968 [0,1,0,0,0,0|2,0,1]=4 1242 B15R0.2405 CCCCC/C=C/CC(=O)NCC(O)CC 240690a_100011218483_100020675968 [0,1,0,0,0,0|2,0,1]=4 1243 B15R0.2405 CCCCC/C=C/CC(=O)NC[C@@H](F)CO 240690a_100015665980_100020675968 [0,1,0,0,0,0|2,0,1]=4 1244 B15R0.2405 CCCCC/C=C/CC(=O)NC[C@H](O)CO 240690a_100020644852_100020675968 [0,1,0,0,0,0|1,0,1]=3 1245 B15R0.2405 CCCCCCC=CC(=O)NCC(C)CO 240690a_100000744482_200015324643 [0,1,0,0,0,0|2,0,1]=4 1246 B15R0.2405 CCCCCCC=CC(=O)NCC(O)CC 11a_100011218483_200015324643 [0,1,0,0,0,0|2,0,1]=4 1247 B15R0.2405 CCCCCCC=CC(=O)NCC(O)CC 240690a_100011218483_200015324643 [0,1,0,0,0,0|2,0,1]=4 1248 B15R0.2405 CCCCCCC=CC(=O)NC[C@@H](F)CO 240690a_100015665980_200015324643 [0,1,0,0,0,0|2,0,1]=4 1249 B15R0.2405 CCCCCCC=CC(=O)NC[C@H](O)CO 240690a_100020644852_200015324643 [0,1,0,0,0,0|1,0,1]=3 1250 B15R0.2405 CCCCCCCCC(=O)NCC(C)CC 11a_100020588543_100000210188 [0,1,0,0,0,0|3,0,0]=4 1251 B15R0.2405 CCCCCCCCC(=O)NCC(C)CC 1626a_100020588543_100000210188 [0,1,0,0,0,0|3,0,0]=4 1252 B15R0.2405 CCCCCCCCC(=O)NCC(C)CC 240690a_100020588543_100000210188 [0,1,0,0,0,0|3,0,0]=4 1253 B15R0.2405 CCCCCCCCC(=O)NCC(C)CC 527a_100020588543_100000210188 [0,1,0,0,0,0|3,0,0]=4 1254 B15R0.2405 CCCCCCCCC(=O)NCC(C)CO 240690a_100000744482_100000210188 [0,1,0,0,0,0|2,0,0]=3 1255 B15R0.2405 CCCCCCCCC(=O)NCC(C)CO 527a_100000744482_100000210188 [0,1,0,0,0,0|2,0,0]=3 1256 B15R0.2405 CCCCCCCCC(=O)NCC(O)CC 11a_100011218483_100000210188 [0,1,0,0,0,0|2,0,0]=3 1257 B15R0.2405 CCCCCCCCC(=O)NCC(O)CC 240690a_100011218483_100000210188 [0,1,0,0,0,0|2,0,0]=3 1258 B15R0.2405 CCCCCCCCC(=O)NCC(O)CC 527a_100011218483_100000210188 [0,1,0,0,0,0|2,0,0]=3 1259 B15R0.2405 CCCCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000210188 [0,1,0,0,0,0|2,0,0]=3 1260 B15R0.2405 CCCCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100000210188 [0,1,0,0,0,0|2,0,0]=3 1261 B15R0.2405 CCCCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000210188 [0,1,0,0,0,0|1,0,0]=2 1262 B15R0.2405 CCCCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000210188 [0,1,0,0,0,0|1,0,0]=2 1263 B15R0.2405 CCCCCCCCC(C)OCC(O)CC 34a_100000210740_100011218378 [0,1,0,0,0,0|2,0,1]=4 1264 B15R0.2405 CCCCCCCCC(C)OCC(O)CC 7a_100000210740_100011218378 [0,1,0,0,0,0|2,0,1]=4 1265 B15R0.2405 CCCCCCCCC(C)OCC(O)CO 34a_100000210740_100011219619 [0,1,0,0,0,0|1,0,1]=3 1266 B15R0.2405 CCCCCCCCC(C)OCC(O)CO 7a_100000210740_100011219619 [0,1,0,0,0,0|1,0,1]=3 1267 B15R0.2405 CCCCCCCCC(C)OC[C@@H](C)CO 34a_100000210740_100000059175 [0,1,0,0,0,0|2,0,1]=4 1268 B15R0.2405 CCCCCCCCC(C)OC[C@@H](C)CO 7a_100000210740_100000059175 [0,1,0,0,0,0|2,0,1]=4 1269 B15R0.2405 CCCCCCCCC(C)OC[C@@H](O)CF 34a_100000210740_100015614560 [0,1,0,0,0,0|2,0,1]=4 1270 B15R0.2405 CCCCCCCCC(C)OC[C@@H](O)CF 7a_100000210740_100015614560 [0,1,0,0,0,0|2,0,1]=4 1271 B15R0.2405 CCCCCCCCC(C)OC[C@@H](O)CO 34a_100000210740_100009815848 [0,1,0,0,0,0|1,0,1]=3 1272 B15R0.2405 CCCCCCCCC(C)OC[C@@H](O)CO 7a_100000210740_100009815848 [0,1,0,0,0,0|1,0,1]=3 1273 B15R0.2405 CCCCCCCNC(=O)CCC(C)CC 11a_100000229938_100000701222 [0,1,0,0,0,0|3,0,0]=4 1274 B15R0.2405 CCCCCCCNC(=O)CCC(C)CC 1626a_100000229938_100000701222 [0,1,0,0,0,0|3,0,0]=4 1275 B15R0.2405 CCCCCCCNC(=O)CCC(C)CC 240690a_100000229938_100000701222 [0,1,0,0,0,0|3,0,0]=4 1276 B15R0.2405 CCCCCCCNC(=O)CCC(C)CC 527a_100000229938_100000701222 [0,1,0,0,0,0|3,0,0]=4 1277 B15R0.2405 CCCCCCCNC(=O)CCC(O)CC 1626a_100000229938_203496584001 [0,1,0,0,0,0|2,0,0]=3 1278 B15R0.2405 CCCCCCCNC(=O)CCC(O)CC 240690a_100000229938_203496584001 [0,1,0,0,0,0|2,0,0]=3 1279 B15R0.2405 CCCCCCCNC(=O)NCC(C)CC 2708a_100000229938_100020588543 [0,1,0,0,0,0|3,0,0]=4 1280 B15R0.2405 CCCCCCCNC(=O)NCC(C)CC 2708a_100020588543_100000229938 [0,1,0,0,0,0|3,0,0]=4 1281 B15R0.2405 CCCCCCCNC(=O)NCC(C)CC 273464a_100000229938_100020588543 [0,1,0,0,0,0|3,0,0]=4 1282 B15R0.2405 CCCCCCCNC(=O)NCC(C)CC 273464a_100020588543_100000229938 [0,1,0,0,0,0|3,0,0]=4 1283 B15R0.2405 CCCCCCCNC(=O)NCC(C)CC 512a_100000229938_100020588543 [0,1,0,0,0,0|3,0,0]=4 1284 B15R0.2405 CCCCCCCNC(=O)NCC(C)CC 512a_100020588543_100000229938 [0,1,0,0,0,0|3,0,0]=4 1285 B15R0.2405 CCCCCCCNC(=O)NCC(C)CO 2708a_100000229938_100000744482 [0,1,0,0,0,0|2,0,0]=3 1286 B15R0.2405 CCCCCCCNC(=O)NCC(C)CO 273464a_100000229938_100000744482 [0,1,0,0,0,0|2,0,0]=3 1287 B15R0.2405 CCCCCCCNC(=O)NCC(C)CO 273464a_100000744482_100000229938 [0,1,0,0,0,0|2,0,0]=3 1288 B15R0.2405 CCCCCCCNC(=O)NCC(C)CO 512a_100000229938_100000744482 [0,1,0,0,0,0|2,0,0]=3 1289 B15R0.2405 CCCCCCCNC(=O)NCC(C)CO 512a_100000744482_100000229938 [0,1,0,0,0,0|2,0,0]=3 1290 B15R0.2405 CCCCCCCNC(=O)NCC(O)CC 2708a_100000229938_100011218483 [0,1,0,0,0,0|2,0,0]=3 1291 B15R0.2405 CCCCCCCNC(=O)NCC(O)CC 273464a_100000229938_100011218483 [0,1,0,0,0,0|2,0,0]=3 1292 B15R0.2405 CCCCCCCNC(=O)NCC(O)CC 273464a_100011218483_100000229938 [0,1,0,0,0,0|2,0,0]=3 1293 B15R0.2405 CCCCCCCNC(=O)NCC(O)CC 512a_100011218483_100000229938 [0,1,0,0,0,0|2,0,0]=3 1294 B15R0.2405 CCCCCCCNC(=O)NC[C@@H](F)CO 2708a_100000229938_100015665980 [0,1,0,0,0,0|2,0,0]=3 1295 B15R0.2405 CCCCCCCNC(=O)NC[C@@H](F)CO 273464a_100000229938_100015665980 [0,1,0,0,0,0|2,0,0]=3 1296 B15R0.2405 CCCCCCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_100000229938 [0,1,0,0,0,0|2,0,0]=3 1297 B15R0.2405 CCCCCCCNC(=O)NC[C@@H](F)CO 512a_100000229938_100015665980 [0,1,0,0,0,0|2,0,0]=3 1298 B15R0.2405 CCCCCCCNC(=O)NC[C@@H](F)CO 512a_100015665980_100000229938 [0,1,0,0,0,0|2,0,0]=3 1299 B15R0.2405 CCCCCCCNC(=O)NC[C@H](O)CO 2708a_100000229938_100020644852 [0,1,0,0,0,0|1,0,0]=2 1300 B15R0.2405 CCCCCCCNC(=O)NC[C@H](O)CO 273464a_100000229938_100020644852 [0,1,0,0,0,0|1,0,0]=2 1301 B15R0.2405 CCCCCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000229938 [0,1,0,0,0,0|1,0,0]=2 1302 B15R0.2405 CCCCCCNCC(=O)NCC(O)CO 2230a_100000210581_200012027429 [0,1,0,0,0,0|1,0,0]=2 1303 B15R0.2405 CCCCCCOCC(=O)NCC(O)CO 34a_100000210259_200012027429 [0,1,0,0,0,0|1,0,0]=2 1304 B15R0.2405 CCCCCCOCC(=O)NCC(O)CO 7a_100000210259_200012027429 [0,1,0,0,0,0|1,0,0]=2 1305 B15R0.2405 CCCCCCSCC(=O)NCC(O)CO 62a_100000210314_200012027429 [0,1,0,0,0,0|1,0,0]=2 1306 B15R0.2405 CCCCCCSCC(=O)NCC(O)CO 62a_200012027429_100000210757 [0,1,0,0,0,0|1,0,0]=2 1307 B15R0.2405 CCCCOCSCC(=O)NCC(O)CO 62a_100011995733_200012027429 [0,1,0,0,0,0|2,0,0]=3 1308 B15R0.2405 CCCCOCSCC(=O)NCC(O)CO 62a_200012027429_100011995733 [0,1,0,0,0,0|2,0,0]=3 1309 B15R0.2405 CCCCSCCNC(=O)CCC(O)CC 1626a_100025743550_203496584001 [0,1,0,0,0,0|3,0,0]=4 1310 B15R0.2405 CCCCSCCNC(=O)CCC(O)CC 240690a_100025743550_203496584001 [0,1,0,0,0,0|3,0,0]=4 1311 B15R0.2405 CCCCSCCNC(=O)NCC(C)CO 2708a_100025743550_100000744482 [0,1,0,0,0,0|3,0,0]=4 1312 B15R0.2405 CCCCSCCNC(=O)NCC(C)CO 273464a_100000744482_100025743550 [0,1,0,0,0,0|3,0,0]=4 1313 B15R0.2405 CCCCSCCNC(=O)NCC(C)CO 273464a_100025743550_100000744482 [0,1,0,0,0,0|3,0,0]=4 1314 B15R0.2405 CCCCSCCNC(=O)NCC(C)CO 512a_100000744482_100025743550 [0,1,0,0,0,0|3,0,0]=4 1315 B15R0.2405 CCCCSCCNC(=O)NCC(C)CO 512a_100025743550_100000744482 [0,1,0,0,0,0|3,0,0]=4 1316 B15R0.2405 CCCCSCCNC(=O)NCC(O)CC 2708a_100025743550_100011218483 [0,1,0,0,0,0|3,0,0]=4 1317 B15R0.2405 CCCCSCCNC(=O)NCC(O)CC 273464a_100011218483_100025743550 [0,1,0,0,0,0|3,0,0]=4 1318 B15R0.2405 CCCCSCCNC(=O)NCC(O)CC 273464a_100025743550_100011218483 [0,1,0,0,0,0|3,0,0]=4 1319 B15R0.2405 CCCCSCCNC(=O)NCC(O)CC 512a_100011218483_100025743550 [0,1,0,0,0,0|3,0,0]=4 1320 B15R0.2405 CCCCSCCNC(=O)NC[C@@H](F)CO 2708a_100025743550_100015665980 [0,1,0,0,0,0|3,0,0]=4 1321 B15R0.2405 CCCCSCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_100025743550 [0,1,0,0,0,0|3,0,0]=4 1322 B15R0.2405 CCCCSCCNC(=O)NC[C@@H](F)CO 273464a_100025743550_100015665980 [0,1,0,0,0,0|3,0,0]=4 1323 B15R0.2405 CCCCSCCNC(=O)NC[C@@H](F)CO 512a_100015665980_100025743550 [0,1,0,0,0,0|3,0,0]=4 1324 B15R0.2405 CCCCSCCNC(=O)NC[C@@H](F)CO 512a_100025743550_100015665980 [0,1,0,0,0,0|3,0,0]=4 1325 B15R0.2405 CCCCSCCNC(=O)NC[C@H](O)CO 2708a_100025743550_100020644852 [0,1,0,0,0,0|2,0,0]=3 1326 B15R0.2405 CCCCSCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100025743550 [0,1,0,0,0,0|2,0,0]=3 1327 B15R0.2405 CCCCSCCNC(=O)NC[C@H](O)CO 273464a_100025743550_100020644852 [0,1,0,0,0,0|2,0,0]=3 1328 B15R0.2405 CCCOCCCNC(=O)CCC(O)CC 1626a_100011217757_203496584001 [0,1,0,0,0,0|3,0,0]=4 1329 B15R0.2405 CCCOCCCNC(=O)CCC(O)CC 240690a_100011217757_203496584001 [0,1,0,0,0,0|3,0,0]=4 1330 B15R0.2405 CCCOCCCNC(=O)NCC(C)CO 2708a_100011217757_100000744482 [0,1,0,0,0,0|3,0,0]=4 1331 B15R0.2405 CCCOCCCNC(=O)NCC(C)CO 273464a_100000744482_100011217757 [0,1,0,0,0,0|3,0,0]=4 1332 B15R0.2405 CCCOCCCNC(=O)NCC(C)CO 273464a_100011217757_100000744482 [0,1,0,0,0,0|3,0,0]=4 1333 B15R0.2405 CCCOCCCNC(=O)NCC(C)CO 512a_100000744482_100011217757 [0,1,0,0,0,0|3,0,0]=4 1334 B15R0.2405 CCCOCCCNC(=O)NCC(C)CO 512a_100011217757_100000744482 [0,1,0,0,0,0|3,0,0]=4 1335 B15R0.2405 CCCOCCCNC(=O)NCC(O)CC 2708a_100011217757_100011218483 [0,1,0,0,0,0|3,0,0]=4 1336 B15R0.2405 CCCOCCCNC(=O)NCC(O)CC 273464a_100011217757_100011218483 [0,1,0,0,0,0|3,0,0]=4 1337 B15R0.2405 CCCOCCCNC(=O)NCC(O)CC 273464a_100011218483_100011217757 [0,1,0,0,0,0|3,0,0]=4 1338 B15R0.2405 CCCOCCCNC(=O)NCC(O)CC 512a_100011218483_100011217757 [0,1,0,0,0,0|3,0,0]=4 1339 B15R0.2405 CCCOCCCNC(=O)NC[C@@H](F)CO 2708a_100011217757_100015665980 [0,1,0,0,0,0|3,0,0]=4 1340 B15R0.2405 CCCOCCCNC(=O)NC[C@@H](F)CO 273464a_100011217757_100015665980 [0,1,0,0,0,0|3,0,0]=4 1341 B15R0.2405 CCCOCCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_100011217757 [0,1,0,0,0,0|3,0,0]=4 1342 B15R0.2405 CCCOCCCNC(=O)NC[C@@H](F)CO 512a_100011217757_100015665980 [0,1,0,0,0,0|3,0,0]=4 1343 B15R0.2405 CCCOCCCNC(=O)NC[C@@H](F)CO 512a_100015665980_100011217757 [0,1,0,0,0,0|3,0,0]=4 1344 B15R0.2405 CCCOCCCNC(=O)NC[C@H](O)CO 2708a_100011217757_100020644852 [0,1,0,0,0,0|2,0,0]=3 1345 B15R0.2405 CCCOCCCNC(=O)NC[C@H](O)CO 273464a_100011217757_100020644852 [0,1,0,0,0,0|2,0,0]=3 1346 B15R0.2405 CCCOCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100011217757 [0,1,0,0,0,0|2,0,0]=3 1347 B15R0.2405 CCCOCCNCC(=O)NCC(O)CO 2230a_100161115042_200012027429 [0,1,0,0,0,0|2,0,0]=3 1348 B15R0.2405 CCCOCCNCC(=O)NCC(O)CO 34a_100161115042_200012027429 [0,1,0,0,0,0|2,0,0]=3 1349 B15R0.2405 CCCOCCOCC(=O)NCC(O)CO 34a_100000752267_200012027429 [0,1,0,0,0,0|2,0,0]=3 1350 B15R0.2405 CCCOCCOCC(=O)NCC(O)CO 7a_100000752267_200012027429 [0,1,0,0,0,0|2,0,0]=3 1351 B15R0.2405 CCCOCCSCC(=O)NCC(O)CO 62a_100011215938_200012027429 [0,1,0,0,0,0|2,0,0]=3 1352 B15R0.2405 CCCOCCSCC(=O)NCC(O)CO 62a_200012027429_100011215938 [0,1,0,0,0,0|2,0,0]=3 1353 B15R0.2405 CCCSCCNCC(=O)NCC(O)CO 2230a_100020603323_200012027429 [0,1,0,0,0,0|2,0,0]=3 1354 B15R0.2405 CCCSCCOCC(=O)NCC(O)CO 34a_200000230433_200012027429 [0,1,0,0,0,0|2,0,0]=3 1355 B15R0.2405 CCCSCCOCC(=O)NCC(O)CO 7a_200000230433_200012027429 [0,1,0,0,0,0|2,0,0]=3 1356 B15R0.2405 CCOCCCNCC(=O)NCC(O)CO 2230a_100000210961_200012027429 [0,1,0,0,0,0|2,0,0]=3 1357 B15R0.2405 CCOCCCNCC(=O)NCC(O)CO 34a_100000210961_200012027429 [0,1,0,0,0,0|2,0,0]=3 1358 B15R0.2405 CCOCCCOCC(=O)NCC(O)CO 34a_100000757476_200012027429 [0,1,0,0,0,0|2,0,0]=3 1359 B15R0.2405 CCOCCCOCC(=O)NCC(O)CO 7a_100000757476_200012027429 [0,1,0,0,0,0|2,0,0]=3 1360 B15R0.2405 CCOCCCSCC(=O)NCC(O)CO 62a_100012232248_200012027429 [0,1,0,0,0,0|2,0,0]=3 1361 B15R0.2405 CCOCCCSCC(=O)NCC(O)CO 62a_200012027429_100012232248 [0,1,0,0,0,0|2,0,0]=3 1362 B15R0.2405 CCSCCCOCC(=O)NCC(O)CO 34a_100011216438_200012027429 [0,1,0,0,0,0|2,0,0]=3 1363 B15R0.2405 CCSCCCOCC(=O)NCC(O)CO 7a_100011216438_200012027429 [0,1,0,0,0,0|2,0,0]=3 1364 B15R0.2405 COCCCCCNC(=O)NCC(C)CO 2708a_100000747528_100000744482 [0,1,0,0,0,0|3,0,0]=4 1365 B15R0.2405 COCCCCCNC(=O)NCC(C)CO 273464a_100000744482_100000747528 [0,1,0,0,0,0|3,0,0]=4 1366 B15R0.2405 COCCCCCNC(=O)NCC(C)CO 273464a_100000747528_100000744482 [0,1,0,0,0,0|3,0,0]=4 1367 B15R0.2405 COCCCCCNC(=O)NCC(C)CO 512a_100000744482_100000747528 [0,1,0,0,0,0|3,0,0]=4 1368 B15R0.2405 COCCCCCNC(=O)NCC(C)CO 512a_100000747528_100000744482 [0,1,0,0,0,0|3,0,0]=4 1369 B15R0.2405 COCCCCCNC(=O)NC[C@@H](F)CO 2708a_100000747528_100015665980 [0,1,0,0,0,0|3,0,0]=4 1370 B15R0.2405 COCCCCCNC(=O)NC[C@@H](F)CO 273464a_100000747528_100015665980 [0,1,0,0,0,0|3,0,0]=4 1371 B15R0.2405 COCCCCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_100000747528 [0,1,0,0,0,0|3,0,0]=4 1372 B15R0.2405 COCCCCCNC(=O)NC[C@@H](F)CO 512a_100000747528_100015665980 [0,1,0,0,0,0|3,0,0]=4 1373 B15R0.2405 COCCCCCNC(=O)NC[C@@H](F)CO 512a_100015665980_100000747528 [0,1,0,0,0,0|3,0,0]=4 1374 B15R0.2405 COCCCCCNC(=O)NC[C@H](O)CO 2708a_100000747528_100020644852 [0,1,0,0,0,0|2,0,0]=3 1375 B15R0.2405 COCCCCCNC(=O)NC[C@H](O)CO 273464a_100000747528_100020644852 [0,1,0,0,0,0|2,0,0]=3 1376 B15R0.2405 COCCCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000747528 [0,1,0,0,0,0|2,0,0]=3 1377 B15R0.2405 COCCCCOCC(=O)NCC(O)CO 34a_100000740925_200012027429 [0,1,0,0,0,0|2,0,0]=3 1378 B15R0.2405 COCCCCSCC(=O)NCC(O)CO 62a_100000730899_200012027429 [0,1,0,0,0,0|2,0,0]=3 1379 B15R0.2405 COCCCCSCC(=O)NCC(O)CO 62a_200012027429_100000730899 [0,1,0,0,0,0|2,0,0]=3 1380 B15R0.2405 COCCOCCNC(=O)NC[C@H](O)CO 2708a_100000745349_100020644852 [0,1,0,0,0,0|3,0,0]=4 1381 B15R0.2405 COCCOCCNC(=O)NC[C@H](O)CO 273464a_100000745349_100020644852 [0,1,0,0,0,0|3,0,0]=4 1382 B15R0.2405 COCCOCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000745349 [0,1,0,0,0,0|3,0,0]=4 1383 B15R0.2405 COCCOCSCC(=O)NCC(O)CO 62a_100000231047_200012027429 [0,1,0,0,0,0|3,0,0]=4 1384 B15R0.2405 COCCOCSCC(=O)NCC(O)CO 62a_200012027429_100000231047 [0,1,0,0,0,0|3,0,0]=4 1385 B15R0.2405 CSCCCCOCC(=O)NCC(O)CO 34a_100011217163_200012027429 [0,1,0,0,0,0|2,0,0]=3 1386 B15R0.2405 CSCCCCOCC(=O)NCC(O)CO 7a_100011217163_200012027429 [0,1,0,0,0,0|2,0,0]=3 1387 B15R0.2405 N#CCCCCCNC(=O)NC[C@H](O)CO 2708a_100000061152_100020644852 [0,1,0,0,0,0|2,0,1]=4 1388 B15R0.2405 N#CCCCCCNC(=O)NC[C@H](O)CO 273464a_100000061152_100020644852 [0,1,0,0,0,0|2,0,1]=4 1389 B15R0.2405 N#CCCCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000061152 [0,1,0,0,0,0|2,0,1]=4 1390 B15R0.2405 N#CCCCCSCC(=O)NCC(O)CO 62a_100011219923_200012027429 [0,1,0,0,0,0|2,0,1]=4 1391 B15R0.2405 N#CCCCCSCC(=O)NCC(O)CO 62a_200012027429_100000211819 [0,1,0,0,0,0|2,0,1]=4 1392 B15R0.2405 NCCCCCOCC(=O)NCC(O)CO 34a_100000762737_200012027429 [0,1,0,0,0,0|2,0,0]=3 1393 B15R0.2405 NCCOCCOCC(=O)NCC(O)CO 34a_100000211614_200012027429 [0,1,0,0,0,0|3,0,0]=4 1394 B15R0.2405 O=C(CCCCCCCO)NC[C@@H](F)CO 240690a_100015665980_100011219782 [0,1,0,0,0,0|2,0,0]=3 1395 B15R0.2405 O=C(CCCCCCCO)NC[C@H](O)CO 240690a_100020644852_100011219782 [0,1,0,0,0,0|1,0,0]=2 1396 B15R0.2405 O=C(COCCCCCBr)NCC(O)CO 34a_100000746331_200012027429 [0,1,0,0,0,0|2,0,0]=3 1397 B15R0.2405 O=C(COCCCCCBr)NCC(O)CO 7a_100000746331_200012027429 [0,1,0,0,0,0|2,0,0]=3 1398 B15R0.2405 O=C(COCCCCCCl)NCC(O)CO 34a_100000746330_200012027429 [0,1,0,0,0,0|2,0,0]=3 1399 B15R0.2405 O=C(COCCCCCCl)NCC(O)CO 7a_100000746330_200012027429 [0,1,0,0,0,0|2,0,0]=3 1400 B15R0.2405 O=C(COCCCCCI)NCC(O)CO 34a_200012148887_200012027429 [0,1,0,0,0,0|2,0,0]=3 1401 B15R0.2405 O=C(COCCCCCI)NCC(O)CO 7a_200012148887_200012027429 [0,1,0,0,0,0|2,0,0]=3 1402 B15R0.2405 O=C(COCCOCCBr)NCC(O)CO 34a_100000692535_200012027429 [0,1,0,0,0,0|3,0,0]=4 1403 B15R0.2405 O=C(COCCOCCBr)NCC(O)CO 7a_100000692535_200012027429 [0,1,0,0,0,0|3,0,0]=4 1404 B15R0.2405 O=C(COCCOCCCl)NCC(O)CO 34a_100011215305_200012027429 [0,1,0,0,0,0|3,0,0]=4 1405 B15R0.2405 O=C(COCCOCCCl)NCC(O)CO 7a_100011215305_200012027429 [0,1,0,0,0,0|3,0,0]=4 1406 B15R0.2405 O=C(COCCOCCF)NCC(O)CO 34a_200015357709_200012027429 [0,1,0,0,0,0|3,0,0]=4 1407 B15R0.2405 O=C(COCCOCCF)NCC(O)CO 7a_200015357709_200012027429 [0,1,0,0,0,0|3,0,0]=4 1408 B15R0.2405 O=C(COCCOCCI)NCC(O)CO 34a_100012149058_200012027429 [0,1,0,0,0,0|3,0,0]=4 1409 B15R0.2405 O=C(COCCOCCI)NCC(O)CO 7a_100012149058_200012027429 [0,1,0,0,0,0|3,0,0]=4 1410 B15R0.2405 O=C(COCCOCCO)NC[C@H](O)CO 240690a_100020644852_106645077154 [0,1,0,0,0,0|3,0,0]=4 1411 B15R0.2405 O=C(CSCCCCCF)NCC(O)CO 62a_100000729378_200012027429 [0,1,0,0,0,0|2,0,0]=3 1412 B15R0.2405 O=C(CSCCCCCF)NCC(O)CO 62a_200012027429_100000729378 [0,1,0,0,0,0|2,0,0]=3 1413 B15R0.2405 O=C(CSCCCCCO)NCC(O)CO 62a_100000746330_200012027429 [0,1,0,0,0,0|2,0,0]=3 1414 B15R0.2405 O=C(CSCCCCCO)NCC(O)CO 62a_200012027429_100000746330 [0,1,0,0,0,0|2,0,0]=3 1415 B15R0.2405 O=C(CSCCOCCO)NCC(O)CO 62a_100011215305_200012027429 [0,1,0,0,0,0|3,0,0]=4 1416 B15R0.2405 O=C(CSCCOCCO)NCC(O)CO 62a_200012027429_100011215305 [0,1,0,0,0,0|3,0,0]=4 1417 B15R0.2405 O=C(NCCCCCCO)NC[C@@H](F)CO 273464a_100000686447_100015665980 [0,1,0,0,0,0|3,0,0]=4 1418 B15R0.2405 O=C(NCCCCCCO)NC[C@@H](F)CO 273464a_100015665980_100000686447 [0,1,0,0,0,0|3,0,0]=4 1419 B15R0.2405 O=C(NCCCCCCO)NC[C@@H](F)CO 512a_100000686447_100015665980 [0,1,0,0,0,0|3,0,0]=4 1420 B15R0.2405 O=C(NCCCCCCO)NC[C@@H](F)CO 512a_100015665980_100000686447 [0,1,0,0,0,0|3,0,0]=4 1421 B15R0.2405 O=CCCCCSCC(=O)NCC(O)CO 62a_100000139335_200012027429 [0,1,0,0,0,0|2,0,1]=4 1422 B15R0.2405 O=CCCCCSCC(=O)NCC(O)CO 62a_200012027429_100000139335 [0,1,0,0,0,0|2,0,1]=4 1423 B15R0.2405 [N-]=[N+]=NCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100009870042 [0,1,0,0,0,0|3,0,0]=4 1424 B15R0.2405 [N-]=[N+]=NCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100009870042 [0,1,0,0,0,0|3,0,0]=4 1425 B15R0.3040 CC(CCN)COCC(=O)NCC(O)CO 34a_106354213184_200012027429 [0,1,0,0,0,0|3,0,0]=4 1426 B15R0.3040 CCCC(=O)CSCC(=O)NCC(O)CO 62a_100000747444_200012027429 [0,1,0,0,0,0|2,0,1]=4 1427 B15R0.3040 CCCC(=O)CSCC(=O)NCC(O)CO 62a_200012027429_100000747444 [0,1,0,0,0,0|2,0,1]=4 1428 B15R0.3040 CCCC(C)COCC(=O)NCC(O)CO 34a_100000688023_200012027429 [0,1,0,0,0,0|2,0,0]=3 1429 B15R0.3040 CCCC(C)COCC(=O)NCC(O)CO 7a_100000688023_200012027429 [0,1,0,0,0,0|2,0,0]=3 1430 B15R0.3040 CCCC(C)CSCC(=O)NCC(O)CO 62a_100011216630_200012027429 [0,1,0,0,0,0|2,0,0]=3 1431 B15R0.3040 CCCC(C)CSCC(=O)NCC(O)CO 62a_200012027429_100011216630 [0,1,0,0,0,0|2,0,0]=3 1432 B15R0.3040 CCC[C@H](N)COCC(=O)NCC(O)CO 34a_100000732646_200012027429 [0,1,0,0,0,0|2,0,0]=3 1433 B15R0.3040 CCNC(=O)CCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000199580 [0,1,0,0,0,0|2,0,1]=4 1434 B15R0.3040 CCNC(=O)CCCC(=O)NC[C@H](O)CO 527a_100020644852_100000199580 [0,1,0,0,0,0|2,0,1]=4 1435 B15R0.3040 CCOC(=O)CCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000210991 [0,1,0,0,0,0|2,0,1]=4 1436 B15R0.3040 CCOC(=O)CCCC(=O)NC[C@H](O)CO 527a_100020644852_100000210991 [0,1,0,0,0,0|2,0,1]=4 1437 B15R0.3040 COCC(N)COCC(=O)NCC(O)CO 34a_100000724102_200012027429 [0,1,0,0,0,0|3,0,0]=4 1438 B15R0.3040 COCC(O)CSCC(=O)NCC(O)CO 62a_100011215053_200012027429 [0,1,0,0,0,0|3,0,0]=4 1439 B15R0.3040 COCC(O)CSCC(=O)NCC(O)CO 62a_200012027429_100011215053 [0,1,0,0,0,0|3,0,0]=4 1440 B15R0.3278 CC(C)(CO)CNC(=O)CCCCCCO 240690a_100020635058_100011996774 [0,1,0,0,0,0|3,0,0]=4 1441 B15R0.3278 CCCCCCCC(=O)NCC(C)(C)CO 240690a_100020635058_100000211969 [0,1,0,0,0,0|2,0,0]=3 1442 B15R0.3278 CCCCCCCC(=O)NCC(C)(C)CO 527a_100020635058_100000211969 [0,1,0,0,0,0|2,0,0]=3 1443 B15R0.3278 CCCCCCCC(=O)NCC(F)(F)CO 240690a_100000703232_100000211969 [0,1,0,0,0,0|2,0,0]=3 1444 B15R0.3278 CCCCCCCC(=O)NCC(F)(F)CO 527a_100000703232_100000211969 [0,1,0,0,0,0|2,0,0]=3 1445 B15R0.3278 CCCCCCCC(C)OCC(C)(C)CO 34a_200011215852_100009813988 [0,1,0,0,0,0|2,0,1]=4 1446 B15R0.3278 CCCCCCCC(C)OCC(C)(C)CO 7a_200011215852_100009813988 [0,1,0,0,0,0|2,0,1]=4 1447 B15R0.3278 CCCCCCNC(=O)NCC(C)(C)CO 2708a_100000210581_100020635058 [0,1,0,0,0,0|3,0,0]=4 1448 B15R0.3278 CCCCCCNC(=O)NCC(C)(C)CO 273464a_100000210581_100020635058 [0,1,0,0,0,0|3,0,0]=4 1449 B15R0.3278 CCCCCCNC(=O)NCC(C)(C)CO 273464a_100020635058_100000210581 [0,1,0,0,0,0|3,0,0]=4 1450 B15R0.3278 CCCCCCNC(=O)NCC(C)(C)CO 512a_100000210581_100020635058 [0,1,0,0,0,0|3,0,0]=4 1451 B15R0.3278 CCCCCCNC(=O)NCC(C)(C)CO 512a_100020635058_100000210581 [0,1,0,0,0,0|3,0,0]=4 1452 B15R0.3278 CCCCCCNC(=O)NCC(F)(F)CO 2708a_100000210581_100000703232 [0,1,0,0,0,0|3,0,0]=4 1453 B15R0.3278 CCCCCCNC(=O)NCC(F)(F)CO 273464a_100000210581_100000703232 [0,1,0,0,0,0|3,0,0]=4 1454 B15R0.3278 CCCCCCNC(=O)NCC(F)(F)CO 273464a_100000703232_100000210581 [0,1,0,0,0,0|3,0,0]=4 1455 B15R0.3278 CCCCCCNC(=O)NCC(F)(F)CO 512a_100000210581_100000703232 [0,1,0,0,0,0|3,0,0]=4 1456 B15R0.3278 CCCCCCNC(=O)NCC(F)(F)CO 512a_100000703232_100000210581 [0,1,0,0,0,0|3,0,0]=4 1457 B15R0.3278 COCCCCCC(=O)NCC(C)(C)CO 240690a_100020635058_100011935119 [0,1,0,0,0,0|3,0,0]=4 1458 B15R0.3278 COCCCCCC(=O)NCC(C)(C)CO 527a_100020635058_100011935119 [0,1,0,0,0,0|3,0,0]=4 1459 B15R0.3278 COCCCCCC(=O)NCC(F)(F)CO 240690a_100000703232_100011935119 [0,1,0,0,0,0|3,0,0]=4 1460 B15R0.3278 COCCCCCC(=O)NCC(F)(F)CO 527a_100000703232_100011935119 [0,1,0,0,0,0|3,0,0]=4 1461 B15R0.3278 O=C(CCCCCCO)NCC(F)(F)CO 240690a_100000703232_100011996774 [0,1,0,0,0,0|3,0,0]=4 1462 B15R0.4278 CCCCCCCC(C)(C)SCC(O)CO 62a_100011219619_200000046972 [0,1,0,0,0,0|1,1,1]=4 1463 B15R0.4278 CCCCCCCC(C)(C)SCC(O)CO 62a_200000046972_100011219619 [0,1,0,0,0,0|1,1,1]=4 1464 B15R0.4278 CCCCCCCC(C)(C)SC[C@@H](O)CO 62a_100009815848_200000046972 [0,1,0,0,0,0|1,1,1]=4 1465 B15R0.4278 CCCCCCCC(C)(C)SC[C@@H](O)CO 62a_200000046972_100009815848 [0,1,0,0,0,0|1,1,1]=4 1466 B15R0.4384 CCCCCCNC(=O)CC(=O)C(O)CO 1458a_100011215603_100000230325 [0,1,0,0,0,0|2,0,1]=4 1467 B15R0.4916 CC(CCCCl)OCC(=O)NCC(O)CO 34a_200000718107_200012027429 [0,1,0,0,0,0|3,0,0]=4 1468 B15R0.4916 CC(CCCCl)OCC(=O)NCC(O)CO 7a_200000718107_200012027429 [0,1,0,0,0,0|3,0,0]=4 1469 B15R0.4916 CCCCC(C)CCC(=O)NCC(C)CC 11a_100020588543_100000033779 [0,1,0,0,0,0|3,0,0]=4 1470 B15R0.4916 CCCCC(C)CCC(=O)NCC(C)CC 1626a_100020588543_100000033779 [0,1,0,0,0,0|3,0,0]=4 1471 B15R0.4916 CCCCC(C)CCC(=O)NCC(C)CC 240690a_100020588543_100000033779 [0,1,0,0,0,0|3,0,0]=4 1472 B15R0.4916 CCCCC(C)CCC(=O)NCC(C)CC 527a_100020588543_100000033779 [0,1,0,0,0,0|3,0,0]=4 1473 B15R0.4916 CCCCC(C)CCC(=O)NCC(C)CO 240690a_100000744482_100000033779 [0,1,0,0,0,0|2,0,0]=3 1474 B15R0.4916 CCCCC(C)CCC(=O)NCC(C)CO 527a_100000744482_100000033779 [0,1,0,0,0,0|2,0,0]=3 1475 B15R0.4916 CCCCC(C)CCC(=O)NCC(O)CC 11a_100011218483_100000033779 [0,1,0,0,0,0|2,0,0]=3 1476 B15R0.4916 CCCCC(C)CCC(=O)NCC(O)CC 240690a_100011218483_100000033779 [0,1,0,0,0,0|2,0,0]=3 1477 B15R0.4916 CCCCC(C)CCC(=O)NCC(O)CC 527a_100011218483_100000033779 [0,1,0,0,0,0|2,0,0]=3 1478 B15R0.4916 CCCCC(C)CCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000033779 [0,1,0,0,0,0|2,0,0]=3 1479 B15R0.4916 CCCCC(C)CCC(=O)NC[C@@H](F)CO 527a_100015665980_100000033779 [0,1,0,0,0,0|2,0,0]=3 1480 B15R0.4916 CCCCC(C)CCC(=O)NC[C@H](O)CO 240690a_100020644852_100000033779 [0,1,0,0,0,0|1,0,0]=2 1481 B15R0.4916 CCCCC(C)CCC(=O)NC[C@H](O)CO 527a_100020644852_100000033779 [0,1,0,0,0,0|1,0,0]=2 1482 B15R0.4916 CCCCC(C)NCC(=O)NCC(O)CO 2230a_100000126638_200012027429 [0,1,0,0,0,0|2,0,0]=3 1483 B15R0.4916 CCCCC(C)OCC(=O)NCC(O)CO 34a_100000687866_200012027429 [0,1,0,0,0,0|2,0,0]=3 1484 B15R0.4916 CCCCC(C)OCC(=O)NCC(O)CO 7a_100000687866_200012027429 [0,1,0,0,0,0|2,0,0]=3 1485 B15R0.4916 CCCCC(C)SCC(=O)NCC(O)CO 62a_200011215066_200012027429 [0,1,0,0,0,0|2,0,0]=3 1486 B15R0.4916 CCCCC(C)SCC(=O)NCC(O)CO 62a_200012027429_200011215066 [0,1,0,0,0,0|2,0,0]=3 1487 B15R0.4916 CCCNC(=O)CCC(=O)NC[C@H](O)CO 240690a_100020644852_100000199543 [0,1,0,0,0,0|2,0,1]=4 1488 B15R0.4916 CCCNC(=O)CCC(=O)NC[C@H](O)CO 527a_100020644852_100000199543 [0,1,0,0,0,0|2,0,1]=4 1489 B15R0.4916 CCCOC(C)CNC(=O)NC[C@H](O)CO 2708a_100015185124_100020644852 [0,1,0,0,0,0|3,0,0]=4 1490 B15R0.4916 CCCOC(C)CNC(=O)NC[C@H](O)CO 273464a_100015185124_100020644852 [0,1,0,0,0,0|3,0,0]=4 1491 B15R0.4916 CCCOC(C)CNC(=O)NC[C@H](O)CO 273464a_100020644852_100015185124 [0,1,0,0,0,0|3,0,0]=4 1492 B15R0.4916 CCOCC(C)OCC(=O)NCC(O)CO 34a_100000718985_200012027429 [0,1,0,0,0,0|3,0,0]=4 1493 B15R0.4916 CCOCC(C)OCC(=O)NCC(O)CO 7a_100000718985_200012027429 [0,1,0,0,0,0|3,0,0]=4 1494 B15R0.4916 COCCN(C)CCC(=O)NC[C@H](O)CO 240690a_100020644852_200103286627 [0,1,0,0,0,0|3,0,0]=4 1495 B15R0.5203 CCCCCC(=O)CC(=O)NCC(O)CO 1458a_100000212188_200012027429 [0,1,0,0,0,0|1,0,1]=3 1496 B15R0.5203 CCCCCC(C)NC(=O)CCC(O)CC 1626a_100000211957_203496584001 [0,1,0,0,0,0|3,0,0]=4 1497 B15R0.5203 CCCCCC(C)NC(=O)CCC(O)CC 240690a_100000211957_203496584001 [0,1,0,0,0,0|3,0,0]=4 1498 B15R0.5203 CCCCCC(C)NC(=O)NCC(C)CO 2708a_100000211957_100000744482 [0,1,0,0,0,0|3,0,0]=4 1499 B15R0.5203 CCCCCC(C)NC(=O)NCC(C)CO 273464a_100000211957_100000744482 [0,1,0,0,0,0|3,0,0]=4 1500 B15R0.5203 CCCCCC(C)NC(=O)NCC(C)CO 273464a_100000744482_100000211957 [0,1,0,0,0,0|3,0,0]=4 1501 B15R0.5203 CCCCCC(C)NC(=O)NCC(C)CO 512a_100000211957_100000744482 [0,1,0,0,0,0|3,0,0]=4 1502 B15R0.5203 CCCCCC(C)NC(=O)NCC(C)CO 512a_100000744482_100000211957 [0,1,0,0,0,0|3,0,0]=4 1503 B15R0.5203 CCCCCC(C)NC(=O)NCC(O)CC 2708a_100000211957_100011218483 [0,1,0,0,0,0|3,0,0]=4 1504 B15R0.5203 CCCCCC(C)NC(=O)NCC(O)CC 273464a_100000211957_100011218483 [0,1,0,0,0,0|3,0,0]=4 1505 B15R0.5203 CCCCCC(C)NC(=O)NCC(O)CC 273464a_100011218483_100000211957 [0,1,0,0,0,0|3,0,0]=4 1506 B15R0.5203 CCCCCC(C)NC(=O)NCC(O)CC 512a_100011218483_100000211957 [0,1,0,0,0,0|3,0,0]=4 1507 B15R0.5203 CCCCCC(C)NC(=O)NC[C@@H](F)CO 2708a_100000211957_100015665980 [0,1,0,0,0,0|3,0,0]=4 1508 B15R0.5203 CCCCCC(C)NC(=O)NC[C@@H](F)CO 273464a_100000211957_100015665980 [0,1,0,0,0,0|3,0,0]=4 1509 B15R0.5203 CCCCCC(C)NC(=O)NC[C@@H](F)CO 273464a_100015665980_100000211957 [0,1,0,0,0,0|3,0,0]=4 1510 B15R0.5203 CCCCCC(C)NC(=O)NC[C@@H](F)CO 512a_100000211957_100015665980 [0,1,0,0,0,0|3,0,0]=4 1511 B15R0.5203 CCCCCC(C)NC(=O)NC[C@@H](F)CO 512a_100015665980_100000211957 [0,1,0,0,0,0|3,0,0]=4 1512 B15R0.5203 CCCCCC(C)NC(=O)NC[C@H](O)CO 2708a_100000211957_100020644852 [0,1,0,0,0,0|2,0,0]=3 1513 B15R0.5203 CCCCCC(C)NC(=O)NC[C@H](O)CO 273464a_100000211957_100020644852 [0,1,0,0,0,0|2,0,0]=3 1514 B15R0.5203 CCCCCC(C)NC(=O)NC[C@H](O)CO 273464a_100020644852_100000211957 [0,1,0,0,0,0|2,0,0]=3 1515 B15R0.5203 CCCCCN(C)CC(=O)NCC(O)CO 2230a_100000223495_200012027429 [0,1,0,0,0,0|2,0,0]=3 1516 B15R0.5203 CCCCCN(C)CC(=O)NCC(O)CO 269982a_100000223495_200012027429 [0,1,0,0,0,0|2,0,0]=3 1517 B15R0.5203 CCCOCC(=O)CC(=O)NCC(O)CO 1458a_100000745993_200012027429 [0,1,0,0,0,0|2,0,1]=4 1518 B15R0.5203 CCCSCC(=O)CC(=O)NCC(O)CO 1458a_100000217233_200012027429 [0,1,0,0,0,0|2,0,1]=4 1519 B15R0.5203 CCOCCC(=O)CC(=O)NCC(O)CO 1458a_100000749530_200012027429 [0,1,0,0,0,0|2,0,1]=4 1520 B15R0.5203 CCSCCC(=O)CC(=O)NCC(O)CO 1458a_100000230768_200012027429 [0,1,0,0,0,0|2,0,1]=4 1521 B15R0.5203 CN(CCCCO)CC(=O)NCC(O)CO 2230a_100000717598_200012027429 [0,1,0,0,0,0|3,0,0]=4 1522 B15R0.5203 CN(CCCCO)CC(=O)NCC(O)CO 269982a_100000717598_200012027429 [0,1,0,0,0,0|3,0,0]=4 1523 B15R0.5203 COCCCC(=O)CC(=O)NCC(O)CO 1458a_100000741012_200012027429 [0,1,0,0,0,0|2,0,1]=4 1524 B15R0.5203 COCCCN(C)CC(=O)NCC(O)CO 2230a_100000224831_200012027429 [0,1,0,0,0,0|3,0,0]=4 1525 B15R0.5203 COCCCN(C)CC(=O)NCC(O)CO 269982a_100000224831_200012027429 [0,1,0,0,0,0|3,0,0]=4 1526 B15R0.5203 CSCCCC(=O)CC(=O)NCC(O)CO 1458a_100000173376_200012027429 [0,1,0,0,0,0|2,0,1]=4 1527 B15R0.5203 O=C(CCCCO)CC(=O)NCC(O)CO 1458a_100000695505_200012027429 [0,1,0,0,0,0|2,0,1]=4 1528 B15R1.137 CCCCCCCC(=O)C1CCC(C1)O 1458a_100000688591_100000210614 [0,0,0,1,0,0|2,0,0]=3 1529 B15R1.137 CCCCCCCC(=O)N1CCC(C1)O 240690a_100011215560_100000211969 [0,0,0,1,0,0|2,0,0]=3 1530 B15R1.137 CCCCCCCC(=O)N1CCC(C1)O 527a_100011215560_100000211969 [0,0,0,1,0,0|2,0,0]=3 1531 B15R1.137 CCCCCCCC(=O)N1CC[C@@H](C1)F 11a_100015203821_100000211969 [0,0,0,1,0,0|3,0,0]=4 1532 B15R1.137 CCCCCCCC(=O)N1CC[C@@H](C1)F 1626a_100015203821_100000211969 [0,0,0,1,0,0|3,0,0]=4 1533 B15R1.137 CCCCCCCC(=O)N1CC[C@@H](C1)F 240690a_100015203821_100000211969 [0,0,0,1,0,0|3,0,0]=4 1534 B15R1.137 CCCCCCCC(=O)N1CC[C@@H](C1)F 527a_100015203821_100000211969 [0,0,0,1,0,0|3,0,0]=4 1535 B15R1.137 CCCCCCCC(=O)N1CC[C@H](C1)C 11a_100016987628_100000211969 [0,0,0,1,0,0|3,0,0]=4 1536 B15R1.137 CCCCCCCC(=O)N1CC[C@H](C1)C 240690a_100016987628_100000211969 [0,0,0,1,0,0|3,0,0]=4 1537 B15R1.137 CCCCCCCC(=O)N1CC[C@H](C1)C 527a_100016987628_100000211969 [0,0,0,1,0,0|3,0,0]=4 1538 B15R1.137 CCCCCCNC(=O)C1CCC(C1)O 1626a_100000210581_100000688591 [0,0,0,1,0,0|3,0,0]=4 1539 B15R1.137 CCCCCCNC(=O)C1CCC(C1)O 240690a_100000210581_100000688591 [0,0,0,1,0,0|3,0,0]=4 1540 B15R1.137 CCCCCCNC(=O)N1CCC(C1)O 2708a_100000210581_100011215560 [0,0,0,1,0,0|3,0,0]=4 1541 B15R1.137 CCCCCCNC(=O)N1CCC(C1)O 273464a_100000210581_100011215560 [0,0,0,1,0,0|3,0,0]=4 1542 B15R1.137 CCCCOCCC(=O)C1CCC(C1)O 1458a_100000688591_100000743108 [0,0,0,1,0,0|3,0,0]=4 1543 B15R1.137 COCCCCCC(=O)N1CCC(C1)O 240690a_100011215560_100011935119 [0,0,0,1,0,0|3,0,0]=4 1544 B15R1.137 COCCCCCC(=O)N1CCC(C1)O 527a_100011215560_100011935119 [0,0,0,1,0,0|3,0,0]=4 1545 B15R1.137 O=C(CCCCCCF)C1CCC(C1)O 1458a_100000688591_100015922095 [0,0,0,1,0,0|3,0,0]=4 1546 B15R1.137 O=C(CCCCCCO)C1CCC(C1)O 1458a_100000688591_100000766143 [0,0,0,1,0,0|3,0,0]=4 1547 B15R1.137 O=C(CCCCCCO)N1CCC(C1)O 240690a_100011215560_100011996774 [0,0,0,1,0,0|3,0,0]=4 1548 B15R1.964 CC(CO)CNC(=O)CC1CCCCC1 240690a_100000744482_100000211666 [0,0,0,1,0,0|2,0,0]=3 1549 B15R1.964 CC(CO)CNC(=O)CC1CCCCC1 527a_100000744482_100000211666 [0,0,0,1,0,0|2,0,0]=3 1550 B15R1.964 CC(CO)CNC(=O)CC1CCCCO1 240690a_100000744482_100000238585 [0,0,0,1,0,0|3,0,0]=4 1551 B15R1.964 CC(CO)CNC(=O)CC1CCCCO1 527a_100000744482_100000238585 [0,0,0,1,0,0|3,0,0]=4 1552 B15R1.964 CC(CO)CNC(=O)CC1CCCOC1 240690a_100000744482_100000741523 [0,0,0,1,0,0|3,0,0]=4 1553 B15R1.964 CC(CO)CNC(=O)CC1CCCOC1 527a_100000744482_100000741523 [0,0,0,1,0,0|3,0,0]=4 1554 B15R1.964 CC(CO)CNC(=O)CC1CCOCC1 240690a_100000744482_100000757261 [0,0,0,1,0,0|3,0,0]=4 1555 B15R1.964 CC(CO)CNC(=O)CC1CCOCC1 527a_100000744482_100000757261 [0,0,0,1,0,0|3,0,0]=4 1556 B15R1.964 CC(CO)CNC(=O)CN1CCCCC1 240690a_100000744482_100000740322 [0,0,0,1,0,0|3,0,0]=4 1557 B15R1.964 CC(CO)CNC(=O)CN1CCCCC1 527a_100000744482_100000740322 [0,0,0,1,0,0|3,0,0]=4 1558 B15R1.964 CC(CO)CNC(=O)NC1CCCCC1 2708a_100000182618_100000744482 [0,0,0,1,0,0|3,0,0]=4 1559 B15R1.964 CC(CO)CNC(=O)NC1CCCCC1 273464a_100000182618_100000744482 [0,0,0,1,0,0|3,0,0]=4 1560 B15R1.964 CC(CO)CNC(=O)NC1CCCCC1 273464a_100000744482_100000182618 [0,0,0,1,0,0|3,0,0]=4 1561 B15R1.964 CCC(C)CCC(=O)CC1CCCCC1 1458a_100000701222_100000211423 [0,0,0,1,0,0|3,0,0]=4 1562 B15R1.964 CCC(C)CNC(=O)CC1CCCCC1 11a_100020588543_100000211666 [0,0,0,1,0,0|3,0,0]=4 1563 B15R1.964 CCC(C)CNC(=O)CC1CCCCC1 1626a_100020588543_100000211666 [0,0,0,1,0,0|3,0,0]=4 1564 B15R1.964 CCC(C)CNC(=O)CC1CCCCC1 240690a_100020588543_100000211666 [0,0,0,1,0,0|3,0,0]=4 1565 B15R1.964 CCC(C)CNC(=O)CC1CCCCC1 527a_100020588543_100000211666 [0,0,0,1,0,0|3,0,0]=4 1566 B15R1.964 CCC(O)CCC(=O)NC1CCCCC1 1626a_100000182618_203496584001 [0,0,0,1,0,0|3,0,0]=4 1567 B15R1.964 CCC(O)CCC(=O)NC1CCCCC1 240690a_100000182618_203496584001 [0,0,0,1,0,0|3,0,0]=4 1568 B15R1.964 CCC(O)CNC(=O)CC1CCCCC1 11a_100011218483_100000211666 [0,0,0,1,0,0|2,0,0]=3 1569 B15R1.964 CCC(O)CNC(=O)CC1CCCCC1 240690a_100011218483_100000211666 [0,0,0,1,0,0|2,0,0]=3 1570 B15R1.964 CCC(O)CNC(=O)CC1CCCCC1 527a_100011218483_100000211666 [0,0,0,1,0,0|2,0,0]=3 1571 B15R1.964 CCC(O)CNC(=O)CC1CCCCO1 11a_100011218483_100000238585 [0,0,0,1,0,0|3,0,0]=4 1572 B15R1.964 CCC(O)CNC(=O)CC1CCCCO1 240690a_100011218483_100000238585 [0,0,0,1,0,0|3,0,0]=4 1573 B15R1.964 CCC(O)CNC(=O)CC1CCCCO1 527a_100011218483_100000238585 [0,0,0,1,0,0|3,0,0]=4 1574 B15R1.964 CCC(O)CNC(=O)CC1CCCOC1 11a_100011218483_100000741523 [0,0,0,1,0,0|3,0,0]=4 1575 B15R1.964 CCC(O)CNC(=O)CC1CCCOC1 240690a_100011218483_100000741523 [0,0,0,1,0,0|3,0,0]=4 1576 B15R1.964 CCC(O)CNC(=O)CC1CCCOC1 527a_100011218483_100000741523 [0,0,0,1,0,0|3,0,0]=4 1577 B15R1.964 CCC(O)CNC(=O)CC1CCOCC1 11a_100011218483_100000757261 [0,0,0,1,0,0|3,0,0]=4 1578 B15R1.964 CCC(O)CNC(=O)CC1CCOCC1 240690a_100011218483_100000757261 [0,0,0,1,0,0|3,0,0]=4 1579 B15R1.964 CCC(O)CNC(=O)CC1CCOCC1 527a_100011218483_100000757261 [0,0,0,1,0,0|3,0,0]=4 1580 B15R1.964 CCC(O)CNC(=O)CN1CCCCC1 11a_100011218483_100000740322 [0,0,0,1,0,0|3,0,0]=4 1581 B15R1.964 CCC(O)CNC(=O)CN1CCCCC1 240690a_100011218483_100000740322 [0,0,0,1,0,0|3,0,0]=4 1582 B15R1.964 CCC(O)CNC(=O)CN1CCCCC1 527a_100011218483_100000740322 [0,0,0,1,0,0|3,0,0]=4 1583 B15R1.964 CCC(O)CNC(=O)NC1CCCCC1 2708a_100000182618_100011218483 [0,0,0,1,0,0|3,0,0]=4 1584 B15R1.964 CCC(O)CNC(=O)NC1CCCCC1 273464a_100000182618_100011218483 [0,0,0,1,0,0|3,0,0]=4 1585 B15R1.964 CCC(O)CNC(=O)NC1CCCCC1 273464a_100011218483_100000182618 [0,0,0,1,0,0|3,0,0]=4 1586 B15R1.964 O=C(C=C1CCCCC1)NC[C@H](O)CO 240690a_100020644852_100000743792 [0,0,0,1,0,0|1,0,2]=4 1587 B15R1.964 O=C(CC1=CCCCC1)NC[C@H](O)CO 240690a_100020644852_100000039269 [0,0,0,1,0,0|1,0,2]=4 1588 B15R1.964 O=C(CC1=CCCCC1)NC[C@H](O)CO 527a_100020644852_100000039269 [0,0,0,1,0,0|1,0,2]=4 1589 B15R1.964 O=C(CC1CCCCC1)NC[C@@H](F)CO 240690a_100015665980_100000211666 [0,0,0,1,0,0|2,0,0]=3 1590 B15R1.964 O=C(CC1CCCCC1)NC[C@@H](F)CO 527a_100015665980_100000211666 [0,0,0,1,0,0|2,0,0]=3 1591 B15R1.964 O=C(CC1CCCCC1)NC[C@H](O)CO 240690a_100020644852_100000211666 [0,0,0,1,0,0|1,0,0]=2 1592 B15R1.964 O=C(CC1CCCCC1)NC[C@H](O)CO 527a_100020644852_100000211666 [0,0,0,1,0,0|1,0,0]=2 1593 B15R1.964 O=C(CC1CCCCO1)NC[C@@H](F)CO 240690a_100015665980_100000238585 [0,0,0,1,0,0|3,0,0]=4 1594 B15R1.964 O=C(CC1CCCCO1)NC[C@@H](F)CO 527a_100015665980_100000238585 [0,0,0,1,0,0|3,0,0]=4 1595 B15R1.964 O=C(CC1CCCCO1)NC[C@H](O)CO 240690a_100020644852_100000238585 [0,0,0,1,0,0|2,0,0]=3 1596 B15R1.964 O=C(CC1CCCCO1)NC[C@H](O)CO 527a_100020644852_100000238585 [0,0,0,1,0,0|2,0,0]=3 1597 B15R1.964 O=C(CC1CCCOC1)NC[C@@H](F)CO 240690a_100015665980_100000741523 [0,0,0,1,0,0|3,0,0]=4 1598 B15R1.964 O=C(CC1CCCOC1)NC[C@@H](F)CO 527a_100015665980_100000741523 [0,0,0,1,0,0|3,0,0]=4 1599 B15R1.964 O=C(CC1CCCOC1)NC[C@H](O)CO 240690a_100020644852_100000741523 [0,0,0,1,0,0|2,0,0]=3 1600 B15R1.964 O=C(CC1CCCOC1)NC[C@H](O)CO 527a_100020644852_100000741523 [0,0,0,1,0,0|2,0,0]=3 1601 B15R1.964 O=C(CC1CCOCC1)NC[C@@H](F)CO 240690a_100015665980_100000757261 [0,0,0,1,0,0|3,0,0]=4 1602 B15R1.964 O=C(CC1CCOCC1)NC[C@@H](F)CO 527a_100015665980_100000757261 [0,0,0,1,0,0|3,0,0]=4 1603 B15R1.964 O=C(CC1CCOCC1)NC[C@H](O)CO 240690a_100020644852_100000757261 [0,0,0,1,0,0|2,0,0]=3 1604 B15R1.964 O=C(CC1CCOCC1)NC[C@H](O)CO 527a_100020644852_100000757261 [0,0,0,1,0,0|2,0,0]=3 1605 B15R1.964 O=C(CN1CCCCC1)NC[C@@H](F)CO 240690a_100015665980_100000740322 [0,0,0,1,0,0|3,0,0]=4 1606 B15R1.964 O=C(CN1CCCCC1)NC[C@@H](F)CO 527a_100015665980_100000740322 [0,0,0,1,0,0|3,0,0]=4 1607 B15R1.964 O=C(CN1CCCCC1)NC[C@H](O)CO 240690a_100020644852_100000740322 [0,0,0,1,0,0|2,0,0]=3 1608 B15R1.964 O=C(CN1CCCCC1)NC[C@H](O)CO 527a_100020644852_100000740322 [0,0,0,1,0,0|2,0,0]=3 1609 B15R1.964 O=C(CN1CCCOC1)NCC(O)CO 2230a_100000131196_200012027429 [0,0,0,1,0,0|3,0,0]=4 1610 B15R1.964 O=C(CN1CCCOC1)NCC(O)CO 269982a_100000131196_200012027429 [0,0,0,1,0,0|3,0,0]=4 1611 B15R1.964 O=C(CN1CCCOC1)NCC(O)CO 34a_100000131196_200012027429 [0,0,0,1,0,0|3,0,0]=4 1612 B15R1.964 O=C(CN1CCOCC1)NCC(O)CO 2230a_100015191051_200012027429 [0,0,0,1,0,0|3,0,0]=4 1613 B15R1.964 O=C(CN1CCOCC1)NCC(O)CO 269982a_100015191051_200012027429 [0,0,0,1,0,0|3,0,0]=4 1614 B15R1.964 O=C(CN1CCOCC1)NCC(O)CO 34a_100015191051_200012027429 [0,0,0,1,0,0|3,0,0]=4 1615 B15R1.964 O=C(CN1CCOCC1)NC[C@H](O)CO 240690a_100020644852_100000740321 [0,0,0,1,0,0|3,0,0]=4 1616 B15R1.964 O=C(CN1CCOCC1)NC[C@H](O)CO 527a_100020644852_100000740321 [0,0,0,1,0,0|3,0,0]=4 1617 B15R1.964 O=C(CN1CCSCC1)NCC(O)CO 2230a_100000737611_200012027429 [0,0,0,1,0,0|3,0,0]=4 1618 B15R1.964 O=C(CN1CCSCC1)NCC(O)CO 269982a_100000737611_200012027429 [0,0,0,1,0,0|3,0,0]=4 1619 B15R1.964 O=C(NC[C@@H](F)CO)NC1CCCCC1 2708a_100000182618_100015665980 [0,0,0,1,0,0|3,0,0]=4 1620 B15R1.964 O=C(NC[C@@H](F)CO)NC1CCCCC1 273464a_100000182618_100015665980 [0,0,0,1,0,0|3,0,0]=4 1621 B15R1.964 O=C(NC[C@@H](F)CO)NC1CCCCC1 273464a_100015665980_100000182618 [0,0,0,1,0,0|3,0,0]=4 1622 B15R1.964 O=C(NC[C@H](O)CO)NC1CCCCC1 2708a_100000182618_100020644852 [0,0,0,1,0,0|2,0,0]=3 1623 B15R1.964 O=C(NC[C@H](O)CO)NC1CCCCC1 273464a_100000182618_100020644852 [0,0,0,1,0,0|2,0,0]=3 1624 B15R1.964 O=C(NC[C@H](O)CO)NC1CCCCC1 273464a_100020644852_100000182618 [0,0,0,1,0,0|2,0,0]=3 1625 B15R1.964 O=C(NC[C@H](O)CO)NC1CCCOC1 2708a_100000719290_100020644852 [0,0,0,1,0,0|3,0,0]=4 1626 B15R1.964 O=C(NC[C@H](O)CO)NC1CCCOC1 273464a_100000719290_100020644852 [0,0,0,1,0,0|3,0,0]=4 1627 B15R1.964 O=C(NC[C@H](O)CO)NC1CCCOC1 273464a_100020644852_100000719290 [0,0,0,1,0,0|3,0,0]=4 1628 B15R1.964 O=C(NC[C@H](O)CO)NC1CCOCC1 2708a_100000741149_100020644852 [0,0,0,1,0,0|3,0,0]=4 1629 B15R1.964 O=C(NC[C@H](O)CO)NC1CCOCC1 273464a_100000741149_100020644852 [0,0,0,1,0,0|3,0,0]=4 1630 B15R1.964 O=C(NC[C@H](O)CO)NC1CCOCC1 273464a_100020644852_100000741149 [0,0,0,1,0,0|3,0,0]=4 1631 B15R1.964 O=C(NC[C@H](O)CO)NC1CCSCC1 2708a_100000748639_100020644852 [0,0,0,1,0,0|3,0,0]=4 1632 B15R1.964 O=C(NC[C@H](O)CO)NC1CCSCC1 273464a_100000748639_100020644852 [0,0,0,1,0,0|3,0,0]=4 1633 B15R1.964 O=C(NC[C@H](O)CO)NC1CCSCC1 273464a_100020644852_100000748639 [0,0,0,1,0,0|3,0,0]=4 1634 B15R1.1115 CC(CO)CNC(=O)CCC1CCCC1 240690a_100000744482_100000211120 [0,0,0,1,0,0|2,0,0]=3 1635 B15R1.1115 CC(CO)CNC(=O)CCC1CCCC1 527a_100000744482_100000211120 [0,0,0,1,0,0|2,0,0]=3 1636 B15R1.1115 CC(CO)CNC(=O)CCC1CCCO1 240690a_100000744482_100011247709 [0,0,0,1,0,0|3,0,0]=4 1637 B15R1.1115 CC(CO)CNC(=O)CCC1CCCO1 527a_100000744482_100011247709 [0,0,0,1,0,0|3,0,0]=4 1638 B15R1.1115 CC(CO)CNC(=O)CCN1CCCC1 240690a_100000744482_100000738983 [0,0,0,1,0,0|3,0,0]=4 1639 B15R1.1115 CC(CO)CNC(=O)COC1CCCC1 240690a_100000744482_100000741352 [0,0,0,1,0,0|3,0,0]=4 1640 B15R1.1115 CC(CO)CNC(=O)COC1CCCC1 527a_100000744482_100000741352 [0,0,0,1,0,0|3,0,0]=4 1641 B15R1.1115 CC(CO)CNC(=O)NCC1CCCC1 2708a_100000737975_100000744482 [0,0,0,1,0,0|3,0,0]=4 1642 B15R1.1115 CC(CO)CNC(=O)NCC1CCCC1 273464a_100000737975_100000744482 [0,0,0,1,0,0|3,0,0]=4 1643 B15R1.1115 CC(CO)CNC(=O)NCC1CCCC1 273464a_100000744482_100000737975 [0,0,0,1,0,0|3,0,0]=4 1644 B15R1.1115 CC(CO)CNC(=O)NCC1CCCC1 512a_100000737975_100000744482 [0,0,0,1,0,0|3,0,0]=4 1645 B15R1.1115 CC(CO)CNC(=O)NCC1CCCC1 512a_100000744482_100000737975 [0,0,0,1,0,0|3,0,0]=4 1646 B15R1.1115 CCC(C)CCC(=O)CCC1CCCC1 1458a_100000701222_100000760354 [0,0,0,1,0,0|3,0,0]=4 1647 B15R1.1115 CCC(C)CNC(=O)CCC1CCCC1 11a_100020588543_100000211120 [0,0,0,1,0,0|3,0,0]=4 1648 B15R1.1115 CCC(C)CNC(=O)CCC1CCCC1 1626a_100020588543_100000211120 [0,0,0,1,0,0|3,0,0]=4 1649 B15R1.1115 CCC(C)CNC(=O)CCC1CCCC1 240690a_100020588543_100000211120 [0,0,0,1,0,0|3,0,0]=4 1650 B15R1.1115 CCC(C)CNC(=O)CCC1CCCC1 527a_100020588543_100000211120 [0,0,0,1,0,0|3,0,0]=4 1651 B15R1.1115 CCC(O)CCC(=O)NCC1CCCC1 1626a_100000737975_203496584001 [0,0,0,1,0,0|3,0,0]=4 1652 B15R1.1115 CCC(O)CCC(=O)NCC1CCCC1 240690a_100000737975_203496584001 [0,0,0,1,0,0|3,0,0]=4 1653 B15R1.1115 CCC(O)CNC(=O)CCC1CCCC1 11a_100011218483_100000211120 [0,0,0,1,0,0|2,0,0]=3 1654 B15R1.1115 CCC(O)CNC(=O)CCC1CCCC1 240690a_100011218483_100000211120 [0,0,0,1,0,0|2,0,0]=3 1655 B15R1.1115 CCC(O)CNC(=O)CCC1CCCC1 527a_100011218483_100000211120 [0,0,0,1,0,0|2,0,0]=3 1656 B15R1.1115 CCC(O)CNC(=O)CCC1CCCO1 11a_100011218483_100011247709 [0,0,0,1,0,0|3,0,0]=4 1657 B15R1.1115 CCC(O)CNC(=O)CCC1CCCO1 240690a_100011218483_100011247709 [0,0,0,1,0,0|3,0,0]=4 1658 B15R1.1115 CCC(O)CNC(=O)CCC1CCCO1 527a_100011218483_100011247709 [0,0,0,1,0,0|3,0,0]=4 1659 B15R1.1115 CCC(O)CNC(=O)CCN1CCCC1 240690a_100011218483_100000738983 [0,0,0,1,0,0|3,0,0]=4 1660 B15R1.1115 CCC(O)CNC(=O)COC1CCCC1 11a_100011218483_100000741352 [0,0,0,1,0,0|3,0,0]=4 1661 B15R1.1115 CCC(O)CNC(=O)COC1CCCC1 240690a_100011218483_100000741352 [0,0,0,1,0,0|3,0,0]=4 1662 B15R1.1115 CCC(O)CNC(=O)COC1CCCC1 527a_100011218483_100000741352 [0,0,0,1,0,0|3,0,0]=4 1663 B15R1.1115 CCC(O)CNC(=O)NCC1CCCC1 2708a_100000737975_100011218483 [0,0,0,1,0,0|3,0,0]=4 1664 B15R1.1115 CCC(O)CNC(=O)NCC1CCCC1 273464a_100000737975_100011218483 [0,0,0,1,0,0|3,0,0]=4 1665 B15R1.1115 CCC(O)CNC(=O)NCC1CCCC1 273464a_100011218483_100000737975 [0,0,0,1,0,0|3,0,0]=4 1666 B15R1.1115 CCC(O)CNC(=O)NCC1CCCC1 512a_100011218483_100000737975 [0,0,0,1,0,0|3,0,0]=4 1667 B15R1.1115 O=C(CCC1CCCC1)NC[C@@H](F)CO 240690a_100015665980_100000211120 [0,0,0,1,0,0|2,0,0]=3 1668 B15R1.1115 O=C(CCC1CCCC1)NC[C@@H](F)CO 527a_100015665980_100000211120 [0,0,0,1,0,0|2,0,0]=3 1669 B15R1.1115 O=C(CCC1CCCC1)NC[C@H](O)CO 240690a_100020644852_100000211120 [0,0,0,1,0,0|1,0,0]=2 1670 B15R1.1115 O=C(CCC1CCCC1)NC[C@H](O)CO 527a_100020644852_100000211120 [0,0,0,1,0,0|1,0,0]=2 1671 B15R1.1115 O=C(CCC1CCCO1)NC[C@@H](F)CO 240690a_100015665980_100011247709 [0,0,0,1,0,0|3,0,0]=4 1672 B15R1.1115 O=C(CCC1CCCO1)NC[C@@H](F)CO 527a_100015665980_100011247709 [0,0,0,1,0,0|3,0,0]=4 1673 B15R1.1115 O=C(CCC1CCCO1)NC[C@H](O)CO 240690a_100020644852_100011247709 [0,0,0,1,0,0|2,0,0]=3 1674 B15R1.1115 O=C(CCC1CCCO1)NC[C@H](O)CO 527a_100020644852_100011247709 [0,0,0,1,0,0|2,0,0]=3 1675 B15R1.1115 O=C(CCN1CCCC1)NC[C@@H](F)CO 240690a_100015665980_100000738983 [0,0,0,1,0,0|3,0,0]=4 1676 B15R1.1115 O=C(CCN1CCCC1)NC[C@H](O)CO 240690a_100020644852_100000738983 [0,0,0,1,0,0|2,0,0]=3 1677 B15R1.1115 O=C(CCN1CCCO1)NC[C@H](O)CO 240690a_100020644852_200015187630 [0,0,0,1,0,0|3,0,0]=4 1678 B15R1.1115 O=C(CNC1CCCC1)NCC(O)CO 2230a_100000211070_200012027429 [0,0,0,1,0,0|2,0,0]=3 1679 B15R1.1115 O=C(CNC1CCCC1)NCC(O)CO 34a_100000211070_200012027429 [0,0,0,1,0,0|2,0,0]=3 1680 B15R1.1115 O=C(CN[C@@H]1CCOC1)NCC(O)CO 2230a_200015188469_200012027429 [0,0,0,1,0,0|3,0,0]=4 1681 B15R1.1115 O=C(CN[C@H]1CCOC1)NCC(O)CO 2230a_100015188467_200012027429 [0,0,0,1,0,0|3,0,0]=4 1682 B15R1.1115 O=C(CN[C@H]1CCOC1)NCC(O)CO 34a_100015188467_200012027429 [0,0,0,1,0,0|3,0,0]=4 1683 B15R1.1115 O=C(COC1CCCC1)NCC(O)CO 34a_100000210269_200012027429 [0,0,0,1,0,0|2,0,0]=3 1684 B15R1.1115 O=C(COC1CCCC1)NCC(O)CO 7a_100000210269_200012027429 [0,0,0,1,0,0|2,0,0]=3 1685 B15R1.1115 O=C(COC1CCCC1)NC[C@@H](F)CO 240690a_100015665980_100000741352 [0,0,0,1,0,0|3,0,0]=4 1686 B15R1.1115 O=C(COC1CCCC1)NC[C@@H](F)CO 527a_100015665980_100000741352 [0,0,0,1,0,0|3,0,0]=4 1687 B15R1.1115 O=C(COC1CCCC1)NC[C@H](O)CO 240690a_100020644852_100000741352 [0,0,0,1,0,0|2,0,0]=3 1688 B15R1.1115 O=C(COC1CCCC1)NC[C@H](O)CO 527a_100020644852_100000741352 [0,0,0,1,0,0|2,0,0]=3 1689 B15R1.1115 O=C(COC1CCCO1)NCC(O)CO 34a_100000085407_200012027429 [0,0,0,1,0,0|3,0,0]=4 1690 B15R1.1115 O=C(COC1CCSC1)NCC(O)CO 7a_100011232664_200012027429 [0,0,0,1,0,0|3,0,0]=4 1691 B15R1.1115 O=C(CO[C@H]1CCOC1)NCC(O)CO 34a_100000717292_200012027429 [0,0,0,1,0,0|3,0,0]=4 1692 B15R1.1115 O=C(CSC1CCCC1)NCC(O)CO 62a_100011217020_200012027429 [0,0,0,1,0,0|2,0,0]=3 1693 B15R1.1115 O=C(CSC1CCCC1)NCC(O)CO 62a_200012027429_100000179811 [0,0,0,1,0,0|2,0,0]=3 1694 B15R1.1115 O=C(CSC1CCOC1)NCC(O)CO 62a_200012027429_100000690089 [0,0,0,1,0,0|3,0,0]=4 1695 B15R1.1115 O=C(NCC1CCCC1)NC[C@@H](F)CO 2708a_100000737975_100015665980 [0,0,0,1,0,0|3,0,0]=4 1696 B15R1.1115 O=C(NCC1CCCC1)NC[C@@H](F)CO 273464a_100000737975_100015665980 [0,0,0,1,0,0|3,0,0]=4 1697 B15R1.1115 O=C(NCC1CCCC1)NC[C@@H](F)CO 273464a_100015665980_100000737975 [0,0,0,1,0,0|3,0,0]=4 1698 B15R1.1115 O=C(NCC1CCCC1)NC[C@@H](F)CO 512a_100000737975_100015665980 [0,0,0,1,0,0|3,0,0]=4 1699 B15R1.1115 O=C(NCC1CCCC1)NC[C@@H](F)CO 512a_100015665980_100000737975 [0,0,0,1,0,0|3,0,0]=4 1700 B15R1.1115 O=C(NCC1CCCC1)NC[C@H](O)CO 2708a_100000737975_100020644852 [0,0,0,1,0,0|2,0,0]=3 1701 B15R1.1115 O=C(NCC1CCCC1)NC[C@H](O)CO 273464a_100000737975_100020644852 [0,0,0,1,0,0|2,0,0]=3 1702 B15R1.1115 O=C(NCC1CCCC1)NC[C@H](O)CO 273464a_100020644852_100000737975 [0,0,0,1,0,0|2,0,0]=3 1703 B15R1.1115 O=C(NCC1CCOC1)NC[C@H](O)CO 2708a_100000737293_100020644852 [0,0,0,1,0,0|3,0,0]=4 1704 B15R1.1115 O=C(NCC1CCOC1)NC[C@H](O)CO 273464a_100000737293_100020644852 [0,0,0,1,0,0|3,0,0]=4 1705 B15R1.1115 O=C(NCC1CCOC1)NC[C@H](O)CO 273464a_100020644852_100000737293 [0,0,0,1,0,0|3,0,0]=4 1706 B15R1.1115 O=C(NC[C@H](O)CO)NC[C@@H]1CCCO1 2708a_100020590478_100020644852 [0,0,0,1,0,0|3,0,0]=4 1707 B15R1.1115 O=C(NC[C@H](O)CO)NC[C@@H]1CCCO1 273464a_100020590478_100020644852 [0,0,0,1,0,0|3,0,0]=4 1708 B15R1.1115 O=C(NC[C@H](O)CO)NC[C@@H]1CCCO1 273464a_100020644852_100020590478 [0,0,0,1,0,0|3,0,0]=4 1709 B15R1.4619 CCC(O)CCC(=O)N1CCCC1CC 1626a_100000754278_203496584001 [0,0,0,1,0,0|3,0,0]=4 1710 B15R1.4619 CCC(O)CCC(=O)N1CCCC1CC 240690a_100000754278_203496584001 [0,0,0,1,0,0|3,0,0]=4 1711 B15R1.4619 CCC(O)CNC(=O)C1CCCN1CC 240690a_100011218483_106256033941 [0,0,0,1,0,0|3,0,0]=4 1712 B15R1.4619 CCC(O)CNC(=O)C1CCCN1CC 527a_100011218483_106256033941 [0,0,0,1,0,0|3,0,0]=4 1713 B15R1.4619 CCC(O)CNC(=O)N1CCCC1CC 273464a_100011218483_100000754278 [0,0,0,1,0,0|3,0,0]=4 1714 B15R1.4619 CCC1CCCN1C(=O)NCC(C)CO 273464a_100000744482_100000754278 [0,0,0,1,0,0|3,0,0]=4 1715 B15R1.4619 CCC1CCCN1C(=O)NC[C@@H](F)CO 273464a_100015665980_100000754278 [0,0,0,1,0,0|3,0,0]=4 1716 B15R1.4619 CCC1CCCN1C(=O)NC[C@H](O)CO 273464a_100020644852_100000754278 [0,0,0,1,0,0|2,0,0]=3 1717 B15R1.4619 CCN1CCCC1C(=O)NCC(C)CO 240690a_100000744482_106256033941 [0,0,0,1,0,0|3,0,0]=4 1718 B15R1.4619 CCN1CCCC1C(=O)NCC(C)CO 527a_100000744482_106256033941 [0,0,0,1,0,0|3,0,0]=4 1719 B15R1.4619 CCN1CCCC1C(=O)NC[C@@H](F)CO 240690a_100015665980_106256033941 [0,0,0,1,0,0|3,0,0]=4 1720 B15R1.4619 CCN1CCCC1C(=O)NC[C@@H](F)CO 527a_100015665980_106256033941 [0,0,0,1,0,0|3,0,0]=4 1721 B15R1.4619 CCN1CCCC1C(=O)NC[C@H](O)CO 240690a_100020644852_106256033941 [0,0,0,1,0,0|2,0,0]=3 1722 B15R1.4619 CCN1CCCC1C(=O)NC[C@H](O)CO 527a_100020644852_106256033941 [0,0,0,1,0,0|2,0,0]=3 1723 B15R1.4619 O=C(NC[C@H](O)CO)N1CCC[C@@H]1CO 273464a_100020644852_100000745186 [0,0,0,1,0,0|3,0,0]=4 1724 B15R1.5815 CC(CO)CNC(=O)C1CCCCC1C 240690a_100000744482_100011215568 [0,0,0,1,0,0|2,0,0]=3 1725 B15R1.5815 CC(CO)CNC(=O)C1CCCCC1C 527a_100000744482_100011215568 [0,0,0,1,0,0|2,0,0]=3 1726 B15R1.5815 CC(CO)CNC(=O)N1CCCCC1C 273464a_100000744482_100000211376 [0,0,0,1,0,0|3,0,0]=4 1727 B15R1.5815 CC(CO)CNC(=O)[C@H]1CCCCN1C 240690a_100000744482_100000767060 [0,0,0,1,0,0|3,0,0]=4 1728 B15R1.5815 CC(CO)CNC(=O)[C@H]1CCCCN1C 527a_100000744482_100000767060 [0,0,0,1,0,0|3,0,0]=4 1729 B15R1.5815 CC1CCCCC1C(=O)NC[C@@H](F)CO 240690a_100015665980_100011215568 [0,0,0,1,0,0|2,0,0]=3 1730 B15R1.5815 CC1CCCCC1C(=O)NC[C@@H](F)CO 527a_100015665980_100011215568 [0,0,0,1,0,0|2,0,0]=3 1731 B15R1.5815 CC1CCCCC1C(=O)NC[C@H](O)CO 240690a_100020644852_100011215568 [0,0,0,1,0,0|1,0,0]=2 1732 B15R1.5815 CC1CCCCC1C(=O)NC[C@H](O)CO 527a_100020644852_100011215568 [0,0,0,1,0,0|1,0,0]=2 1733 B15R1.5815 CC1CCCCN1C(=O)NC[C@@H](F)CO 273464a_100015665980_100000211376 [0,0,0,1,0,0|3,0,0]=4 1734 B15R1.5815 CC1CCCCN1C(=O)NC[C@H](O)CO 273464a_100020644852_100000211376 [0,0,0,1,0,0|2,0,0]=3 1735 B15R1.5815 CCC(C)CNC(=O)C1CCCCC1C 11a_100020588543_100011215568 [0,0,0,1,0,0|3,0,0]=4 1736 B15R1.5815 CCC(C)CNC(=O)C1CCCCC1C 1626a_100020588543_100011215568 [0,0,0,1,0,0|3,0,0]=4 1737 B15R1.5815 CCC(C)CNC(=O)C1CCCCC1C 240690a_100020588543_100011215568 [0,0,0,1,0,0|3,0,0]=4 1738 B15R1.5815 CCC(C)CNC(=O)C1CCCCC1C 527a_100020588543_100011215568 [0,0,0,1,0,0|3,0,0]=4 1739 B15R1.5815 CCC(O)CCC(=O)N1CCCCC1C 1626a_100000211376_203496584001 [0,0,0,1,0,0|3,0,0]=4 1740 B15R1.5815 CCC(O)CCC(=O)N1CCCCC1C 240690a_100000211376_203496584001 [0,0,0,1,0,0|3,0,0]=4 1741 B15R1.5815 CCC(O)CNC(=O)C1CCCCC1C 11a_100011218483_100011215568 [0,0,0,1,0,0|2,0,0]=3 1742 B15R1.5815 CCC(O)CNC(=O)C1CCCCC1C 240690a_100011218483_100011215568 [0,0,0,1,0,0|2,0,0]=3 1743 B15R1.5815 CCC(O)CNC(=O)C1CCCCC1C 527a_100011218483_100011215568 [0,0,0,1,0,0|2,0,0]=3 1744 B15R1.5815 CCC(O)CNC(=O)N1CCCCC1C 273464a_100011218483_100000211376 [0,0,0,1,0,0|3,0,0]=4 1745 B15R1.5815 CCC(O)CNC(=O)[C@H]1CCCCN1C 11a_100011218483_100000767060 [0,0,0,1,0,0|3,0,0]=4 1746 B15R1.5815 CCC(O)CNC(=O)[C@H]1CCCCN1C 240690a_100011218483_100000767060 [0,0,0,1,0,0|3,0,0]=4 1747 B15R1.5815 CCC(O)CNC(=O)[C@H]1CCCCN1C 527a_100011218483_100000767060 [0,0,0,1,0,0|3,0,0]=4 1748 B15R1.5815 CN1CCCC[C@@H]1C(=O)NC[C@@H](F)CO 240690a_100015665980_100000767060 [0,0,0,1,0,0|3,0,0]=4 1749 B15R1.5815 CN1CCCC[C@@H]1C(=O)NC[C@@H](F)CO 527a_100015665980_100000767060 [0,0,0,1,0,0|3,0,0]=4 1750 B15R1.5815 CN1CCCC[C@@H]1C(=O)NC[C@H](O)CO 240690a_100020644852_100000767060 [0,0,0,1,0,0|2,0,0]=3 1751 B15R1.5815 CN1CCCC[C@@H]1C(=O)NC[C@H](O)CO 527a_100020644852_100000767060 [0,0,0,1,0,0|2,0,0]=3 1752 B15R1.5815 C[C@H]1COCCN1C(=O)NC[C@H](O)CO 273464a_100020644852_100009815349 [0,0,0,1,0,0|3,0,0]=4 1753 B15R1.5820 CC1SCCN1CC(=O)NCC(O)CO 2230a_200011216479_200012027429 [0,0,0,1,0,0|3,0,0]=4 1754 B15R1.5820 CC1SCCN1CC(=O)NCC(O)CO 269982a_200011216479_200012027429 [0,0,0,1,0,0|3,0,0]=4 1755 B15R1.5820 CC1SCCN1CC(=O)NCC(O)CO 34a_200011216479_200012027429 [0,0,0,1,0,0|3,0,0]=4 1756 B15R1.5820 C[C@@H]1CCCN1CC(=O)NCC(O)CO 2230a_100015189458_200012027429 [0,0,0,1,0,0|2,0,0]=3 1757 B15R1.5820 C[C@@H]1CCCN1CC(=O)NCC(O)CO 269982a_100015189458_200012027429 [0,0,0,1,0,0|2,0,0]=3 1758 B15R1.5820 C[C@@H]1CCCN1CC(=O)NCC(O)CO 34a_100015189458_200012027429 [0,0,0,1,0,0|2,0,0]=3 1759 B15R1.5820 C[C@H]1CCCN1CC(=O)NCC(O)CO 2230a_100020605311_200012027429 [0,0,0,1,0,0|2,0,0]=3 1760 B15R1.5820 C[C@H]1CCCN1CC(=O)NCC(O)CO 269982a_100020605311_200012027429 [0,0,0,1,0,0|2,0,0]=3 1761 B15R1.6934 COCC1CCN1C(=O)NC[C@H](O)CO 273464a_100020644852_100015195929 [0,0,0,1,0,0|3,0,0]=4 1762 B15R1.9590 CCCCCCCC(=O)NCC1CCC1 11a_100000738700_100000211969 [0,0,0,1,0,0|3,0,0]=4 1763 B15R1.9590 CCCCCCCC(=O)NCC1CCC1 1626a_100000738700_100000211969 [0,0,0,1,0,0|3,0,0]=4 1764 B15R1.9590 CCCCCCCC(=O)NCC1CCC1 240690a_100000738700_100000211969 [0,0,0,1,0,0|3,0,0]=4 1765 B15R1.9590 CCCCCCCC(=O)NCC1CCC1 527a_100000738700_100000211969 [0,0,0,1,0,0|3,0,0]=4 1766 B15R1.9590 CCCCCCCC(=O)NCC1COC1 11a_100015281925_100000211969 [0,0,0,1,0,0|2,0,0]=3 1767 B15R1.9590 CCCCCCCC(=O)NCC1COC1 1626a_100015281925_100000211969 [0,0,0,1,0,0|2,0,0]=3 1768 B15R1.9590 CCCCCCCC(=O)NCC1COC1 240690a_100015281925_100000211969 [0,0,0,1,0,0|2,0,0]=3 1769 B15R1.9590 CCCCCCCC(=O)NCC1COC1 527a_100015281925_100000211969 [0,0,0,1,0,0|2,0,0]=3 1770 B15R1.9590 CCCCCCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000211969 [0,0,0,1,0,0|2,0,0]=3 1771 B15R1.9590 CCCCCCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000211969 [0,0,0,1,0,0|2,0,0]=3 1772 B15R1.9590 CCCCCCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000211969 [0,0,0,1,0,0|2,0,0]=3 1773 B15R1.9590 CCCCCCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000211969 [0,0,0,1,0,0|2,0,0]=3 1774 B15R1.9590 CCCCCCCC(=O)NNC1COC1 22a_100015188821_100000211969 [0,0,0,1,0,0|3,0,0]=4 1775 B15R1.9590 CCCCCCCC(=O)OCN1CCC1 269982a_100000754969_100009852258 [0,0,0,1,0,0|3,0,0]=4 1776 B15R1.9590 CCCCCCCC(C)OCC1CCO1 34a_100000039022_200011218727 [0,0,0,1,0,0|2,0,1]=4 1777 B15R1.9590 CCCCCCCC(C)OCC1CCO1 34a_200011215852_100000103362 [0,0,0,1,0,0|2,0,1]=4 1778 B15R1.9590 CCCCCCCC(C)OCC1CCO1 7a_200011215852_100000103362 [0,0,0,1,0,0|2,0,1]=4 1779 B15R1.9590 CCCCCCCC(C)OCC1COC1 34a_100000060846_200011218727 [0,0,0,1,0,0|2,0,1]=4 1780 B15R1.9590 CCCCCCCC(C)OCC1COC1 34a_200011215852_100010264016 [0,0,0,1,0,0|2,0,1]=4 1781 B15R1.9590 CCCCCCCC(C)OCC1COC1 7a_200011215852_100010264016 [0,0,0,1,0,0|2,0,1]=4 1782 B15R1.9590 CCCCCCNC(=O)NCC1COC1 2708a_100000210581_100015281925 [0,0,0,1,0,0|3,0,0]=4 1783 B15R1.9590 CCCCCCNC(=O)NCC1COC1 2708a_100015281925_100000210581 [0,0,0,1,0,0|3,0,0]=4 1784 B15R1.9590 CCCCCCNC(=O)NCC1COC1 273464a_100000210581_100015281925 [0,0,0,1,0,0|3,0,0]=4 1785 B15R1.9590 CCCCCCNC(=O)NCC1COC1 273464a_100015281925_100000210581 [0,0,0,1,0,0|3,0,0]=4 1786 B15R1.9590 CCCCCCNC(=O)NCC1COC1 512a_100000210581_100015281925 [0,0,0,1,0,0|3,0,0]=4 1787 B15R1.9590 CCCCCCNC(=O)NCC1COC1 512a_100015281925_100000210581 [0,0,0,1,0,0|3,0,0]=4 1788 B15R1.9590 CCCCCCNC(=O)NC[C@@H]1CCO1 2708a_100000210581_100020831831 [0,0,0,1,0,0|3,0,0]=4 1789 B15R1.9590 CCCCCCNC(=O)NC[C@@H]1CCO1 2708a_100020831831_100000210581 [0,0,0,1,0,0|3,0,0]=4 1790 B15R1.9590 CCCCCCNC(=O)NC[C@@H]1CCO1 273464a_100000210581_100020831831 [0,0,0,1,0,0|3,0,0]=4 1791 B15R1.9590 CCCCCCNC(=O)NC[C@@H]1CCO1 273464a_100020831831_100000210581 [0,0,0,1,0,0|3,0,0]=4 1792 B15R1.9590 CCCCCCNC(=O)NC[C@@H]1CCO1 512a_100000210581_100020831831 [0,0,0,1,0,0|3,0,0]=4 1793 B15R1.9590 CCCCCCNC(=O)NC[C@@H]1CCO1 512a_100020831831_100000210581 [0,0,0,1,0,0|3,0,0]=4 1794 B15R1.9590 COCCCCCC(=O)NCC1COC1 11a_100015281925_100011935119 [0,0,0,1,0,0|3,0,0]=4 1795 B15R1.9590 COCCCCCC(=O)NCC1COC1 1626a_100015281925_100011935119 [0,0,0,1,0,0|3,0,0]=4 1796 B15R1.9590 COCCCCCC(=O)NCC1COC1 240690a_100015281925_100011935119 [0,0,0,1,0,0|3,0,0]=4 1797 B15R1.9590 COCCCCCC(=O)NCC1COC1 527a_100015281925_100011935119 [0,0,0,1,0,0|3,0,0]=4 1798 B15R1.9590 COCCCCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100011935119 [0,0,0,1,0,0|3,0,0]=4 1799 B15R1.9590 COCCCCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100011935119 [0,0,0,1,0,0|3,0,0]=4 1800 B15R1.9590 COCCCCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100011935119 [0,0,0,1,0,0|3,0,0]=4 1801 B15R1.9590 COCCCCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100011935119 [0,0,0,1,0,0|3,0,0]=4 1802 B15R1.9590 O=C(CCCCCCO)NCC1COC1 240690a_100015281925_100011996774 [0,0,0,1,0,0|3,0,0]=4 1803 B15R1.9590 O=C(CCCCCCO)NC[C@@H]1CCO1 240690a_100020831831_100011996774 [0,0,0,1,0,0|3,0,0]=4 1804 B15R1.12024 CCCCCCCC(=O)NCC1(CC1)C 11a_100000766693_100000211969 [0,0,0,1,0,0|3,0,0]=4 1805 B15R1.12024 CCCCCCCC(=O)NCC1(CC1)C 1626a_100000766693_100000211969 [0,0,0,1,0,0|3,0,0]=4 1806 B15R1.12024 CCCCCCCC(=O)NCC1(CC1)C 240690a_100000766693_100000211969 [0,0,0,1,0,0|3,0,0]=4 1807 B15R1.12024 CCCCCCCC(=O)NCC1(CC1)C 527a_100000766693_100000211969 [0,0,0,1,0,0|3,0,0]=4 1808 B15R1.12024 CCCCCCCC(=O)NCC1(CC1)O 11a_100011936951_100000211969 [0,0,0,1,0,0|2,0,0]=3 1809 B15R1.12024 CCCCCCCC(=O)NCC1(CC1)O 240690a_100011936951_100000211969 [0,0,0,1,0,0|2,0,0]=3 1810 B15R1.12024 CCCCCCCC(=O)NCC1(CC1)O 527a_100011936951_100000211969 [0,0,0,1,0,0|2,0,0]=3 1811 B15R1.12024 CCCCCCCC(C)OCC1(CO1)C 34a_200011215852_100000760498 [0,0,0,1,0,0|2,0,1]=4 1812 B15R1.12024 CCCCCCNC(=O)NCC1(CC1)O 2708a_100000210581_100011936951 [0,0,0,1,0,0|3,0,0]=4 1813 B15R1.12024 CCCCCCNC(=O)NCC1(CC1)O 2708a_100011936951_100000210581 [0,0,0,1,0,0|3,0,0]=4 1814 B15R1.12024 CCCCCCNC(=O)NCC1(CC1)O 273464a_100000210581_100011936951 [0,0,0,1,0,0|3,0,0]=4 1815 B15R1.12024 CCCCCCNC(=O)NCC1(CC1)O 512a_100000210581_100011936951 [0,0,0,1,0,0|3,0,0]=4 1816 B15R1.12024 CCCCCCNC(=O)NCC1(CC1)O 512a_100011936951_100000210581 [0,0,0,1,0,0|3,0,0]=4 1817 B15R1.12024 COCCCCCC(=O)NCC1(CC1)O 11a_100011936951_100011935119 [0,0,0,1,0,0|3,0,0]=4 1818 B15R1.12024 COCCCCCC(=O)NCC1(CC1)O 240690a_100011936951_100011935119 [0,0,0,1,0,0|3,0,0]=4 1819 B15R1.12024 COCCCCCC(=O)NCC1(CC1)O 527a_100011936951_100011935119 [0,0,0,1,0,0|3,0,0]=4 1820 B15R1.12024 O=C(CCCCCCO)NCC1(CC1)O 240690a_100011936951_100011996774 [0,0,0,1,0,0|3,0,0]=4 1821 B15R1.12032 CCCCCCCN1CC[C@H]([C@H](C1)O)O 2230a_100000690696_100000210681 [0,0,0,1,0,0|3,0,0]=4 1822 B15R1.12032 CCCCCCCN1CC[C@H]([C@H](C1)O)O 269982a_100000690696_100000210681 [0,0,0,1,0,0|3,0,0]=4 1823 B15R1.12446 CC1CC1COCC(=O)NCC(O)CO 34a_100000744939_200012027429 [0,0,0,1,0,0|2,0,0]=3 1824 B15R1.12446 CC1CC1COCC(=O)NCC(O)CO 7a_100000744939_200012027429 [0,0,0,1,0,0|2,0,0]=3 1825 B15R1.12447 O=C(CNCC1CCC1)NCC(O)CO 2230a_100000738700_200012027429 [0,0,0,1,0,0|2,0,0]=3 1826 B15R1.12447 O=C(CNCC1CCC1)NCC(O)CO 34a_100000738700_200012027429 [0,0,0,1,0,0|2,0,0]=3 1827 B15R1.12447 O=C(CNCC1COC1)NCC(O)CO 2230a_100015281925_200012027429 [0,0,0,1,0,0|3,0,0]=4 1828 B15R1.12447 O=C(CNCC1COC1)NCC(O)CO 34a_100015281925_200012027429 [0,0,0,1,0,0|3,0,0]=4 1829 B15R1.12447 O=C(CNC[C@@H]1CCO1)NCC(O)CO 2230a_100020831831_200012027429 [0,0,0,1,0,0|3,0,0]=4 1830 B15R1.12447 O=C(CNC[C@@H]1CCO1)NCC(O)CO 34a_100020831831_200012027429 [0,0,0,1,0,0|3,0,0]=4 1831 B15R1.12447 O=C(COCC1CCC1)NCC(O)CO 34a_100000760304_200012027429 [0,0,0,1,0,0|2,0,0]=3 1832 B15R1.12447 O=C(COCC1CCO1)NCC(O)CO 34a_100000039022_200012027429 [0,0,0,1,0,0|3,0,0]=4 1833 B15R1.12447 O=C(COCC1CNC1)NCC(O)CO 34a_100016987283_200012027429 [0,0,0,1,0,0|3,0,0]=4 1834 B15R1.12447 O=C(COCC1COC1)NCC(O)CO 34a_100000060846_200012027429 [0,0,0,1,0,0|3,0,0]=4 1835 B15R1.12447 O=C(CSCC1CCC1)NCC(O)CO 62a_100000763275_200012027429 [0,0,0,1,0,0|2,0,0]=3 1836 B15R1.12447 O=C(CSCC1CCC1)NCC(O)CO 62a_200012027429_100000763275 [0,0,0,1,0,0|2,0,0]=3 1837 B15R1.12447 O=C(CSCC1CCO1)NCC(O)CO 62a_100000103362_200012027429 [0,0,0,1,0,0|3,0,0]=4 1838 B15R1.12447 O=C(CSCC1CCO1)NCC(O)CO 62a_200012027429_100000103362 [0,0,0,1,0,0|3,0,0]=4 1839 B15R1.12447 O=C(CSCC1COC1)NCC(O)CO 62a_100010264016_200012027429 [0,0,0,1,0,0|3,0,0]=4 1840 B15R1.12447 O=C(CSCC1COC1)NCC(O)CO 62a_200012027429_100010264016 [0,0,0,1,0,0|3,0,0]=4 1841 B15R1.12447 O=C(NCCN1CCC1)NC[C@H](O)CO 2708a_100000691440_100020644852 [0,0,0,1,0,0|3,0,0]=4 1842 B15R1.12447 O=C(NCCN1CCC1)NC[C@H](O)CO 273464a_100000691440_100020644852 [0,0,0,1,0,0|3,0,0]=4 1843 B15R1.12447 O=C(NCCN1CCC1)NC[C@H](O)CO 273464a_100020644852_100000691440 [0,0,0,1,0,0|3,0,0]=4 1844 B15R1.12448 O=C(CNCCC1CC1)NCC(O)CO 34a_100000764129_200012027429 [0,0,0,1,0,0|2,0,0]=3 1845 B15R1.12448 O=C(COCCC1CC1)NCC(O)CO 34a_100000754188_200012027429 [0,0,0,1,0,0|2,0,0]=3 1846 B15R1.12448 O=C(COCCC1CC1)NCC(O)CO 7a_100000754188_200012027429 [0,0,0,1,0,0|2,0,0]=3 1847 B15R1.12448 O=C(COCC[C@@H]1CO1)NCC(O)CO 34a_100009820653_200012027429 [0,0,0,1,0,0|3,0,0]=4 1848 B15R1.12448 O=C(CSCCC1CC1)NCC(O)CO 62a_100000764125_200012027429 [0,0,0,1,0,0|2,0,0]=3 1849 B15R1.12448 O=C(CSCCC1CC1)NCC(O)CO 62a_200012027429_100000764125 [0,0,0,1,0,0|2,0,0]=3 1850 B15R1.12448 O=C(CSCCC1CO1)NCC(O)CO 62a_100000732470_200012027429 [0,0,0,1,0,0|3,0,0]=4 1851 B15R1.12448 O=C(CSCCC1CO1)NCC(O)CO 62a_200012027429_100000732470 [0,0,0,1,0,0|3,0,0]=4 1852 B15R1.23624 CC(CO)CNC(=O)C1CCCCCC1 240690a_100000744482_100000749507 [0,0,0,1,0,0|2,0,0]=3 1853 B15R1.23624 CC(CO)CNC(=O)C1CCCCCC1 527a_100000744482_100000749507 [0,0,0,1,0,0|2,0,0]=3 1854 B15R1.23624 CC(CO)CNC(=O)N1CCCCCC1 273464a_100000744482_100000185865 [0,0,0,1,0,0|3,0,0]=4 1855 B15R1.23624 CCC(C)CCC(=O)C1CCCCCC1 1458a_100000701222_100011217769 [0,0,0,1,0,0|3,0,0]=4 1856 B15R1.23624 CCC(C)CNC(=O)C1CCCCCC1 11a_100020588543_100000749507 [0,0,0,1,0,0|3,0,0]=4 1857 B15R1.23624 CCC(C)CNC(=O)C1CCCCCC1 1626a_100020588543_100000749507 [0,0,0,1,0,0|3,0,0]=4 1858 B15R1.23624 CCC(C)CNC(=O)C1CCCCCC1 240690a_100020588543_100000749507 [0,0,0,1,0,0|3,0,0]=4 1859 B15R1.23624 CCC(C)CNC(=O)C1CCCCCC1 527a_100020588543_100000749507 [0,0,0,1,0,0|3,0,0]=4 1860 B15R1.23624 CCC(O)CCC(=O)N1CCCCCC1 1626a_100000185865_203496584001 [0,0,0,1,0,0|3,0,0]=4 1861 B15R1.23624 CCC(O)CCC(=O)N1CCCCCC1 240690a_100000185865_203496584001 [0,0,0,1,0,0|3,0,0]=4 1862 B15R1.23624 CCC(O)CNC(=O)C1CCCCCC1 11a_100011218483_100000749507 [0,0,0,1,0,0|2,0,0]=3 1863 B15R1.23624 CCC(O)CNC(=O)C1CCCCCC1 240690a_100011218483_100000749507 [0,0,0,1,0,0|2,0,0]=3 1864 B15R1.23624 CCC(O)CNC(=O)C1CCCCCC1 527a_100011218483_100000749507 [0,0,0,1,0,0|2,0,0]=3 1865 B15R1.23624 CCC(O)CNC(=O)N1CCCCCC1 273464a_100011218483_100000185865 [0,0,0,1,0,0|3,0,0]=4 1866 B15R1.23624 O=C(NC[C@@H](F)CO)C1CCCCCC1 240690a_100015665980_100000749507 [0,0,0,1,0,0|2,0,0]=3 1867 B15R1.23624 O=C(NC[C@@H](F)CO)C1CCCCCC1 527a_100015665980_100000749507 [0,0,0,1,0,0|2,0,0]=3 1868 B15R1.23624 O=C(NC[C@@H](F)CO)N1CCCCCC1 273464a_100015665980_100000185865 [0,0,0,1,0,0|3,0,0]=4 1869 B15R1.23624 O=C(NC[C@H](O)CO)C1CCC=CCC1 240690a_100020644852_100000048548 [0,0,0,1,0,0|1,0,2]=4 1870 B15R1.23624 O=C(NC[C@H](O)CO)C1CCC=CCC1 527a_100020644852_100000048548 [0,0,0,1,0,0|1,0,2]=4 1871 B15R1.23624 O=C(NC[C@H](O)CO)C1CCCCCC1 240690a_100020644852_100000749507 [0,0,0,1,0,0|1,0,0]=2 1872 B15R1.23624 O=C(NC[C@H](O)CO)C1CCCCCC1 527a_100020644852_100000749507 [0,0,0,1,0,0|1,0,0]=2 1873 B15R1.23624 O=C(NC[C@H](O)CO)N1CCCCCC1 273464a_100020644852_100000185865 [0,0,0,1,0,0|2,0,0]=3 1874 B15R1.23624 O=C(NC[C@H](O)CO)N1CCCOCC1 273464a_100020644852_100000685342 [0,0,0,1,0,0|3,0,0]=4 1875 B15R1.23881 CCCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 11a_206633788156_100000211969 [0,0,0,1,0,0|2,0,0]=3 1876 B15R1.23881 CCCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 240690a_206633788156_100000211969 [0,0,0,1,0,0|2,0,0]=3 1877 B15R1.23881 CCCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 527a_206633788156_100000211969 [0,0,0,1,0,0|2,0,0]=3 1878 B15R1.23881 CCCCCCNC(=O)N1C[C@@H]([C@@H]1C)O 2708a_100000210581_206633788156 [0,0,0,1,0,0|3,0,0]=4 1879 B15R1.23881 CCCCCCNC(=O)N1C[C@@H]([C@@H]1C)O 273464a_100000210581_206633788156 [0,0,0,1,0,0|3,0,0]=4 1880 B15R1.23881 COCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 11a_206633788156_100011935119 [0,0,0,1,0,0|3,0,0]=4 1881 B15R1.23881 COCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 240690a_206633788156_100011935119 [0,0,0,1,0,0|3,0,0]=4 1882 B15R1.23881 COCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 527a_206633788156_100011935119 [0,0,0,1,0,0|3,0,0]=4 1883 B15R1.23881 C[C@H]1[C@H](CN1C(=O)CCCCCCO)O 240690a_206633788156_100011996774 [0,0,0,1,0,0|3,0,0]=4 1884 B15R1.23883 CCCCCCCC(=O)C1CC(C1)CO 1458a_206645079618_100000210614 [0,0,0,1,0,0|2,0,0]=3 1885 B15R1.23883 CCCCCCCC(=O)N1CC(C1)CC 11a_100015205115_100000211969 [0,0,0,1,0,0|3,0,0]=4 1886 B15R1.23883 CCCCCCCC(=O)N1CC(C1)CC 1626a_100015205115_100000211969 [0,0,0,1,0,0|3,0,0]=4 1887 B15R1.23883 CCCCCCCC(=O)N1CC(C1)CC 240690a_100015205115_100000211969 [0,0,0,1,0,0|3,0,0]=4 1888 B15R1.23883 CCCCCCCC(=O)N1CC(C1)CC 527a_100015205115_100000211969 [0,0,0,1,0,0|3,0,0]=4 1889 B15R1.23883 CCCCCCCC(=O)N1CC(C1)CF 11a_100010363649_100000211969 [0,0,0,1,0,0|3,0,0]=4 1890 B15R1.23883 CCCCCCCC(=O)N1CC(C1)CF 240690a_100010363649_100000211969 [0,0,0,1,0,0|3,0,0]=4 1891 B15R1.23883 CCCCCCCC(=O)N1CC(C1)CF 527a_100010363649_100000211969 [0,0,0,1,0,0|3,0,0]=4 1892 B15R1.23883 CCCCCCCC(=O)N1CC(C1)CO 240690a_100016987283_100000211969 [0,0,0,1,0,0|2,0,0]=3 1893 B15R1.23883 CCCCCCCC(=O)N1CC(C1)CO 527a_100016987283_100000211969 [0,0,0,1,0,0|2,0,0]=3 1894 B15R1.23883 CCCCCCNC(=O)C1CC(C1)CO 1626a_100000210581_206645079618 [0,0,0,1,0,0|3,0,0]=4 1895 B15R1.23883 CCCCCCNC(=O)N1CC(C1)CO 2708a_100000210581_100016987283 [0,0,0,1,0,0|3,0,0]=4 1896 B15R1.23883 CCCCCCNC(=O)N1CC(C1)CO 273464a_100000210581_100016987283 [0,0,0,1,0,0|3,0,0]=4 1897 B15R1.23883 CCCCOCCC(=O)C1CC(C1)CO 1458a_206645079618_100000743108 [0,0,0,1,0,0|3,0,0]=4 1898 B15R1.23883 COCCCCCC(=O)N1CC(C1)CO 240690a_100016987283_100011935119 [0,0,0,1,0,0|3,0,0]=4 1899 B15R1.23883 COCCCCCC(=O)N1CC(C1)CO 527a_100016987283_100011935119 [0,0,0,1,0,0|3,0,0]=4 1900 B15R1.23883 O=C(CCCCCCF)C1CC(C1)CO 1458a_206645079618_100015922095 [0,0,0,1,0,0|3,0,0]=4 1901 B15R1.23883 O=C(CCCCCCO)C1CC(C1)CO 1458a_206645079618_100000766143 [0,0,0,1,0,0|3,0,0]=4 1902 B15R1.23883 O=C(CCCCCCO)N1CC(C1)CO 240690a_100016987283_100011996774 [0,0,0,1,0,0|3,0,0]=4 1903 B13R0.274 C#CCCCCCC(=O)CC(O)CC 1458a_100000694772_100011218378 [0,0,0,0,1,0|1,0,2]=4 1904 B13R0.274 C#CCCCCCC(=O)CC(O)CC 1458a_100011667805_100012094781 [0,0,0,0,1,0|1,0,2]=4 1905 B13R0.274 C#CCCCCCC(=O)C[C@@H](C)CO 1458a_100000694772_100000059175 [0,0,0,0,1,0|1,0,2]=4 1906 B13R0.274 C=CC(C)CC(=O)CCCCCCC 1458a_100011934298_100000210614 [0,0,0,0,1,0|2,0,1]=4 1907 B13R0.274 C=CCCCCCC(=O)CC(O)CC 1458a_100011667805_100000700193 [0,0,0,0,1,0|1,0,2]=4 1908 B13R0.274 C=CCCCCCC(=O)CC(O)CC 1458a_100011934241_100011218378 [0,0,0,0,1,0|1,0,2]=4 1909 B13R0.274 C=CCCCCCC(=O)C[C@@H](C)CO 1458a_100011934241_100000059175 [0,0,0,0,1,0|1,0,2]=4 1910 B13R0.274 CCC(C)CC(=O)CCCCCCF 1458a_100000708755_100015922095 [0,0,0,0,1,0|3,0,0]=4 1911 B13R0.274 CCC(C)CC(=O)CCCCCCO 1458a_100000708755_100000766143 [0,0,0,0,1,0|3,0,0]=4 1912 B13R0.274 CCC(C)CC(=O)CCCCCCO 1458a_100011996774_100000748023 [0,0,0,0,1,0|3,0,0]=4 1913 B13R0.274 CCC(C)CC(=O)CCCCCOC 1458a_100011935119_100000748023 [0,0,0,0,1,0|3,0,0]=4 1914 B13R0.274 CCC(O)CC(=O)CCCCCC#N 1458a_100011667805_100009813376 [0,0,0,0,1,0|2,0,1]=4 1915 B13R0.274 CCC(O)CC(=O)CCCCCCF 1458a_100011667805_100015922095 [0,0,0,0,1,0|2,0,0]=3 1916 B13R0.274 CCC(O)CC(=O)CCCCCCO 1458a_100011667805_100000766143 [0,0,0,0,1,0|2,0,0]=3 1917 B13R0.274 CCC(O)CC(=O)CCCCCCO 1458a_100011996774_100011218378 [0,0,0,0,1,0|2,0,0]=3 1918 B13R0.274 CCC(O)CC(=O)CCCCCOC 1458a_100011935119_100011218378 [0,0,0,0,1,0|2,0,0]=3 1919 B13R0.274 CCC(O)CC(=O)CCOCCOC 1458a_100000745395_100011218378 [0,0,0,0,1,0|3,0,0]=4 1920 B13R0.274 CCC(O)CC(=O)CCOCCOC 1458a_100011667805_100000695917 [0,0,0,0,1,0|3,0,0]=4 1921 B13R0.274 CCC(O)CC(=O)NCCCCCO 240690a_100000762737_100011667805 [0,0,0,0,1,0|3,0,0]=4 1922 B13R0.274 CCCC/C=C/CC(=O)CC(O)CC 1458a_200016282684_100011218378 [0,0,0,0,1,0|1,0,2]=4 1923 B13R0.274 CCCC/C=C/CC(=O)C[C@@H](C)CO 1458a_200016282684_100000059175 [0,0,0,0,1,0|1,0,2]=4 1924 B13R0.274 CCCCCC#CC(=O)CC(O)CC 1458a_100011215388_100011218378 [0,0,0,0,1,0|1,0,2]=4 1925 B13R0.274 CCCCCC#CC(=O)C[C@@H](C)CO 1458a_100011215388_100000059175 [0,0,0,0,1,0|1,0,2]=4 1926 B13R0.274 CCCCCC=CC(=O)CC(O)CC 1458a_100016263427_100011218378 [0,0,0,0,1,0|1,0,2]=4 1927 B13R0.274 CCCCCC=CC(=O)C[C@@H](C)CO 1458a_100016263427_100000059175 [0,0,0,0,1,0|1,0,2]=4 1928 B13R0.274 CCCCCCCC(=O)CC(=O)CC 1458a_100000211969_100000747405 [0,0,0,0,1,0|1,0,2]=4 1929 B13R0.274 CCCCCCCC(=O)CC(C)CC 1458a_100000211969_100000748023 [0,0,0,0,1,0|2,0,0]=3 1930 B13R0.274 CCCCCCCC(=O)CC(C)CC 1458a_100000708755_100000210614 [0,0,0,0,1,0|2,0,0]=3 1931 B13R0.274 CCCCCCCC(=O)CC(O)CC 1458a_100000211969_100011218378 [0,0,0,0,1,0|1,0,0]=2 1932 B13R0.274 CCCCCCCC(=O)CC(O)CC 1458a_100011667805_100000210614 [0,0,0,0,1,0|1,0,0]=2 1933 B13R0.274 CCCCCCCC(=O)CN(C)CC 1458a_100116209913_100000210614 [0,0,0,0,1,0|3,0,0]=4 1934 B13R0.274 CCCCCCCC(=O)C[C@@H](C)CC 1458a_100000211969_100009816398 [0,0,0,0,1,0|2,0,0]=3 1935 B13R0.274 CCCCCCCC(=O)C[C@@H](C)CO 1458a_100000211969_100000059175 [0,0,0,0,1,0|1,0,0]=2 1936 B13R0.274 CCCCCCCC(=O)NC(C)CC 11a_100000209981_100000211969 [0,0,0,0,1,0|3,0,0]=4 1937 B13R0.274 CCCCCCCC(=O)NC(C)CC 1626a_100000209981_100000211969 [0,0,0,0,1,0|3,0,0]=4 1938 B13R0.274 CCCCCCCC(=O)NC(C)CC 240690a_100000209981_100000211969 [0,0,0,0,1,0|3,0,0]=4 1939 B13R0.274 CCCCCCCC(=O)NC(C)CC 527a_100000209981_100000211969 [0,0,0,0,1,0|3,0,0]=4 1940 B13R0.274 CCCCCCCC(=O)N[C@H](C)CF 11a_100102880703_100000211969 [0,0,0,0,1,0|3,0,0]=4 1941 B13R0.274 CCCCCCCC(=O)N[C@H](C)CF 1626a_100102880703_100000211969 [0,0,0,0,1,0|3,0,0]=4 1942 B13R0.274 CCCCCCCC(=O)N[C@H](C)CF 240690a_100102880703_100000211969 [0,0,0,0,1,0|3,0,0]=4 1943 B13R0.274 CCCCCCCC(=O)N[C@H](C)CF 527a_100102880703_100000211969 [0,0,0,0,1,0|3,0,0]=4 1944 B13R0.274 CCCCCCCC(=O)N[C@H](C)CO 240690a_100000737577_100000211969 [0,0,0,0,1,0|2,0,0]=3 1945 B13R0.274 CCCCCCCC(=O)N[C@H](C)CO 527a_100000737577_100000211969 [0,0,0,0,1,0|2,0,0]=3 1946 B13R0.274 CCCCCCCC(C)OC(C)CO 34a_200011215852_100012180447 [0,0,0,0,1,0|2,0,1]=4 1947 B13R0.274 CCCCCCCC(C)OC(C)CO 7a_200011215852_100012180447 [0,0,0,0,1,0|2,0,1]=4 1948 B13R0.274 CCCCCCCN(C)CC(O)CC 2230a_100000228206_100011218378 [0,0,0,0,1,0|3,0,0]=4 1949 B13R0.274 CCCCCCCN(C)CC(O)CC 269982a_100000228206_100011218378 [0,0,0,0,1,0|3,0,0]=4 1950 B13R0.274 CCCCCCCN(C)CC(O)CO 2230a_100000228206_100011219619 [0,0,0,0,1,0|2,0,0]=3 1951 B13R0.274 CCCCCCCN(C)CC(O)CO 2230a_100011216503_100000210681 [0,0,0,0,1,0|2,0,0]=3 1952 B13R0.274 CCCCCCCN(C)CC(O)CO 269982a_100011216503_100000210681 [0,0,0,0,1,0|2,0,0]=3 1953 B13R0.274 CCCCCCCN(C)C[C@@H](C)CO 2230a_100000228206_100000059175 [0,0,0,0,1,0|3,0,0]=4 1954 B13R0.274 CCCCCCCN(C)C[C@@H](C)CO 269982a_100000228206_100000059175 [0,0,0,0,1,0|3,0,0]=4 1955 B13R0.274 CCCCCCCN(C)C[C@@H](O)CF 2230a_100000228206_100015614560 [0,0,0,0,1,0|3,0,0]=4 1956 B13R0.274 CCCCCCCN(C)C[C@@H](O)CO 2230a_100000228206_100009815848 [0,0,0,0,1,0|2,0,0]=3 1957 B13R0.274 CCCCCCNC(=O)CC(=O)CO 1458a_100000210174_100000230325 [0,0,0,0,1,0|1,0,2]=4 1958 B13R0.274 CCCCCCNC(=O)CC(C)CC 11a_100000210581_100000708755 [0,0,0,0,1,0|3,0,0]=4 1959 B13R0.274 CCCCCCNC(=O)CC(C)CC 1626a_100000210581_100000708755 [0,0,0,0,1,0|3,0,0]=4 1960 B13R0.274 CCCCCCNC(=O)CC(C)CC 240690a_100000210581_100000708755 [0,0,0,0,1,0|3,0,0]=4 1961 B13R0.274 CCCCCCNC(=O)CC(C)CC 527a_100000210581_100000708755 [0,0,0,0,1,0|3,0,0]=4 1962 B13R0.274 CCCCCCNC(=O)CC(O)CC 1626a_100000210581_100011667805 [0,0,0,0,1,0|2,0,0]=3 1963 B13R0.274 CCCCCCNC(=O)CC(O)CC 240690a_100000210581_100011667805 [0,0,0,0,1,0|2,0,0]=3 1964 B13R0.274 CCCCCCNC(=O)N[C@H](C)CO 2708a_100000210581_100000737577 [0,0,0,0,1,0|3,0,0]=4 1965 B13R0.274 CCCCCCNC(=O)N[C@H](C)CO 273464a_100000737577_100000210581 [0,0,0,0,1,0|3,0,0]=4 1966 B13R0.274 CCCCCCNC(=O)N[C@H](C)CO 512a_100000210581_100000737577 [0,0,0,0,1,0|3,0,0]=4 1967 B13R0.274 CCCCCCNC(=O)N[C@H](C)CO 512a_100000737577_100000210581 [0,0,0,0,1,0|3,0,0]=4 1968 B13R0.274 CCCCCNNC(=O)CC(O)CC 22a_100000694160_100011667805 [0,0,0,0,1,0|3,0,0]=4 1969 B13R0.274 CCCCOCCC(=O)CC(C)CC 1458a_100000708755_100000743108 [0,0,0,0,1,0|3,0,0]=4 1970 B13R0.274 CCCCOCCC(=O)CC(O)CC 1458a_100011667805_100000743108 [0,0,0,0,1,0|2,0,0]=3 1971 B13R0.274 CCCCOCCN(C)CC(O)CO 2230a_100011216503_100000743108 [0,0,0,0,1,0|3,0,0]=4 1972 B13R0.274 CCCCOCCN(C)CC(O)CO 269982a_100011216503_100000743108 [0,0,0,0,1,0|3,0,0]=4 1973 B13R0.274 CCCOCCNC(=O)CC(O)CC 1626a_100161115042_100011667805 [0,0,0,0,1,0|3,0,0]=4 1974 B13R0.274 CCCOCCNC(=O)CC(O)CC 240690a_100161115042_100011667805 [0,0,0,0,1,0|3,0,0]=4 1975 B13R0.274 CCCSCCNC(=O)CC(O)CC 240690a_100020603323_100011667805 [0,0,0,0,1,0|3,0,0]=4 1976 B13R0.274 CCOCCCNC(=O)CC(O)CC 1626a_100000210961_100011667805 [0,0,0,0,1,0|3,0,0]=4 1977 B13R0.274 CCOCCCNC(=O)CC(O)CC 240690a_100000210961_100011667805 [0,0,0,0,1,0|3,0,0]=4 1978 B13R0.274 CC[C@H](C)CC(=O)CCCCCCO 1458a_100011996774_100009816398 [0,0,0,0,1,0|3,0,0]=4 1979 B13R0.274 CC[C@H](C)CC(=O)CCCCCOC 1458a_100011935119_100009816398 [0,0,0,0,1,0|3,0,0]=4 1980 B13R0.274 CN(CCCCCCF)CC(O)CO 2230a_100011216503_100015922095 [0,0,0,0,1,0|3,0,0]=4 1981 B13R0.274 CN(CCCCCCF)CC(O)CO 269982a_100011216503_100015922095 [0,0,0,0,1,0|3,0,0]=4 1982 B13R0.274 CN(CCCCCCO)CC(O)CO 2230a_100011216503_100000766143 [0,0,0,0,1,0|3,0,0]=4 1983 B13R0.274 CN(CCCCCCO)CC(O)CO 269982a_100011216503_100000766143 [0,0,0,0,1,0|3,0,0]=4 1984 B13R0.274 COCCCCCC(=O)C[C@@H](C)CO 1458a_100011935119_100000059175 [0,0,0,0,1,0|2,0,0]=3 1985 B13R0.274 COCCCCCC(=O)N[C@H](C)CO 240690a_100000737577_100011935119 [0,0,0,0,1,0|3,0,0]=4 1986 B13R0.274 COCCCCCC(=O)N[C@H](C)CO 527a_100000737577_100011935119 [0,0,0,0,1,0|3,0,0]=4 1987 B13R0.274 COCCOCCC(=O)C[C@@H](C)CO 1458a_100000745395_100000059175 [0,0,0,0,1,0|3,0,0]=4 1988 B13R0.274 C[C@@H](CO)CC(=O)CCCCCCO 1458a_100011996774_100000059175 [0,0,0,0,1,0|2,0,0]=3 1989 B13R0.274 C[C@H](CO)NC(=O)CCCCCCO 240690a_100000737577_100011996774 [0,0,0,0,1,0|3,0,0]=4 1990 B15R0.137 C#CC(C)NCOC(=O)CCCCCCC 2230a_100000707721_100009852258 [0,0,0,0,0,1|2,0,1]=4 1991 B15R0.137 C#CC(C)NCOC(=O)CCCCCCC 34a_100000707721_100009852258 [0,0,0,0,0,1|2,0,1]=4 1992 B15R0.137 C#CC(C)SCOC(=O)CCCCCCC 62a_200000035995_100009852258 [0,0,0,0,0,1|2,0,1]=4 1993 B15R0.137 C#C[C@@H](C)OCOC(=O)CCCCCCC 34a_100009815206_100009852258 [0,0,0,0,0,1|2,0,1]=4 1994 B15R0.137 C#C[C@@H](C)OCOC(=O)CCCCCCC 7a_100009815206_100009852258 [0,0,0,0,0,1|2,0,1]=4 1995 B15R0.137 C=CC(C)OCOC(=O)CCCCCCC 34a_100000695699_100009852258 [0,0,0,0,0,1|2,0,1]=4 1996 B15R0.137 C=CC(C)SCOC(=O)CCCCCCC 62a_100011215867_100009852258 [0,0,0,0,0,1|2,0,1]=4 1997 B15R0.137 CC(CO)CCNC(=O)CCCCCCO 240690a_106354213184_100011996774 [0,0,0,0,0,1|3,0,0]=4 1998 B15R0.137 CCC(O)CNNC(=O)CCCCCOC 22a_100015206393_100011935119 [0,0,0,0,0,1|3,0,0]=4 1999 B15R0.137 CCCCCCCC(=NNCC(O)CC)C 4a_100015206393_100000210596 [0,0,0,0,0,1|3,0,0]=4 2000 B15R0.137 CCCCCCCC(=O)NCCC(C)CC 11a_100020591266_100000211969 [0,0,0,0,0,1|3,0,0]=4 2001 B15R0.137 CCCCCCCC(=O)NCCC(C)CC 1626a_100020591266_100000211969 [0,0,0,0,0,1|3,0,0]=4 2002 B15R0.137 CCCCCCCC(=O)NCCC(C)CC 240690a_100020591266_100000211969 [0,0,0,0,0,1|3,0,0]=4 2003 B15R0.137 CCCCCCCC(=O)NCCC(C)CC 527a_100020591266_100000211969 [0,0,0,0,0,1|3,0,0]=4 2004 B15R0.137 CCCCCCCC(=O)NCCC(C)CO 240690a_106354213184_100000211969 [0,0,0,0,0,1|2,0,0]=3 2005 B15R0.137 CCCCCCCC(=O)NCCC(C)CO 527a_106354213184_100000211969 [0,0,0,0,0,1|2,0,0]=3 2006 B15R0.137 CCCCCCCC(=O)NN=CC(O)CO 4a_100000181853_100000033539 [0,0,0,0,0,1|1,0,1]=3 2007 B15R0.137 CCCCCCCC(=O)NNCC(O)CC 22a_100015206393_100000211969 [0,0,0,0,0,1|2,0,0]=3 2008 B15R0.137 CCCCCCCC(=O)OCNC(C)C#N 2230a_100000737613_100009852258 [0,0,0,0,0,1|2,0,1]=4 2009 B15R0.137 CCCCCCCC(=O)OCNC(C)CC 2230a_100000209981_100009852258 [0,0,0,0,0,1|2,0,0]=3 2010 B15R0.137 CCCCCCCC(=O)OCN[C@H](C)CO 2230a_100000737577_100009852258 [0,0,0,0,0,1|1,0,0]=2 2011 B15R0.137 CCCCCCCC(=O)OCOC(C)C#N 34a_100011218135_100009852258 [0,0,0,0,0,1|2,0,1]=4 2012 B15R0.137 CCCCCCCC(=O)OCOC(C)CC 7a_100000210228_100009852258 [0,0,0,0,0,1|2,0,0]=3 2013 B15R0.137 CCCCCCCC(=O)OCOC(C)CF 34a_100016041109_100009852258 [0,0,0,0,0,1|2,0,0]=3 2014 B15R0.137 CCCCCCCC(=O)OCOC(C)CF 7a_100016041109_100009852258 [0,0,0,0,0,1|2,0,0]=3 2015 B15R0.137 CCCCCCCC(=O)OCOC(C)CN 34a_100000210904_100009852258 [0,0,0,0,0,1|2,0,0]=3 2016 B15R0.137 CCCCCCCC(=O)OCSC(C)C#N 62a_100000703298_100009852258 [0,0,0,0,0,1|2,0,1]=4 2017 B15R0.137 CCCCCCCC(=O)OCSC(C)CC 62a_100000758301_100009852258 [0,0,0,0,0,1|2,0,0]=3 2018 B15R0.137 CCCCCCCC(=O)OCSC(C)CO 62a_100012180447_100009852258 [0,0,0,0,0,1|1,0,0]=2 2019 B15R0.137 CCCCCCCC(=O)OCSC(C)OC 62a_100009879195_100009852258 [0,0,0,0,0,1|3,0,0]=4 2020 B15R0.137 CCCCCCCC(=O)OCSC(F)C#N 62a_200000117898_100009852258 [0,0,0,0,0,1|2,0,1]=4 2021 B15R0.137 CCCCCCCC(=O)OCS[C@H](C)CO 62a_100016084084_100009852258 [0,0,0,0,0,1|1,0,0]=2 2022 B15R0.137 CCCCCCNC(=O)CNCC(C)CO 34a_100000744482_100000230325 [0,0,0,0,0,1|3,0,0]=4 2023 B15R0.137 CCCCCCNC(=O)CNCC(O)CC 2230a_100011218483_100000230325 [0,0,0,0,0,1|3,0,0]=4 2024 B15R0.137 CCCCCCNC(=O)CNC[C@@H](F)CO 34a_100015665980_100000230325 [0,0,0,0,0,1|3,0,0]=4 2025 B15R0.137 CCCCCCNC(=O)CNC[C@H](O)CO 2230a_100020644852_100000230325 [0,0,0,0,0,1|2,0,0]=3 2026 B15R0.137 CCCCCCNC(=O)COCC(C)CN 34a_100000744482_100000230325 [0,0,0,0,0,1|3,0,0]=4 2027 B15R0.137 CCCCCCNC(=O)COCC(Cl)CCl 34a_100000033668_100000230325 [0,0,0,0,0,1|3,0,0]=4 2028 B15R0.137 CCCCCCNC(=O)COC[C@@H](C)CC 7a_100009816381_100000230325 [0,0,0,0,0,1|3,0,0]=4 2029 B15R0.137 CCCCCCNC(=O)COC[C@H](F)CN 34a_100015665980_100000230325 [0,0,0,0,0,1|3,0,0]=4 2030 B15R0.137 CCCCCCNC(=O)CSCC(O)CC 62a_100000230325_100011218378 [0,0,0,0,0,1|2,1,0]=4 2031 B15R0.137 CCCCCCNC(=O)CSCC(O)CO 62a_100000230325_100011219619 [0,0,0,0,0,1|1,1,0]=3 2032 B15R0.137 CCCCCCNC(=O)CSC[C@@H](C)CO 62a_100000230325_100000059175 [0,0,0,0,0,1|2,1,0]=4 2033 B15R0.137 CCCCCCNC(=O)CSC[C@@H](O)CF 62a_100000230325_100015614560 [0,0,0,0,0,1|2,1,0]=4 2034 B15R0.137 CCCCCCNC(=O)CSC[C@@H](O)CO 62a_100000230325_100009815848 [0,0,0,0,0,1|1,1,0]=3 2035 B15R0.137 CCCCCCNC(=O)NCCC(C)CO 2708a_100000210581_106354213184 [0,0,0,0,0,1|3,0,0]=4 2036 B15R0.137 CCCCCCNC(=O)NCCC(C)CO 273464a_100000210581_106354213184 [0,0,0,0,0,1|3,0,0]=4 2037 B15R0.137 CCCCCCNC(=O)NCCC(C)CO 273464a_106354213184_100000210581 [0,0,0,0,0,1|3,0,0]=4 2038 B15R0.137 CCCCCCNC(=O)NCCC(C)CO 512a_100000210581_106354213184 [0,0,0,0,0,1|3,0,0]=4 2039 B15R0.137 CCCCCCNC(=O)NCCC(C)CO 512a_106354213184_100000210581 [0,0,0,0,0,1|3,0,0]=4 2040 B15R0.137 CCCCCCNC(=O)NNCC(O)CC 273464a_100000210581_100015206393 [0,0,0,0,0,1|3,0,0]=4 2041 B15R0.137 CCCCCCNC(=O)NNCC(O)CC 512a_100000210581_100015206393 [0,0,0,0,0,1|3,0,0]=4 2042 B15R0.137 CCCCCCNC(=O)NNCC(O)CC 512a_100015206393_100000210581 [0,0,0,0,0,1|3,0,0]=4 2043 B15R0.137 COCCCCCC(=O)NCCC(C)CO 240690a_106354213184_100011935119 [0,0,0,0,0,1|3,0,0]=4 2044 B15R0.137 COCCCCCC(=O)NCCC(C)CO 527a_106354213184_100011935119 [0,0,0,0,0,1|3,0,0]=4 2045 B12R0.5 CCCCCCCC=NNCCO 4a_100000210001_100000210592 [2,0,0,0,0,0|2,0,0]=4 2046 B12R0.5 CCCCCCCCNCCCO 2230a_100000229939_100000230001 [2,0,0,0,0,0|1,0,1]=4 2047 B12R0.5 CCCCCCCCNCCCO 34a_100000229939_100000230001 [2,0,0,0,0,0|1,0,1]=4 2048 B12R0.5 CCCCCCCCOCCCBr 34a_100011217188_100000210759 [2,0,0,0,0,0|1,0,1]=4 2049 B12R0.5 CCCCCCCCOCCCC 34a_100000210227_100000210759 [2,0,0,0,0,0|1,0,1]=4 2050 B12R0.5 CCCCCCCCOCCCC 34a_100000210232_100000210210 [2,0,0,0,0,0|1,0,1]=4 2051 B12R0.5 CCCCCCCCOCCCC 7a_100000210227_100000210759 [2,0,0,0,0,0|1,0,1]=4 2052 B12R0.5 CCCCCCCCOCCCC 7a_100000210232_100000210211 [2,0,0,0,0,0|1,0,1]=4 2053 B12R0.5 CCCCCCCCOCCCCl 34a_100000230001_100000210759 [2,0,0,0,0,0|1,0,1]=4 2054 B12R0.5 CCCCCCCCOCCCF 34a_100000210232_100011934791 [2,0,0,0,0,0|1,0,1]=4 2055 B12R0.5 CCCCCCCCOCCCF 34a_100000759539_100000210759 [2,0,0,0,0,0|1,0,1]=4 2056 B12R0.5 CCCCCCCCOCCCF 7a_100000210232_100011934791 [2,0,0,0,0,0|1,0,1]=4 2057 B12R0.5 CCCCCCCCOCCCN 34a_100000182051_100000210759 [2,0,0,0,0,0|1,0,1]=4 2058 B12R0.5 CCCCCCCCOCCCO 34a_100000210232_100000230001 [2,0,0,0,0,0|0,0,1]=3 2059 B12R0.5 CCCCCCCCOCCCO 7a_100000210232_100011215043 [2,0,0,0,0,0|0,0,1]=3 2060 B12R0.5 CCCCCCCCSCCCO 62a_100000210759_100011215043 [2,0,0,0,0,0|0,1,1]=4 2061 B12R0.5 CCCCCCCCSCCCO 62a_100011215043_100000210317 [2,0,0,0,0,0|0,1,1]=4 2062 B12R0.5 CCCCCCCNCCCCO 2230a_100000229938_100000210776 [2,0,0,0,0,0|2,0,0]=4 2063 B12R0.5 CCCCCCCNCCCCO 2230a_100000750430_100000210681 [2,0,0,0,0,0|2,0,0]=4 2064 B12R0.5 CCCCCCCNCCCCO 34a_100000750430_100000210614 [2,0,0,0,0,0|2,0,0]=4 2065 B12R0.5 CCCCCCCOCCCCO 34a_100000210272_100011216708 [2,0,0,0,0,0|2,0,0]=4 2066 B12R0.5 CCCCCCCOCCCCO 7a_100000210272_100000210776 [2,0,0,0,0,0|2,0,0]=4 2067 B12R0.5 CCCCCCCSCCCCO 62a_100000210614_100000210776 [2,0,0,0,0,0|2,0,0]=4 2068 B12R0.5 CCCCCCCSCCCCO 62a_100000210776_100000210316 [2,0,0,0,0,0|2,0,0]=4 2069 B12R0.5 CCCCCNCCOCCCO 34a_100000224656_100000230001 [2,0,0,0,0,0|1,0,1]=4 2070 B12R0.5 CCCCCOCCOCCCO 34a_100011215259_100000230001 [2,0,0,0,0,0|1,0,1]=4 2071 B12R0.5 CCCCCOCCOCCCO 7a_100011215259_100011215043 [2,0,0,0,0,0|1,0,1]=4 2072 B12R0.5 CCCCNCCCOCCCO 2230a_100011310245_100000210211 [2,0,0,0,0,0|1,0,1]=4 2073 B12R0.5 CCCCNCCCOCCCO 34a_100011310245_100000210210 [2,0,0,0,0,0|1,0,1]=4 2074 B12R0.5 CCCCOCCCOCCCO 34a_200011215613_100000230001 [2,0,0,0,0,0|1,0,1]=4 2075 B12R0.5 CCCCOCCCOCCCO 7a_200011215613_100011215043 [2,0,0,0,0,0|1,0,1]=4 2076 B12R0.5 COCCCCCCOCCCO 34a_200012092642_100000230001 [2,0,0,0,0,0|1,0,1]=4 2077 B12R0.5 COCCCCCCOCCCO 7a_200012092642_100011215043 [2,0,0,0,0,0|1,0,1]=4 2078 B12R0.5 NCCCCCCCOCCCO 34a_100011996573_100000230001 [2,0,0,0,0,0|1,0,1]=4 2079 B12R0.5 OCCCOCCCCCCCBr 34a_100000760002_100000230001 [2,0,0,0,0,0|1,0,1]=4 2080 B12R0.5 OCCCOCCCCCCCBr 7a_100000760002_100011215043 [2,0,0,0,0,0|1,0,1]=4 2081 B12R0.234 CC(O)COCCCCCCCBr 34a_100000760002_100011218427 [2,0,0,0,0,0|1,0,1]=4 2082 B12R0.234 CC(O)COCCCCCCCBr 7a_100000760002_100011218427 [2,0,0,0,0,0|1,0,1]=4 2083 B12R0.234 CC(O)COCCCCCCCN 34a_100011996573_100011218427 [2,0,0,0,0,0|1,0,1]=4 2084 B12R0.234 CCCCCCCCNCC(C)O 2230a_100000210904_100000210759 [2,0,0,0,0,0|1,0,1]=4 2085 B12R0.234 CCCCCCCCNCC(C)O 2230a_100000229939_100011218427 [2,0,0,0,0,0|1,0,1]=4 2086 B12R0.234 CCCCCCCCNCC(C)O 34a_100000210904_100000210759 [2,0,0,0,0,0|1,0,1]=4 2087 B12R0.234 CCCCCCCCNCC(C)O 34a_100000229939_100011218427 [2,0,0,0,0,0|1,0,1]=4 2088 B12R0.234 CCCCCCCCNC[C@@H](C)O 2230a_100000229939_100009817552 [2,0,0,0,0,0|1,0,1]=4 2089 B12R0.234 CCCCCCCCNC[C@@H](C)O 34a_100000229939_100009817552 [2,0,0,0,0,0|1,0,1]=4 2090 B12R0.234 CCCCCCCCOCC(C)Br 34a_100012180447_100000210759 [2,0,0,0,0,0|1,0,1]=4 2091 B12R0.234 CCCCCCCCOCC(C)C 34a_100000210232_100000210624 [2,0,0,0,0,0|1,0,1]=4 2092 B12R0.234 CCCCCCCCOCC(C)C 34a_100000210257_100000210759 [2,0,0,0,0,0|1,0,1]=4 2093 B12R0.234 CCCCCCCCOCC(C)C 7a_100000210232_100000210760 [2,0,0,0,0,0|1,0,1]=4 2094 B12R0.234 CCCCCCCCOCC(C)F 34a_100015925927_100000210759 [2,0,0,0,0,0|1,0,1]=4 2095 B12R0.234 CCCCCCCCOCC(C)O 34a_100000210232_100011218427 [2,0,0,0,0,0|0,0,1]=3 2096 B12R0.234 CCCCCCCCOCC(C)O 7a_100000210232_100011218427 [2,0,0,0,0,0|0,0,1]=3 2097 B12R0.234 CCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210759 [2,0,0,0,0,0|1,0,1]=4 2098 B12R0.234 CCCCCCCCOC[C@@H](C)N 34a_100000737577_100000210759 [2,0,0,0,0,0|1,0,1]=4 2099 B12R0.234 CCCCCCCCOC[C@@H](C)O 34a_100000210232_100009817552 [2,0,0,0,0,0|0,0,1]=3 2100 B12R0.234 CCCCCCCCOC[C@@H](C)O 7a_100000210232_100009817552 [2,0,0,0,0,0|0,0,1]=3 2101 B12R0.234 CCCCCCCCSCC(C)O 62a_100000210759_100011218427 [2,0,0,0,0,0|0,1,1]=4 2102 B12R0.234 CCCCCCCCSCC(C)O 62a_100011218427_100000210317 [2,0,0,0,0,0|0,1,1]=4 2103 B12R0.234 CCCCCCCCSC[C@@H](C)O 62a_100000210759_100009817552 [2,0,0,0,0,0|0,1,1]=4 2104 B12R0.234 CCCCCCCCSC[C@@H](C)O 62a_100009817552_100000210317 [2,0,0,0,0,0|0,1,1]=4 2105 B12R0.234 CCCCCCCNCCC(C)O 2230a_100000229938_100012276601 [2,0,0,0,0,0|2,0,0]=4 2106 B12R0.234 CCCCCCCNCCC(C)O 2230a_200000755665_100000210681 [2,0,0,0,0,0|2,0,0]=4 2107 B12R0.234 CCCCCCCOCCC(C)O 34a_100000210272_100012276601 [2,0,0,0,0,0|2,0,0]=4 2108 B12R0.234 CCCCCCCOCCC(C)O 7a_100000210272_100012276601 [2,0,0,0,0,0|2,0,0]=4 2109 B12R0.234 CCCCCCCSCCC(C)O 62a_100000210614_100012276601 [2,0,0,0,0,0|2,0,0]=4 2110 B12R0.234 CCCCCCCSCCC(C)O 62a_100012276601_100000210316 [2,0,0,0,0,0|2,0,0]=4 2111 B12R0.234 CCCCCNCCOCC(C)O 34a_100000224656_100011218427 [2,0,0,0,0,0|1,0,1]=4 2112 B12R0.234 CCCCCNCCOC[C@@H](C)O 34a_100000224656_100009817552 [2,0,0,0,0,0|1,0,1]=4 2113 B12R0.234 CCCCCOCCOCC(C)O 34a_100011215259_100011218427 [2,0,0,0,0,0|1,0,1]=4 2114 B12R0.234 CCCCCOCCOCC(C)O 7a_100011215259_100011218427 [2,0,0,0,0,0|1,0,1]=4 2115 B12R0.234 CCCCCOCCOC[C@@H](C)O 34a_100011215259_100009817552 [2,0,0,0,0,0|1,0,1]=4 2116 B12R0.234 CCCCCOCCOC[C@@H](C)O 7a_100011215259_100009817552 [2,0,0,0,0,0|1,0,1]=4 2117 B12R0.234 CCCCOCCCOCC(C)O 34a_200011215613_100011218427 [2,0,0,0,0,0|1,0,1]=4 2118 B12R0.234 CCCCOCCCOCC(C)O 7a_200011215613_100011218427 [2,0,0,0,0,0|1,0,1]=4 2119 B12R0.234 CCCCOCCCOC[C@@H](C)O 34a_200011215613_100009817552 [2,0,0,0,0,0|1,0,1]=4 2120 B12R0.234 CCCCOCCCOC[C@@H](C)O 7a_200011215613_100009817552 [2,0,0,0,0,0|1,0,1]=4 2121 B12R0.234 COCCCCCCOCC(C)O 34a_200012092642_100011218427 [2,0,0,0,0,0|1,0,1]=4 2122 B12R0.234 COCCCCCCOCC(C)O 7a_200012092642_100011218427 [2,0,0,0,0,0|1,0,1]=4 2123 B12R0.234 COCCCCCCOC[C@@H](C)O 34a_200012092642_100009817552 [2,0,0,0,0,0|1,0,1]=4 2124 B12R0.234 COCCCCCCOC[C@@H](C)O 7a_200012092642_100009817552 [2,0,0,0,0,0|1,0,1]=4 2125 B12R0.234 C[C@@H](O)COCCCCCCCBr 34a_100000760002_100009817552 [2,0,0,0,0,0|1,0,1]=4 2126 B12R0.234 C[C@@H](O)COCCCCCCCBr 7a_100000760002_100009817552 [2,0,0,0,0,0|1,0,1]=4 2127 B12R0.234 C[C@@H](O)COCCCCCCCN 34a_100011996573_100009817552 [2,0,0,0,0,0|1,0,1]=4 2128 B12R0.248 C#CCCCCCOCC(O)CO 34a_100000766912_100011219619 [2,0,0,0,0,0|0,0,2]=4 2129 B12R0.248 C#CCCCCCOCC(O)CO 7a_100000766912_100011219619 [2,0,0,0,0,0|0,0,2]=4 2130 B12R0.248 C#CCCCCCOC[C@@H](O)CO 34a_100000766912_100009815848 [2,0,0,0,0,0|0,0,2]=4 2131 B12R0.248 C#CCCCCCOC[C@@H](O)CO 7a_100000766912_100009815848 [2,0,0,0,0,0|0,0,2]=4 2132 B12R0.248 C=CC(O)COCCCCCCC 34a_100000210272_100000730141 [2,0,0,0,0,0|1,0,1]=4 2133 B12R0.248 C=CC(O)COCCCCCCC 7a_100000210272_100000730141 [2,0,0,0,0,0|1,0,1]=4 2134 B12R0.248 C=CCCCCCOCC(O)CO 34a_100011216702_100011219619 [2,0,0,0,0,0|0,0,2]=4 2135 B12R0.248 C=CCCCCCOCC(O)CO 7a_100011216702_100011219619 [2,0,0,0,0,0|0,0,2]=4 2136 B12R0.248 C=CCCCCCOC[C@@H](O)CO 34a_100011216702_100009815848 [2,0,0,0,0,0|0,0,2]=4 2137 B12R0.248 C=CCCCCCOC[C@@H](O)CO 7a_100011216702_100009815848 [2,0,0,0,0,0|0,0,2]=4 2138 B12R0.248 CC/C=C/CCCOCC(O)CO 34a_100016287902_100011219619 [2,0,0,0,0,0|0,0,2]=4 2139 B12R0.248 CC/C=C/CCCOCC(O)CO 7a_100016287902_100011219619 [2,0,0,0,0,0|0,0,2]=4 2140 B12R0.248 CC/C=C/CCCOC[C@@H](O)CO 34a_100016287902_100009815848 [2,0,0,0,0,0|0,0,2]=4 2141 B12R0.248 CC/C=C/CCCOC[C@@H](O)CO 7a_100016287902_100009815848 [2,0,0,0,0,0|0,0,2]=4 2142 B12R0.248 CCC(O)COCCCCCCBr 34a_100011215345_100011218378 [2,0,0,0,0,0|2,0,0]=4 2143 B12R0.248 CCC(O)COCCCCCCBr 7a_100011215345_100011218378 [2,0,0,0,0,0|2,0,0]=4 2144 B12R0.248 CCC(O)COCCCCCCCl 34a_100000766143_100011218378 [2,0,0,0,0,0|2,0,0]=4 2145 B12R0.248 CCC(O)COCCCCCCCl 7a_100000766143_100011218378 [2,0,0,0,0,0|2,0,0]=4 2146 B12R0.248 CCC(O)COCCCCCCF 34a_100000732779_100011218378 [2,0,0,0,0,0|2,0,0]=4 2147 B12R0.248 CCC(O)COCCCCCCF 7a_100000732779_100011218378 [2,0,0,0,0,0|2,0,0]=4 2148 B12R0.248 CCC(O)COCCCCCCN 34a_100000686447_100011218378 [2,0,0,0,0,0|2,0,0]=4 2149 B12R0.248 CCC(O)COCCCCCNC 34a_100000722520_100011218378 [2,0,0,0,0,0|2,0,0]=4 2150 B12R0.248 CCCC#CCCOCC(O)CO 34a_100000042726_100011219619 [2,0,0,0,0,0|0,0,2]=4 2151 B12R0.248 CCCC#CCCOCC(O)CO 7a_100000042726_100011219619 [2,0,0,0,0,0|0,0,2]=4 2152 B12R0.248 CCCC#CCCOC[C@@H](O)CO 34a_100000042726_100009815848 [2,0,0,0,0,0|0,0,2]=4 2153 B12R0.248 CCCC#CCCOC[C@@H](O)CO 7a_100000042726_100009815848 [2,0,0,0,0,0|0,0,2]=4 2154 B12R0.248 CCCC/C=C/COCC(O)CO 34a_200016272032_100011219619 [2,0,0,0,0,0|0,0,2]=4 2155 B12R0.248 CCCC/C=C/COCC(O)CO 7a_200016272032_100011219619 [2,0,0,0,0,0|0,0,2]=4 2156 B12R0.248 CCCC/C=C/COC[C@@H](O)CO 34a_200016272032_100009815848 [2,0,0,0,0,0|0,0,2]=4 2157 B12R0.248 CCCC/C=C/COC[C@@H](O)CO 7a_200016272032_100009815848 [2,0,0,0,0,0|0,0,2]=4 2158 B12R0.248 CCCCC#CCOCC(O)CO 34a_200000034558_100011219619 [2,0,0,0,0,0|0,0,2]=4 2159 B12R0.248 CCCCC#CCOCC(O)CO 7a_200000034558_100011219619 [2,0,0,0,0,0|0,0,2]=4 2160 B12R0.248 CCCCC#CCOC[C@@H](O)CO 34a_200000034558_100009815848 [2,0,0,0,0,0|0,0,2]=4 2161 B12R0.248 CCCCC#CCOC[C@@H](O)CO 7a_200000034558_100009815848 [2,0,0,0,0,0|0,0,2]=4 2162 B12R0.248 CCCCCCCCOC(C)CO 34a_100000210232_100012180447 [2,0,0,0,0,0|1,0,1]=4 2163 B12R0.248 CCCCCCCCOC(C)CO 7a_100000210232_100012180447 [2,0,0,0,0,0|1,0,1]=4 2164 B12R0.248 CCCCCCCNCC(C)CO 34a_100000744482_100000210614 [2,0,0,0,0,0|2,0,0]=4 2165 B12R0.248 CCCCCCCNCC(O)CC 2230a_100000229938_100011218378 [2,0,0,0,0,0|2,0,0]=4 2166 B12R0.248 CCCCCCCNCC(O)CC 2230a_100011218483_100000210681 [2,0,0,0,0,0|2,0,0]=4 2167 B12R0.248 CCCCCCCNCC(O)CO 2230a_100000229938_100011219619 [2,0,0,0,0,0|1,0,0]=3 2168 B12R0.248 CCCCCCCNC[C@@H](C)CO 2230a_100000229938_100000059175 [2,0,0,0,0,0|2,0,0]=4 2169 B12R0.248 CCCCCCCNC[C@@H](F)CO 34a_100015665980_100000210614 [2,0,0,0,0,0|2,0,0]=4 2170 B12R0.248 CCCCCCCNC[C@@H](O)CF 2230a_100000229938_100015614560 [2,0,0,0,0,0|2,0,0]=4 2171 B12R0.248 CCCCCCCNC[C@@H](O)CO 2230a_100000229938_100009815848 [2,0,0,0,0,0|1,0,0]=3 2172 B12R0.248 CCCCCCCNC[C@H](O)CO 2230a_100020644852_100000210681 [2,0,0,0,0,0|1,0,0]=3 2173 B12R0.248 CCCCCCCOCC(C)CC 34a_100000210272_100000748023 [2,0,0,0,0,0|2,0,0]=4 2174 B12R0.248 CCCCCCCOCC(C)CC 7a_100000210272_100000748023 [2,0,0,0,0,0|2,0,0]=4 2175 B12R0.248 CCCCCCCOCC(C)CN 34a_100000744482_100000210614 [2,0,0,0,0,0|2,0,0]=4 2176 B12R0.248 CCCCCCCOCC(Cl)CCl 34a_100000033668_100000210614 [2,0,0,0,0,0|2,0,0]=4 2177 B12R0.248 CCCCCCCOCC(O)CC 34a_100000210272_100011218378 [2,0,0,0,0,0|1,0,0]=3 2178 B12R0.248 CCCCCCCOCC(O)CC 7a_100000210272_100011218378 [2,0,0,0,0,0|1,0,0]=3 2179 B12R0.248 CCCCCCCOCC(O)CO 34a_100000210272_100011219619 [2,0,0,0,0,0|0,0,0]=2 2180 B12R0.248 CCCCCCCOCC(O)CO 7a_100000210272_100011219619 [2,0,0,0,0,0|0,0,0]=2 2181 B12R0.248 CCCCCCCOC[C@@H](C)CC 34a_100000210272_100009816398 [2,0,0,0,0,0|2,0,0]=4 2182 B12R0.248 CCCCCCCOC[C@@H](C)CC 7a_100000210272_100009816398 [2,0,0,0,0,0|2,0,0]=4 2183 B12R0.248 CCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210614 [2,0,0,0,0,0|2,0,0]=4 2184 B12R0.248 CCCCCCCOC[C@@H](C)CO 34a_100000210272_100000059175 [2,0,0,0,0,0|1,0,0]=3 2185 B12R0.248 CCCCCCCOC[C@@H](C)CO 7a_100000210272_100000059175 [2,0,0,0,0,0|1,0,0]=3 2186 B12R0.248 CCCCCCCOC[C@@H](O)CF 34a_100000210272_100015614560 [2,0,0,0,0,0|1,0,0]=3 2187 B12R0.248 CCCCCCCOC[C@@H](O)CF 7a_100000210272_100015614560 [2,0,0,0,0,0|1,0,0]=3 2188 B12R0.248 CCCCCCCOC[C@@H](O)CO 34a_100000210272_100009815848 [2,0,0,0,0,0|0,0,0]=2 2189 B12R0.248 CCCCCCCOC[C@@H](O)CO 7a_100000210272_100009815848 [2,0,0,0,0,0|0,0,0]=2 2190 B12R0.248 CCCCCCCOC[C@H](F)CN 34a_100015665980_100000210614 [2,0,0,0,0,0|2,0,0]=4 2191 B12R0.248 CCCCCCCSCC(O)CC 62a_100000210614_100011218378 [2,0,0,0,0,0|1,1,0]=4 2192 B12R0.248 CCCCCCCSCC(O)CC 62a_100011218378_100000210316 [2,0,0,0,0,0|1,1,0]=4 2193 B12R0.248 CCCCCCCSCC(O)CO 62a_100000210614_100011219619 [2,0,0,0,0,0|0,1,0]=3 2194 B12R0.248 CCCCCCCSCC(O)CO 62a_100011219619_100000210316 [2,0,0,0,0,0|0,1,0]=3 2195 B12R0.248 CCCCCCCSC[C@@H](C)CO 62a_100000059175_100000210316 [2,0,0,0,0,0|1,1,0]=4 2196 B12R0.248 CCCCCCCSC[C@@H](C)CO 62a_100000210614_100000059175 [2,0,0,0,0,0|1,1,0]=4 2197 B12R0.248 CCCCCCCSC[C@@H](O)CF 62a_100000210614_100015614560 [2,0,0,0,0,0|1,1,0]=4 2198 B12R0.248 CCCCCCCSC[C@@H](O)CF 62a_100015614560_100000210316 [2,0,0,0,0,0|1,1,0]=4 2199 B12R0.248 CCCCCCCSC[C@@H](O)CO 62a_100000210614_100009815848 [2,0,0,0,0,0|0,1,0]=3 2200 B12R0.248 CCCCCCCSC[C@@H](O)CO 62a_100009815848_100000210316 [2,0,0,0,0,0|0,1,0]=3 2201 B12R0.248 CCCCOCCNC[C@H](O)CO 2230a_100020644852_100000743108 [2,0,0,0,0,0|2,0,0]=4 2202 B12R0.248 CCCCOCCOCC(O)CC 34a_100000210238_100011218378 [2,0,0,0,0,0|2,0,0]=4 2203 B12R0.248 CCCCOCCOCC(O)CC 7a_100000210238_100011218378 [2,0,0,0,0,0|2,0,0]=4 2204 B12R0.248 CCCCOCCOCC(O)CO 34a_100000210238_100011219619 [2,0,0,0,0,0|1,0,0]=3 2205 B12R0.248 CCCCOCCOCC(O)CO 7a_100000210238_100011219619 [2,0,0,0,0,0|1,0,0]=3 2206 B12R0.248 CCCCOCCOC[C@@H](C)CO 34a_100000210238_100000059175 [2,0,0,0,0,0|2,0,0]=4 2207 B12R0.248 CCCCOCCOC[C@@H](C)CO 7a_100000210238_100000059175 [2,0,0,0,0,0|2,0,0]=4 2208 B12R0.248 CCCCOCCOC[C@@H](O)CF 34a_100000210238_100015614560 [2,0,0,0,0,0|2,0,0]=4 2209 B12R0.248 CCCCOCCOC[C@@H](O)CF 7a_100000210238_100015614560 [2,0,0,0,0,0|2,0,0]=4 2210 B12R0.248 CCCCOCCOC[C@@H](O)CO 34a_100000210238_100009815848 [2,0,0,0,0,0|1,0,0]=3 2211 B12R0.248 CCCCOCCOC[C@@H](O)CO 7a_100000210238_100009815848 [2,0,0,0,0,0|1,0,0]=3 2212 B12R0.248 CCCCOCCSCC(O)CO 62a_100000743108_100011219619 [2,0,0,0,0,0|1,1,0]=4 2213 B12R0.248 CCCCOCCSCC(O)CO 62a_100011219619_100000743108 [2,0,0,0,0,0|1,1,0]=4 2214 B12R0.248 CCCCOCCSC[C@@H](O)CO 62a_100000743108_100009815848 [2,0,0,0,0,0|1,1,0]=4 2215 B12R0.248 CCCCOCCSC[C@@H](O)CO 62a_100009815848_100000743108 [2,0,0,0,0,0|1,1,0]=4 2216 B12R0.248 CCCCSCCNCC(O)CO 2230a_100025743550_100011219619 [2,0,0,0,0,0|2,0,0]=4 2217 B12R0.248 CCCCSCCNC[C@@H](O)CO 2230a_100025743550_100009815848 [2,0,0,0,0,0|2,0,0]=4 2218 B12R0.248 CCCCSCCOCC(O)CC 34a_200000230436_100011218378 [2,0,0,0,0,0|2,0,0]=4 2219 B12R0.248 CCCCSCCOCC(O)CC 7a_200000230436_100011218378 [2,0,0,0,0,0|2,0,0]=4 2220 B12R0.248 CCCCSCCOCC(O)CO 34a_200000230436_100011219619 [2,0,0,0,0,0|1,0,0]=3 2221 B12R0.248 CCCCSCCOCC(O)CO 7a_200000230436_100011219619 [2,0,0,0,0,0|1,0,0]=3 2222 B12R0.248 CCCCSCCOC[C@@H](C)CO 34a_200000230436_100000059175 [2,0,0,0,0,0|2,0,0]=4 2223 B12R0.248 CCCCSCCOC[C@@H](C)CO 7a_200000230436_100000059175 [2,0,0,0,0,0|2,0,0]=4 2224 B12R0.248 CCCCSCCOC[C@@H](O)CF 34a_200000230436_100015614560 [2,0,0,0,0,0|2,0,0]=4 2225 B12R0.248 CCCCSCCOC[C@@H](O)CF 7a_200000230436_100015614560 [2,0,0,0,0,0|2,0,0]=4 2226 B12R0.248 CCCCSCCOC[C@@H](O)CO 34a_200000230436_100009815848 [2,0,0,0,0,0|1,0,0]=3 2227 B12R0.248 CCCCSCCOC[C@@H](O)CO 7a_200000230436_100009815848 [2,0,0,0,0,0|1,0,0]=3 2228 B12R0.248 CCCOCCCNCC(O)CO 2230a_100011217757_100011219619 [2,0,0,0,0,0|2,0,0]=4 2229 B12R0.248 CCCOCCCNCC(O)CO 34a_100011217757_100011219619 [2,0,0,0,0,0|2,0,0]=4 2230 B12R0.248 CCCOCCCNC[C@@H](O)CO 2230a_100011217757_100009815848 [2,0,0,0,0,0|2,0,0]=4 2231 B12R0.248 CCCOCCCNC[C@@H](O)CO 34a_100011217757_100009815848 [2,0,0,0,0,0|2,0,0]=4 2232 B12R0.248 CNCCCCCOCC(O)CO 34a_100000722520_100011219619 [2,0,0,0,0,0|1,0,0]=3 2233 B12R0.248 CNCCCCCOC[C@@H](C)CO 34a_100000722520_100000059175 [2,0,0,0,0,0|2,0,0]=4 2234 B12R0.248 CNCCCCCOC[C@@H](O)CF 34a_100000722520_100015614560 [2,0,0,0,0,0|2,0,0]=4 2235 B12R0.248 CNCCCCCOC[C@@H](O)CO 34a_100000722520_100009815848 [2,0,0,0,0,0|1,0,0]=3 2236 B12R0.248 CNCCOCCOCC(O)CO 34a_100000228057_100011219619 [2,0,0,0,0,0|2,0,0]=4 2237 B12R0.248 CNCCOCCOC[C@@H](O)CO 34a_100000228057_100009815848 [2,0,0,0,0,0|2,0,0]=4 2238 B12R0.248 COCCCCCNCC(O)CO 2230a_100000747528_100011219619 [2,0,0,0,0,0|2,0,0]=4 2239 B12R0.248 COCCCCCNCC(O)CO 34a_100000747528_100011219619 [2,0,0,0,0,0|2,0,0]=4 2240 B12R0.248 COCCCCCNC[C@@H](O)CO 2230a_100000747528_100009815848 [2,0,0,0,0,0|2,0,0]=4 2241 B12R0.248 COCCCCCNC[C@@H](O)CO 34a_100000747528_100009815848 [2,0,0,0,0,0|2,0,0]=4 2242 B12R0.248 COCCOCCOCC(O)CO 34a_100011215163_100011219619 [2,0,0,0,0,0|2,0,0]=4 2243 B12R0.248 COCCOCCOCC(O)CO 7a_100011215163_100011219619 [2,0,0,0,0,0|2,0,0]=4 2244 B12R0.248 COCCOCCOC[C@@H](O)CO 34a_100011215163_100009815848 [2,0,0,0,0,0|2,0,0]=4 2245 B12R0.248 COCCOCCOC[C@@H](O)CO 7a_100011215163_100009815848 [2,0,0,0,0,0|2,0,0]=4 2246 B12R0.248 C[C@@H](CO)COCCCCCCBr 34a_100011215345_100000059175 [2,0,0,0,0,0|2,0,0]=4 2247 B12R0.248 C[C@@H](CO)COCCCCCCBr 7a_100011215345_100000059175 [2,0,0,0,0,0|2,0,0]=4 2248 B12R0.248 C[C@@H](CO)COCCCCCCCl 34a_100000766143_100000059175 [2,0,0,0,0,0|2,0,0]=4 2249 B12R0.248 C[C@@H](CO)COCCCCCCCl 7a_100000766143_100000059175 [2,0,0,0,0,0|2,0,0]=4 2250 B12R0.248 C[C@@H](CO)COCCCCCCF 34a_100000732779_100000059175 [2,0,0,0,0,0|2,0,0]=4 2251 B12R0.248 C[C@@H](CO)COCCCCCCF 7a_100000732779_100000059175 [2,0,0,0,0,0|2,0,0]=4 2252 B12R0.248 C[C@@H](CO)COCCCCCCN 34a_100000686447_100000059175 [2,0,0,0,0,0|2,0,0]=4 2253 B12R0.248 NCCCCCCOCC(O)CO 34a_100000686447_100011219619 [2,0,0,0,0,0|1,0,0]=3 2254 B12R0.248 NCCCCCCOC[C@@H](O)CF 34a_100000686447_100015614560 [2,0,0,0,0,0|2,0,0]=4 2255 B12R0.248 NCCCCCCOC[C@@H](O)CO 34a_100000686447_100009815848 [2,0,0,0,0,0|1,0,0]=3 2256 B12R0.248 OCC(O)COCCCCCCBr 34a_100011215345_100011219619 [2,0,0,0,0,0|1,0,0]=3 2257 B12R0.248 OCC(O)COCCCCCCBr 7a_100011215345_100011219619 [2,0,0,0,0,0|1,0,0]=3 2258 B12R0.248 OCC(O)COCCCCCCCl 34a_100000766143_100011219619 [2,0,0,0,0,0|1,0,0]=3 2259 B12R0.248 OCC(O)COCCCCCCCl 7a_100000766143_100011219619 [2,0,0,0,0,0|1,0,0]=3 2260 B12R0.248 OCC(O)COCCCCCCF 34a_100000732779_100011219619 [2,0,0,0,0,0|1,0,0]=3 2261 B12R0.248 OCC(O)COCCCCCCF 7a_100000732779_100011219619 [2,0,0,0,0,0|1,0,0]=3 2262 B12R0.248 OCC(O)CSCCCCCCF 62a_100011219619_100015922095 [2,0,0,0,0,0|1,1,0]=4 2263 B12R0.248 OCC(O)CSCCCCCCF 62a_100015922095_100011219619 [2,0,0,0,0,0|1,1,0]=4 2264 B12R0.248 OCCCCCCNCC(O)CO 2230a_100000686447_100011219619 [2,0,0,0,0,0|2,0,0]=4 2265 B12R0.248 OCCCCCCNCC(O)CO 34a_100000686447_100011219619 [2,0,0,0,0,0|2,0,0]=4 2266 B12R0.248 OCCCCCCNC[C@@H](O)CO 2230a_100000686447_100009815848 [2,0,0,0,0,0|2,0,0]=4 2267 B12R0.248 OCCCCCCNC[C@@H](O)CO 34a_100000686447_100009815848 [2,0,0,0,0,0|2,0,0]=4 2268 B12R0.248 OCCCCCCNC[C@H](O)CO 2230a_100020644852_100000766143 [2,0,0,0,0,0|2,0,0]=4 2269 B12R0.248 OCCCCCCSCC(O)CO 62a_100000766143_100011219619 [2,0,0,0,0,0|1,1,0]=4 2270 B12R0.248 OCCCCCCSCC(O)CO 62a_100011219619_100000766143 [2,0,0,0,0,0|1,1,0]=4 2271 B12R0.248 OCCCCCCSC[C@@H](O)CO 62a_100000766143_100009815848 [2,0,0,0,0,0|1,1,0]=4 2272 B12R0.248 OCCCCCCSC[C@@H](O)CO 62a_100009815848_100000766143 [2,0,0,0,0,0|1,1,0]=4 2273 B12R0.248 OC[C@@H](O)CNCCCCCCF 2230a_100020644852_100015922095 [2,0,0,0,0,0|2,0,0]=4 2274 B12R0.248 OC[C@H](O)COCCCCCCBr 34a_100011215345_100009815848 [2,0,0,0,0,0|1,0,0]=3 2275 B12R0.248 OC[C@H](O)COCCCCCCBr 7a_100011215345_100009815848 [2,0,0,0,0,0|1,0,0]=3 2276 B12R0.248 OC[C@H](O)COCCCCCCCl 34a_100000766143_100009815848 [2,0,0,0,0,0|1,0,0]=3 2277 B12R0.248 OC[C@H](O)COCCCCCCCl 7a_100000766143_100009815848 [2,0,0,0,0,0|1,0,0]=3 2278 B12R0.248 OC[C@H](O)COCCCCCCF 34a_100000732779_100009815848 [2,0,0,0,0,0|1,0,0]=3 2279 B12R0.248 OC[C@H](O)COCCCCCCF 7a_100000732779_100009815848 [2,0,0,0,0,0|1,0,0]=3 2280 B12R0.248 OC[C@H](O)CSCCCCCCF 62a_100009815848_100015922095 [2,0,0,0,0,0|1,1,0]=4 2281 B12R0.248 OC[C@H](O)CSCCCCCCF 62a_100015922095_100009815848 [2,0,0,0,0,0|1,1,0]=4 2282 B12R0.248 O[C@@H](CF)COCCCCCCBr 34a_100011215345_100015614560 [2,0,0,0,0,0|2,0,0]=4 2283 B12R0.248 O[C@@H](CF)COCCCCCCBr 7a_100011215345_100015614560 [2,0,0,0,0,0|2,0,0]=4 2284 B12R0.248 O[C@@H](CF)COCCCCCCCl 34a_100000766143_100015614560 [2,0,0,0,0,0|2,0,0]=4 2285 B12R0.248 O[C@@H](CF)COCCCCCCCl 7a_100000766143_100015614560 [2,0,0,0,0,0|2,0,0]=4 2286 B12R0.248 O[C@@H](CF)COCCCCCCF 34a_100000732779_100015614560 [2,0,0,0,0,0|2,0,0]=4 2287 B12R0.248 O[C@@H](CF)COCCCCCCF 7a_100000732779_100015614560 [2,0,0,0,0,0|2,0,0]=4 2288 B12R0.206 C#CCCC(=O)CCCCCCC 1458a_100000211969_100000753159 [2,0,0,0,0,0|1,0,1]=4 2289 B12R0.206 C#CCCC(=O)CCCCCCC 1458a_100000692101_100000210614 [2,0,0,0,0,0|1,0,1]=4 2290 B12R0.206 C#CCCCCCC(=O)CCCO 1458a_100000694772_100011215043 [2,0,0,0,0,0|0,0,2]=4 2291 B12R0.206 C=CCCC(=O)CCCCCCC 1458a_100000211969_100000754431 [2,0,0,0,0,0|1,0,1]=4 2292 B12R0.206 C=CCCC(=O)CCCCCCC 1458a_100000749702_100000210614 [2,0,0,0,0,0|1,0,1]=4 2293 B12R0.206 C=CCCCCCC(=O)CCCO 1458a_100011934241_100011215043 [2,0,0,0,0,0|0,0,2]=4 2294 B12R0.206 CCC#CC(=O)CCCCCCC 1458a_100011827653_100000210614 [2,0,0,0,0,0|1,0,1]=4 2295 B12R0.206 CCC=CC(=O)CCCCCCC 1458a_100000212282_100000210614 [2,0,0,0,0,0|1,0,1]=4 2296 B12R0.206 CCCC/C=C/CC(=O)CCCO 1458a_200016282684_100011215043 [2,0,0,0,0,0|0,0,2]=4 2297 B12R0.206 CCCCC(=O)CCCCCCF 1458a_100000210183_100015922095 [2,0,0,0,0,0|2,0,0]=4 2298 B12R0.206 CCCCC(=O)CCCCCCO 1458a_100000210183_100000766143 [2,0,0,0,0,0|2,0,0]=4 2299 B12R0.206 CCCCC(=O)CCCCCCO 1458a_100011996774_100000210211 [2,0,0,0,0,0|2,0,0]=4 2300 B12R0.206 CCCCC(=O)CCCCCOC 1458a_100011935119_100000210211 [2,0,0,0,0,0|2,0,0]=4 2301 B12R0.206 CCCCCC#CC(=O)CCCO 1458a_100011215388_100011215043 [2,0,0,0,0,0|0,0,2]=4 2302 B12R0.206 CCCCCC=CC(=O)CCCO 1458a_100016263427_100011215043 [2,0,0,0,0,0|0,0,2]=4 2303 B12R0.206 CCCCCCCC(=O)C#CCO 1458a_100000049017_100000210614 [2,0,0,0,0,0|0,0,2]=4 2304 B12R0.206 CCCCCCCC(=O)CCC#N 1458a_100000211969_100011215226 [2,0,0,0,0,0|1,0,1]=4 2305 B12R0.206 CCCCCCCC(=O)CCC#N 1458a_100011934036_100000210614 [2,0,0,0,0,0|1,0,1]=4 2306 B12R0.206 CCCCCCCC(=O)CCCC 1458a_100000210183_100000210614 [2,0,0,0,0,0|1,0,0]=3 2307 B12R0.206 CCCCCCCC(=O)CCCC 1458a_100000211969_100000210211 [2,0,0,0,0,0|1,0,0]=3 2308 B12R0.206 CCCCCCCC(=O)CCCF 1458a_100000211969_100011934791 [2,0,0,0,0,0|1,0,0]=3 2309 B12R0.206 CCCCCCCC(=O)CCCO 1458a_100000211969_100011215043 [2,0,0,0,0,0|0,0,0]=2 2310 B12R0.206 CCCCCCCC(=O)CCOC 1458a_100000211969_100000233755 [2,0,0,0,0,0|2,0,0]=4 2311 B12R0.206 CCCCCCCC(=O)CCOC 1458a_100000749529_100000210614 [2,0,0,0,0,0|2,0,0]=4 2312 B12R0.206 CCCCCCCC(=O)CCSC 1458a_100000174002_100000210614 [2,0,0,0,0,0|2,0,0]=4 2313 B12R0.206 CCCCCCCC(=O)CCSC 1458a_100000211969_100000751147 [2,0,0,0,0,0|2,0,0]=4 2314 B12R0.206 CCCCCCCC(=O)COCC 1458a_100000211967_100000210614 [2,0,0,0,0,0|2,0,0]=4 2315 B12R0.206 CCCCCCCC(=O)CSCC 1458a_100000230394_100000210614 [2,0,0,0,0,0|2,0,0]=4 2316 B12R0.206 CCCCCCCC(=O)NCCC 11a_100020643023_100000211969 [2,0,0,0,0,0|1,0,0]=3 2317 B12R0.206 CCCCCCCC(=O)NCCC 1626a_100020643023_100000211969 [2,0,0,0,0,0|1,0,0]=3 2318 B12R0.206 CCCCCCCC(=O)NCCC 240690a_100020643023_100000211969 [2,0,0,0,0,0|1,0,0]=3 2319 B12R0.206 CCCCCCCC(=O)NCCC 527a_100020643023_100000211969 [2,0,0,0,0,0|1,0,0]=3 2320 B12R0.206 CCCCCCCC(=O)NCCF 11a_100000724931_100000211969 [2,0,0,0,0,0|2,0,0]=4 2321 B12R0.206 CCCCCCCC(=O)NCCF 1626a_100000724931_100000211969 [2,0,0,0,0,0|2,0,0]=4 2322 B12R0.206 CCCCCCCC(=O)NCCF 240690a_100000724931_100000211969 [2,0,0,0,0,0|2,0,0]=4 2323 B12R0.206 CCCCCCCC(=O)NCCF 527a_100000724931_100000211969 [2,0,0,0,0,0|2,0,0]=4 2324 B12R0.206 CCCCCCCC(=O)NCCO 240690a_100000210304_100000211969 [2,0,0,0,0,0|1,0,0]=3 2325 B12R0.206 CCCCCCCC(=O)NCCO 527a_100000210304_100000211969 [2,0,0,0,0,0|1,0,0]=3 2326 B12R0.206 CCCCCCCC(=O)NNCC 22a_100000756455_100000211969 [2,0,0,0,0,0|2,0,0]=4 2327 B12R0.206 CCCCCCCC(=O)OCNC 2230a_106832991635_100009852258 [2,0,0,0,0,0|1,0,0]=3 2328 B12R0.206 CCCCCCCC(=O)OCNC 34a_100102657272_100009852258 [2,0,0,0,0,0|1,0,0]=3 2329 B12R0.206 CCCCCCCC(=O)OCNC 7a_106832991635_100009852258 [2,0,0,0,0,0|1,0,0]=3 2330 B12R0.206 CCCCCCCC(=O)OCOC 34a_100138415774_100009852258 [2,0,0,0,0,0|1,0,0]=3 2331 B12R0.206 CCCCCCCC(=O)OCSC 62a_200000210301_100009852258 [2,0,0,0,0,0|1,0,0]=3 2332 B12R0.206 CCCCCCCC(=O)OCS[13CH3] 62a_200025704644_100009852258 [2,0,0,0,0,0|1,0,0]=3 2333 B12R0.206 CCCCCCCC(C)OCCC 34a_100000210258_200011218727 [2,0,0,0,0,0|1,0,1]=4 2334 B12R0.206 CCCCCCCC(C)OCCC 34a_200011215852_100000210303 [2,0,0,0,0,0|1,0,1]=4 2335 B12R0.206 CCCCCCCC(C)OCCC 7a_200011215852_100000210303 [2,0,0,0,0,0|1,0,1]=4 2336 B12R0.206 CCCCCCCC(C)OCCO 34a_200011215852_100000211926 [2,0,0,0,0,0|1,0,1]=4 2337 B12R0.206 CCCCCCCC(C)OCCO 7a_200011215852_100000211926 [2,0,0,0,0,0|1,0,1]=4 2338 B12R0.206 CCCCCCCN(C)CCCO 2230a_100000213112_100000210681 [2,0,0,0,0,0|2,0,0]=4 2339 B12R0.206 CCCCCCCN(C)CCCO 2230a_100000228206_100000230001 [2,0,0,0,0,0|2,0,0]=4 2340 B12R0.206 CCCCCCCN(C)CCCO 269982a_100000213112_100000210681 [2,0,0,0,0,0|2,0,0]=4 2341 B12R0.206 CCCCCCCN(C)CCCO 269982a_100000228206_100011215043 [2,0,0,0,0,0|2,0,0]=4 2342 B12R0.206 CCCCCCNC(=O)CCCC 11a_100000210581_100000210183 [2,0,0,0,0,0|2,0,0]=4 2343 B12R0.206 CCCCCCNC(=O)CCCC 1626a_100000210581_100000210183 [2,0,0,0,0,0|2,0,0]=4 2344 B12R0.206 CCCCCCNC(=O)CCCC 240690a_100000210581_100000210183 [2,0,0,0,0,0|2,0,0]=4 2345 B12R0.206 CCCCCCNC(=O)CCCC 527a_100000210581_100000210183 [2,0,0,0,0,0|2,0,0]=4 2346 B12R0.206 CCCCCCNC(=O)NCCC 2708a_100000210581_100020643023 [2,0,0,0,0,0|2,0,0]=4 2347 B12R0.206 CCCCCCNC(=O)NCCC 2708a_100020643023_100000210581 [2,0,0,0,0,0|2,0,0]=4 2348 B12R0.206 CCCCCCNC(=O)NCCC 273464a_100000210581_100020643023 [2,0,0,0,0,0|2,0,0]=4 2349 B12R0.206 CCCCCCNC(=O)NCCC 273464a_100020643023_100000210581 [2,0,0,0,0,0|2,0,0]=4 2350 B12R0.206 CCCCCCNC(=O)NCCC 512a_100000210581_100020643023 [2,0,0,0,0,0|2,0,0]=4 2351 B12R0.206 CCCCCCNC(=O)NCCC 512a_100020643023_100000210581 [2,0,0,0,0,0|2,0,0]=4 2352 B12R0.206 CCCCCCNC(=O)NCCO 2708a_100000210581_100000210304 [2,0,0,0,0,0|2,0,0]=4 2353 B12R0.206 CCCCCCNC(=O)NCCO 273464a_100000210304_100000210581 [2,0,0,0,0,0|2,0,0]=4 2354 B12R0.206 CCCCCCNC(=O)NCCO 273464a_100000210581_100000210304 [2,0,0,0,0,0|2,0,0]=4 2355 B12R0.206 CCCCCCNC(=O)NCCO 512a_100000210581_100000210304 [2,0,0,0,0,0|2,0,0]=4 2356 B12R0.206 CCCCCNCC(=O)NCCC 2230a_100000174927_100000210326 [2,0,0,0,0,0|2,0,0]=4 2357 B12R0.206 CCCCCNCC(=O)NCCC 2230a_100000209983_100000183358 [2,0,0,0,0,0|2,0,0]=4 2358 B12R0.206 CCCCCNCC(=O)OCCC 2230a_100000209983_200011215008 [2,0,0,0,0,0|1,0,0]=3 2359 B12R0.206 CCCCCOCC(=O)NCCC 34a_100000210253_100000183358 [2,0,0,0,0,0|2,0,0]=4 2360 B12R0.206 CCCCCOCC(=O)NCCC 7a_100000210253_100000183358 [2,0,0,0,0,0|2,0,0]=4 2361 B12R0.206 CCCCCOCC(=O)OCCC 34a_100000210253_200011215008 [2,0,0,0,0,0|1,0,0]=3 2362 B12R0.206 CCCCCOCC(=O)OCCC 7a_100000210253_200011215008 [2,0,0,0,0,0|1,0,0]=3 2363 B12R0.206 CCCCCSCC(=O)NCCC 62a_100000183358_100000210326 [2,0,0,0,0,0|2,0,0]=4 2364 B12R0.206 CCCCCSCC(=O)NCCC 62a_100000210326_100000183358 [2,0,0,0,0,0|2,0,0]=4 2365 B12R0.206 CCCCCSCC(=O)OCCC 62a_100000210326_200011215008 [2,0,0,0,0,0|1,0,0]=3 2366 B12R0.206 CCCCCSCC(=O)OCCC 62a_200011215008_100000210326 [2,0,0,0,0,0|1,0,0]=3 2367 B12R0.206 CCCCNCOC(=O)OCCC 7a_106832991798_200000139673 [2,0,0,0,0,0|2,0,0]=4 2368 B12R0.206 CCCCOCCC(=O)CCCC 1458a_100000210183_100000743108 [2,0,0,0,0,0|2,0,0]=4 2369 B12R0.206 CCCCOCOC(=O)OCCC 34a_100000210227_200000139673 [2,0,0,0,0,0|2,0,0]=4 2370 B12R0.206 CCCCOCOC(=O)OCCC 7a_100000210227_200000139673 [2,0,0,0,0,0|2,0,0]=4 2371 B12R0.206 CCCCSCOC(=O)OCCC 62a_100000210211_200000139673 [2,0,0,0,0,0|2,0,0]=4 2372 B12R0.206 CCCNC(=O)CCCCCCO 240690a_100020643023_100011996774 [2,0,0,0,0,0|2,0,0]=4 2373 B12R0.206 CCCNC(=O)CCCCCOC 11a_100020643023_100011935119 [2,0,0,0,0,0|2,0,0]=4 2374 B12R0.206 CCCNC(=O)CCCCCOC 1626a_100020643023_100011935119 [2,0,0,0,0,0|2,0,0]=4 2375 B12R0.206 CCCNC(=O)CCCCCOC 240690a_100020643023_100011935119 [2,0,0,0,0,0|2,0,0]=4 2376 B12R0.206 CCCNC(=O)CCCCCOC 527a_100020643023_100011935119 [2,0,0,0,0,0|2,0,0]=4 2377 B12R0.206 CCCNC(=O)CCCSCCC 62a_100000210303_100011194427 [2,0,0,0,0,0|2,0,0]=4 2378 B12R0.206 CCCNC(=O)CCCSCCC 62a_100011194427_100000210303 [2,0,0,0,0,0|2,0,0]=4 2379 B12R0.206 CCCOC(=O)CNCCCCO 2230a_100000750430_200011215008 [2,0,0,0,0,0|2,0,0]=4 2380 B12R0.206 CCCOC(=O)CNCCCCO 34a_100000750430_200011215008 [2,0,0,0,0,0|2,0,0]=4 2381 B12R0.206 CCCOC(=O)CNCCCOC 34a_100150723488_200011215008 [2,0,0,0,0,0|2,0,0]=4 2382 B12R0.206 CCCOC(=O)CNCCCSC 2230a_100000749238_200011215008 [2,0,0,0,0,0|2,0,0]=4 2383 B12R0.206 CCCOC(=O)CNCCOCC 2230a_102516460346_200011215008 [2,0,0,0,0,0|2,0,0]=4 2384 B12R0.206 CCCOC(=O)CNCCOCC 34a_102516460346_200011215008 [2,0,0,0,0,0|2,0,0]=4 2385 B12R0.206 CCCOC(=O)CNCCSCC 2230a_100000106463_200011215008 [2,0,0,0,0,0|2,0,0]=4 2386 B12R0.206 CCCOC(=O)COCCCCBr 34a_100011216708_200011215008 [2,0,0,0,0,0|2,0,0]=4 2387 B12R0.206 CCCOC(=O)COCCCCCl 34a_100000210776_200011215008 [2,0,0,0,0,0|2,0,0]=4 2388 B12R0.206 CCCOC(=O)COCCCCCl 7a_100000210776_200011215008 [2,0,0,0,0,0|2,0,0]=4 2389 B12R0.206 CCCOC(=O)COCCCCF 34a_100011995726_200011215008 [2,0,0,0,0,0|2,0,0]=4 2390 B12R0.206 CCCOC(=O)COCCCCF 7a_100011995726_200011215008 [2,0,0,0,0,0|2,0,0]=4 2391 B12R0.206 CCCOC(=O)COCCCCI 34a_200012148704_200011215008 [2,0,0,0,0,0|2,0,0]=4 2392 B12R0.206 CCCOC(=O)COCCCCN 34a_100000750430_200011215008 [2,0,0,0,0,0|2,0,0]=4 2393 B12R0.206 CCCOC(=O)COCCCNC 34a_100000213112_200011215008 [2,0,0,0,0,0|2,0,0]=4 2394 B12R0.206 CCCOC(=O)COCCCOC 34a_100000740835_200011215008 [2,0,0,0,0,0|2,0,0]=4 2395 B12R0.206 CCCOC(=O)COCCCSC 34a_100000690336_200011215008 [2,0,0,0,0,0|2,0,0]=4 2396 B12R0.206 CCCOC(=O)COCCCSC 7a_100000690336_200011215008 [2,0,0,0,0,0|2,0,0]=4 2397 B12R0.206 CCCOC(=O)COCCOCC 34a_100000210136_200011215008 [2,0,0,0,0,0|2,0,0]=4 2398 B12R0.206 CCCOC(=O)COCCOCC 7a_100000210136_200011215008 [2,0,0,0,0,0|2,0,0]=4 2399 B12R0.206 CCCOC(=O)COCCSCC 34a_100000212035_200011215008 [2,0,0,0,0,0|2,0,0]=4 2400 B12R0.206 CCCOC(=O)COCCSCC 7a_100000212035_200011215008 [2,0,0,0,0,0|2,0,0]=4 2401 B12R0.206 CCCOC(=O)CSCCCCF 62a_100000729493_200011215008 [2,0,0,0,0,0|2,0,0]=4 2402 B12R0.206 CCCOC(=O)CSCCCCF 62a_200011215008_100000729493 [2,0,0,0,0,0|2,0,0]=4 2403 B12R0.206 CCCOC(=O)CSCCCCO 62a_100000210776_200011215008 [2,0,0,0,0,0|2,0,0]=4 2404 B12R0.206 CCCOC(=O)CSCCCCO 62a_200011215008_100000210776 [2,0,0,0,0,0|2,0,0]=4 2405 B12R0.206 CCCOC(=O)CSCCCOC 62a_100000709357_200011215008 [2,0,0,0,0,0|2,0,0]=4 2406 B12R0.206 CCCOC(=O)CSCCCOC 62a_200011215008_100000709357 [2,0,0,0,0,0|2,0,0]=4 2407 B12R0.206 CCCOC(=O)CSCCOCC 62a_100000210147_200011215008 [2,0,0,0,0,0|2,0,0]=4 2408 B12R0.206 CCCOC(=O)CSCCOCC 62a_200011215008_100011215890 [2,0,0,0,0,0|2,0,0]=4 2409 B12R0.206 CCCOC(=O)CSCCSCC 62a_100000757381_200011215008 [2,0,0,0,0,0|2,0,0]=4 2410 B12R0.206 CCCOC(=O)CSCCSCC 62a_200011215008_100000757381 [2,0,0,0,0,0|2,0,0]=4 2411 B12R0.206 COCCCCCC(=O)CCCF 1458a_100011935119_100011934791 [2,0,0,0,0,0|2,0,0]=4 2412 B12R0.206 COCCCCCC(=O)CCCO 1458a_100011935119_100011215043 [2,0,0,0,0,0|1,0,0]=3 2413 B12R0.206 COCCCCCC(=O)NCCO 240690a_100000210304_100011935119 [2,0,0,0,0,0|2,0,0]=4 2414 B12R0.206 COCCCCCC(=O)NCCO 527a_100000210304_100011935119 [2,0,0,0,0,0|2,0,0]=4 2415 B12R0.206 COCCOCCC(=O)CCCO 1458a_100000745395_100011215043 [2,0,0,0,0,0|2,0,0]=4 2416 B12R0.206 O=C(CCCCCCO)NCCO 240690a_100000210304_100011996774 [2,0,0,0,0,0|2,0,0]=4 2417 B12R0.206 O=C(CCCF)CCCCCCO 1458a_100011996774_100011934791 [2,0,0,0,0,0|2,0,0]=4 2418 B12R0.206 O=C(CCCO)CCCCCCO 1458a_100011996774_100011215043 [2,0,0,0,0,0|1,0,0]=3 2419 B12R0.255 CC(O)CCC(=O)CCCCCO 1458a_100102619762_100012276601 [2,0,0,0,0,0|2,0,0]=4 2420 B12R0.255 CC(O)CNC(=O)CCCCCO 240690a_100000210904_100102619762 [2,0,0,0,0,0|2,0,0]=4 2421 B12R0.255 CCCCCCC(=O)CCC(C)C 1458a_100000181311_100000210757 [2,0,0,0,0,0|2,0,0]=4 2422 B12R0.255 CCCCCCC(=O)CCC(C)C 1458a_100102632555_100000210312 [2,0,0,0,0,0|2,0,0]=4 2423 B12R0.255 CCCCCCC(=O)CCC(C)O 1458a_100102632555_100012276601 [2,0,0,0,0,0|1,0,0]=3 2424 B12R0.255 CCCCCCC(=O)NCC(C)C 11a_100000210953_100102632555 [2,0,0,0,0,0|2,0,0]=4 2425 B12R0.255 CCCCCCC(=O)NCC(C)C 1626a_100000210953_100102632555 [2,0,0,0,0,0|2,0,0]=4 2426 B12R0.255 CCCCCCC(=O)NCC(C)C 240690a_100000210953_100102632555 [2,0,0,0,0,0|2,0,0]=4 2427 B12R0.255 CCCCCCC(=O)NCC(C)C 527a_100000210953_100102632555 [2,0,0,0,0,0|2,0,0]=4 2428 B12R0.255 CCCCCCC(=O)NCC(C)O 11a_100000210904_100102632555 [2,0,0,0,0,0|1,0,0]=3 2429 B12R0.255 CCCCCCC(=O)NCC(C)O 240690a_100000210904_100102632555 [2,0,0,0,0,0|1,0,0]=3 2430 B12R0.255 CCCCCCC(=O)NCC(C)O 527a_100000210904_100102632555 [2,0,0,0,0,0|1,0,0]=3 2431 B12R0.255 CCCCCCC(C)OCC(C)O 34a_100000210265_100011218427 [2,0,0,0,0,0|1,0,1]=4 2432 B12R0.255 CCCCCCC(C)OCC(C)O 7a_100000210265_100011218427 [2,0,0,0,0,0|1,0,1]=4 2433 B12R0.255 CCCCCCC(C)OC[C@@H](C)O 34a_100000210265_100009817552 [2,0,0,0,0,0|1,0,1]=4 2434 B12R0.255 CCCCCCC(C)OC[C@@H](C)O 7a_100000210265_100009817552 [2,0,0,0,0,0|1,0,1]=4 2435 B12R0.255 CCCCCNC(=O)CCC(C)O 1626a_100000209983_100000718519 [2,0,0,0,0,0|2,0,0]=4 2436 B12R0.255 CCCCCNC(=O)NCC(C)O 2708a_100000209983_100000210904 [2,0,0,0,0,0|2,0,0]=4 2437 B12R0.255 CCCCCNC(=O)NCC(C)O 273464a_100000209983_100000210904 [2,0,0,0,0,0|2,0,0]=4 2438 B12R0.255 CCCCCNC(=O)NCC(C)O 273464a_100000210904_100000209983 [2,0,0,0,0,0|2,0,0]=4 2439 B12R0.255 CCCCCNC(=O)NCC(C)O 512a_100000209983_100000210904 [2,0,0,0,0,0|2,0,0]=4 2440 B12R0.255 CCCCCNC(=O)NCC(C)O 512a_100000210904_100000209983 [2,0,0,0,0,0|2,0,0]=4 2441 B12R0.255 CCCCOCC(=O)CCC(C)O 1458a_100000757543_100012276601 [2,0,0,0,0,0|2,0,0]=4 2442 B12R0.255 CCCCOCC(=O)NCC(C)O 11a_100000210904_100000757543 [2,0,0,0,0,0|2,0,0]=4 2443 B12R0.255 CCCCOCC(=O)NCC(C)O 240690a_100000210904_100000757543 [2,0,0,0,0,0|2,0,0]=4 2444 B12R0.255 CCCCOCC(=O)NCC(C)O 527a_100000210904_100000757543 [2,0,0,0,0,0|2,0,0]=4 2445 B12R0.255 CCCCSCC(=O)CCC(C)O 1458a_100000191162_100012276601 [2,0,0,0,0,0|2,0,0]=4 2446 B12R0.255 CCCCSCC(=O)NCC(C)O 11a_100000210904_100000191162 [2,0,0,0,0,0|2,0,0]=4 2447 B12R0.255 CCCCSCC(=O)NCC(C)O 240690a_100000210904_100000191162 [2,0,0,0,0,0|2,0,0]=4 2448 B12R0.255 CCCCSCC(=O)NCC(C)O 527a_100000210904_100000191162 [2,0,0,0,0,0|2,0,0]=4 2449 B12R0.47 CCCCCCC(=O)CCCCC 1458a_100000212188_100000210757 [2,0,0,0,0,0|2,0,0]=4 2450 B12R0.47 CCCCCCC(=O)CCCCC 1458a_100102632555_100000210326 [2,0,0,0,0,0|2,0,0]=4 2451 B12R0.47 CCCCCCC(=O)CCCCF 1458a_100102632555_100000729493 [2,0,0,0,0,0|2,0,0]=4 2452 B12R0.47 CCCCCCC(=O)CCCCO 1458a_100000695505_100000210757 [2,0,0,0,0,0|1,0,0]=3 2453 B12R0.47 CCCCCCC(=O)CCCCO 1458a_100102632555_100000210776 [2,0,0,0,0,0|1,0,0]=3 2454 B12R0.47 CCCCCCC(=O)COCCO 1458a_100000708028_100000210757 [2,0,0,0,0,0|2,0,0]=4 2455 B12R0.47 CCCCCCC(=O)NCCCC 11a_100000102301_100102632555 [2,0,0,0,0,0|2,0,0]=4 2456 B12R0.47 CCCCCCC(=O)NCCCC 1626a_100000102301_100102632555 [2,0,0,0,0,0|2,0,0]=4 2457 B12R0.47 CCCCCCC(=O)NCCCC 240690a_100000102301_100102632555 [2,0,0,0,0,0|2,0,0]=4 2458 B12R0.47 CCCCCCC(=O)NCCCC 527a_100000102301_100102632555 [2,0,0,0,0,0|2,0,0]=4 2459 B12R0.47 CCCCCCC(=O)NCCCF 11a_100015189416_100102632555 [2,0,0,0,0,0|2,0,0]=4 2460 B12R0.47 CCCCCCC(=O)NCCCF 1626a_100015189416_100102632555 [2,0,0,0,0,0|2,0,0]=4 2461 B12R0.47 CCCCCCC(=O)NCCCF 240690a_100015189416_100102632555 [2,0,0,0,0,0|2,0,0]=4 2462 B12R0.47 CCCCCCC(=O)NCCCF 527a_100015189416_100102632555 [2,0,0,0,0,0|2,0,0]=4 2463 B12R0.47 CCCCCCC(=O)NCCCO 240690a_100000182051_100102632555 [2,0,0,0,0,0|1,0,0]=3 2464 B12R0.47 CCCCCCC(=O)NCCCO 527a_100000182051_100102632555 [2,0,0,0,0,0|1,0,0]=3 2465 B12R0.47 CCCCCCC(=O)NNCCO 22a_100000210001_100102632555 [2,0,0,0,0,0|2,0,0]=4 2466 B12R0.47 CCCCCCC(C)OCCCO 34a_100000210265_100000230001 [2,0,0,0,0,0|1,0,1]=4 2467 B12R0.47 CCCCCCC(C)OCCCO 7a_100000210265_100011215043 [2,0,0,0,0,0|1,0,1]=4 2468 B12R0.47 CCCCCNC(=O)CCCCO 1626a_100000209983_100000695505 [2,0,0,0,0,0|2,0,0]=4 2469 B12R0.47 CCCCCNC(=O)NCCCO 2708a_100000209983_100000182051 [2,0,0,0,0,0|2,0,0]=4 2470 B12R0.47 CCCCCNC(=O)NCCCO 273464a_100000182051_100000209983 [2,0,0,0,0,0|2,0,0]=4 2471 B12R0.47 CCCCCNC(=O)NCCCO 273464a_100000209983_100000182051 [2,0,0,0,0,0|2,0,0]=4 2472 B12R0.47 CCCCCNC(=O)NCCCO 512a_100000209983_100000182051 [2,0,0,0,0,0|2,0,0]=4 2473 B12R0.47 CCCCNCC(=O)OCCCC 2230a_100000102301_100000211628 [2,0,0,0,0,0|2,0,0]=4 2474 B12R0.47 CCCCNCC(=O)OCCCC 7a_106832991798_100000211628 [2,0,0,0,0,0|2,0,0]=4 2475 B12R0.47 CCCCOC(=O)CSCCCC 62a_100000210211_100000211628 [2,0,0,0,0,0|2,0,0]=4 2476 B12R0.47 CCCCOC(=O)CSCCCC 62a_100000211628_100000210210 [2,0,0,0,0,0|2,0,0]=4 2477 B12R0.47 CCCCOCC(=O)CCCCO 1458a_100000695505_100011995733 [2,0,0,0,0,0|2,0,0]=4 2478 B12R0.47 CCCCOCC(=O)CCCCO 1458a_100000757543_100000210776 [2,0,0,0,0,0|2,0,0]=4 2479 B12R0.47 CCCCOCC(=O)NCCCO 240690a_100000182051_100000757543 [2,0,0,0,0,0|2,0,0]=4 2480 B12R0.47 CCCCOCC(=O)NCCCO 527a_100000182051_100000757543 [2,0,0,0,0,0|2,0,0]=4 2481 B12R0.47 CCCCOCC(=O)OCCCC 34a_100000210227_100000211628 [2,0,0,0,0,0|2,0,0]=4 2482 B12R0.47 CCCCOCC(=O)OCCCC 7a_100000210227_100000211628 [2,0,0,0,0,0|2,0,0]=4 2483 B12R0.47 CCCCSCC(=O)CCCCO 1458a_100000191162_100000210776 [2,0,0,0,0,0|2,0,0]=4 2484 B12R0.47 CCCCSCC(=O)NCCCO 240690a_100000182051_100000191162 [2,0,0,0,0,0|2,0,0]=4 2485 B12R0.47 CCCCSCC(=O)NCCCO 527a_100000182051_100000191162 [2,0,0,0,0,0|2,0,0]=4 2486 B12R0.47 CCCOCCC(=O)CCCCO 1458a_100000695505_100011215938 [2,0,0,0,0,0|2,0,0]=4 2487 B12R0.47 CCOCCCC(=O)CCCCO 1458a_100000695505_100012232248 [2,0,0,0,0,0|2,0,0]=4 2488 B12R0.47 COCCCCC(=O)CCCCO 1458a_100000695505_100000755781 [2,0,0,0,0,0|2,0,0]=4 2489 B12R0.47 O=C(CCCCCO)NCCCO 240690a_100000182051_100102619762 [2,0,0,0,0,0|2,0,0]=4 2490 B12R0.47 O=C(CCCCO)CCCCCF 1458a_100000695505_100000729378 [2,0,0,0,0,0|2,0,0]=4 2491 B12R0.47 O=C(CCCCO)CCCCCO 1458a_100000695505_100000746330 [2,0,0,0,0,0|2,0,0]=4 2492 B12R0.47 O=C(CCCCO)CCCCCO 1458a_100102619762_100000210776 [2,0,0,0,0,0|2,0,0]=4 2493 B12R0.142 CCCCCC(=O)NCC(C)CO 240690a_100000744482_100000212188 [2,0,0,0,0,0|2,0,0]=4 2494 B12R0.142 CCCCCC(=O)NCC(C)CO 527a_100000744482_100000212188 [2,0,0,0,0,0|2,0,0]=4 2495 B12R0.142 CCCCCC(=O)NCC(O)CC 11a_100011218483_100000212188 [2,0,0,0,0,0|2,0,0]=4 2496 B12R0.142 CCCCCC(=O)NCC(O)CC 240690a_100011218483_100000212188 [2,0,0,0,0,0|2,0,0]=4 2497 B12R0.142 CCCCCC(=O)NCC(O)CC 527a_100011218483_100000212188 [2,0,0,0,0,0|2,0,0]=4 2498 B12R0.142 CCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000212188 [2,0,0,0,0,0|2,0,0]=4 2499 B12R0.142 CCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100000212188 [2,0,0,0,0,0|2,0,0]=4 2500 B12R0.142 CCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000212188 [2,0,0,0,0,0|1,0,0]=3 2501 B12R0.142 CCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000212188 [2,0,0,0,0,0|1,0,0]=3 2502 B12R0.142 CCCCCC(C)OCC(O)CO 34a_100011215632_100011219619 [2,0,0,0,0,0|1,0,1]=4 2503 B12R0.142 CCCCCC(C)OCC(O)CO 7a_100011215632_100011219619 [2,0,0,0,0,0|1,0,1]=4 2504 B12R0.142 CCCCCC(C)OC[C@@H](O)CO 34a_100011215632_100009815848 [2,0,0,0,0,0|1,0,1]=4 2505 B12R0.142 CCCCCC(C)OC[C@@H](O)CO 7a_100011215632_100009815848 [2,0,0,0,0,0|1,0,1]=4 2506 B12R0.142 CCCCNC(=O)NC[C@H](O)CO 2708a_100000102301_100020644852 [2,0,0,0,0,0|2,0,0]=4 2507 B12R0.142 CCCCNC(=O)NC[C@H](O)CO 273464a_100000102301_100020644852 [2,0,0,0,0,0|2,0,0]=4 2508 B12R0.142 CCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000102301 [2,0,0,0,0,0|2,0,0]=4 2509 B12R0.142 CCCOCC(=O)NCC(O)CO 34a_100000210258_200012027429 [2,0,0,0,0,0|2,0,0]=4 2510 B12R0.142 CCCOCC(=O)NC[C@H](O)CO 240690a_100020644852_100000745993 [2,0,0,0,0,0|2,0,0]=4 2511 B12R0.142 CCCOCC(=O)NC[C@H](O)CO 527a_100020644852_100000745993 [2,0,0,0,0,0|2,0,0]=4 2512 B12R0.142 CCCSCC(=O)NCC(O)CO 62a_100000210303_200012027429 [2,0,0,0,0,0|2,0,0]=4 2513 B12R0.142 CCCSCC(=O)NCC(O)CO 62a_200012027429_100000210303 [2,0,0,0,0,0|2,0,0]=4 2514 B12R0.142 CCCSCC(=O)NC[C@H](O)CO 240690a_100020644852_100000217233 [2,0,0,0,0,0|2,0,0]=4 2515 B12R0.142 CCCSCC(=O)NC[C@H](O)CO 527a_100020644852_100000217233 [2,0,0,0,0,0|2,0,0]=4 2516 B12R0.142 CCOCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000749530 [2,0,0,0,0,0|2,0,0]=4 2517 B12R0.142 CCOCCC(=O)NC[C@H](O)CO 527a_100020644852_100000749530 [2,0,0,0,0,0|2,0,0]=4 2518 B12R0.142 CCSCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000230768 [2,0,0,0,0,0|2,0,0]=4 2519 B12R0.142 CCSCCC(=O)NC[C@H](O)CO 527a_100020644852_100000230768 [2,0,0,0,0,0|2,0,0]=4 2520 B12R0.142 COCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000741012 [2,0,0,0,0,0|2,0,0]=4 2521 B12R0.142 COCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000741012 [2,0,0,0,0,0|2,0,0]=4 2522 B12R0.142 CSCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000173376 [2,0,0,0,0,0|2,0,0]=4 2523 B12R0.142 CSCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000173376 [2,0,0,0,0,0|2,0,0]=4 2524 B14R0.82 CCCCCCCCN(C)CC(O)CO 2230a_100000207567_100011219619 [1,1,0,0,0,0|1,0,1]=4 2525 B14R0.82 CCCCCCCCN(C)CC(O)CO 2230a_100011216503_100000210759 [1,1,0,0,0,0|1,0,1]=4 2526 B14R0.82 CCCCCCCCN(C)CC(O)CO 269982a_100011216503_100000210759 [1,1,0,0,0,0|1,0,1]=4 2527 B14R0.82 CCCCCCCCN(C)C[C@@H](O)CO 2230a_100000207567_100009815848 [1,1,0,0,0,0|1,0,1]=4 2528 B14R0.197 CCC(C)CCCCCOCC(O)CC 7a_200000035636_100011218378 [1,1,0,0,0,0|1,0,1]=4 2529 B14R0.197 CCC(C)CCCCCOCC(O)CO 7a_200000035636_100011219619 [1,1,0,0,0,0|0,0,1]=3 2530 B14R0.197 CCC(C)CCCCCOC[C@@H](C)CO 7a_200000035636_100000059175 [1,1,0,0,0,0|1,0,1]=4 2531 B14R0.197 CCC(C)CCCCCOC[C@@H](O)CF 7a_200000035636_100015614560 [1,1,0,0,0,0|1,0,1]=4 2532 B14R0.197 CCC(C)CCCCCOC[C@@H](O)CO 7a_200000035636_100009815848 [1,1,0,0,0,0|0,0,1]=3 2533 B14R0.305 CC(C)CCCCCCNCC(O)CO 2230a_100000211014_100011219619 [1,1,0,0,0,0|1,0,1]=4 2534 B14R0.305 CC(C)CCCCCCNCC(O)CO 34a_100000211014_100011219619 [1,1,0,0,0,0|1,0,1]=4 2535 B14R0.305 CC(C)CCCCCCNC[C@@H](O)CO 2230a_100000211014_100009815848 [1,1,0,0,0,0|1,0,1]=4 2536 B14R0.305 CC(C)CCCCCCNC[C@@H](O)CO 34a_100000211014_100009815848 [1,1,0,0,0,0|1,0,1]=4 2537 B14R0.305 CC(C)NCCCCCOCC(O)CO 34a_100011629493_100011219619 [1,1,0,0,0,0|1,0,1]=4 2538 B14R0.305 CC(C)NCCCCCOC[C@@H](O)CO 34a_100011629493_100009815848 [1,1,0,0,0,0|1,0,1]=4 2539 B14R0.337 C#CCCCCCCCOCC(O)CO 34a_100000054614_100011219619 [1,1,0,0,0,0|0,0,2]=4 2540 B14R0.337 C#CCCCCCCCOCC(O)CO 7a_100000054614_100011219619 [1,1,0,0,0,0|0,0,2]=4 2541 B14R0.337 C#CCCCCCCCOC[C@@H](O)CO 34a_100000054614_100009815848 [1,1,0,0,0,0|0,0,2]=4 2542 B14R0.337 C#CCCCCCCCOC[C@@H](O)CO 7a_100000054614_100009815848 [1,1,0,0,0,0|0,0,2]=4 2543 B14R0.337 C=CCCCCCCCOCC(O)CO 34a_100000730831_100011219619 [1,1,0,0,0,0|0,0,2]=4 2544 B14R0.337 C=CCCCCCCCOCC(O)CO 7a_100000730831_100011219619 [1,1,0,0,0,0|0,0,2]=4 2545 B14R0.337 C=CCCCCCCCOC[C@@H](O)CO 34a_100000730831_100009815848 [1,1,0,0,0,0|0,0,2]=4 2546 B14R0.337 C=CCCCCCCCOC[C@@H](O)CO 7a_100000730831_100009815848 [1,1,0,0,0,0|0,0,2]=4 2547 B14R0.337 CC/C=C\CCCCCOCC(O)CO 34a_100016268722_100011219619 [1,1,0,0,0,0|0,0,2]=4 2548 B14R0.337 CC/C=C\CCCCCOCC(O)CO 7a_100016268722_100011219619 [1,1,0,0,0,0|0,0,2]=4 2549 B14R0.337 CC/C=C\CCCCCOC[C@@H](O)CO 34a_100016268722_100009815848 [1,1,0,0,0,0|0,0,2]=4 2550 B14R0.337 CC/C=C\CCCCCOC[C@@H](O)CO 7a_100016268722_100009815848 [1,1,0,0,0,0|0,0,2]=4 2551 B14R0.337 CCC(O)COCCCCCCCCBr 34a_100009813846_100011218378 [1,1,0,0,0,0|1,0,1]=4 2552 B14R0.337 CCC(O)COCCCCCCCCBr 7a_100009813846_100011218378 [1,1,0,0,0,0|1,0,1]=4 2553 B14R0.337 CCC(O)COCCCCCCCCCl 34a_100000033203_100011218378 [1,1,0,0,0,0|1,0,1]=4 2554 B14R0.337 CCC(O)COCCCCCCCCCl 7a_100000033203_100011218378 [1,1,0,0,0,0|1,0,1]=4 2555 B14R0.337 CCC(O)COCCCCCCCCN 34a_102515433106_100011218378 [1,1,0,0,0,0|1,0,1]=4 2556 B14R0.337 CCCCC/C=C\CCOCC(O)CO 34a_100016277358_100011219619 [1,1,0,0,0,0|0,0,2]=4 2557 B14R0.337 CCCCC/C=C\CCOCC(O)CO 7a_100016277358_100011219619 [1,1,0,0,0,0|0,0,2]=4 2558 B14R0.337 CCCCC/C=C\CCOC[C@@H](O)CO 34a_100016277358_100009815848 [1,1,0,0,0,0|0,0,2]=4 2559 B14R0.337 CCCCC/C=C\CCOC[C@@H](O)CO 7a_100016277358_100009815848 [1,1,0,0,0,0|0,0,2]=4 2560 B14R0.337 CCCCCC#CCCOCC(O)CO 34a_200000042877_100011219619 [1,1,0,0,0,0|0,0,2]=4 2561 B14R0.337 CCCCCC#CCCOCC(O)CO 7a_200000042877_100011219619 [1,1,0,0,0,0|0,0,2]=4 2562 B14R0.337 CCCCCC#CCCOC[C@@H](O)CO 34a_200000042877_100009815848 [1,1,0,0,0,0|0,0,2]=4 2563 B14R0.337 CCCCCC#CCCOC[C@@H](O)CO 7a_200000042877_100009815848 [1,1,0,0,0,0|0,0,2]=4 2564 B14R0.337 CCCCCC/C=C/COCC(O)CC 34a_200016276170_100011218378 [1,1,0,0,0,0|1,0,1]=4 2565 B14R0.337 CCCCCC/C=C/COCC(O)CC 7a_200016276170_100011218378 [1,1,0,0,0,0|1,0,1]=4 2566 B14R0.337 CCCCCC/C=C/COCC(O)CO 34a_200016276170_100011219619 [1,1,0,0,0,0|0,0,1]=3 2567 B14R0.337 CCCCCC/C=C/COCC(O)CO 7a_200016276170_100011219619 [1,1,0,0,0,0|0,0,1]=3 2568 B14R0.337 CCCCCC/C=C/COC[C@@H](C)CO 34a_200016276170_100000059175 [1,1,0,0,0,0|1,0,1]=4 2569 B14R0.337 CCCCCC/C=C/COC[C@@H](C)CO 7a_200016276170_100000059175 [1,1,0,0,0,0|1,0,1]=4 2570 B14R0.337 CCCCCC/C=C/COC[C@@H](O)CF 34a_200016276170_100015614560 [1,1,0,0,0,0|1,0,1]=4 2571 B14R0.337 CCCCCC/C=C/COC[C@@H](O)CF 7a_200016276170_100015614560 [1,1,0,0,0,0|1,0,1]=4 2572 B14R0.337 CCCCCC/C=C/COC[C@@H](O)CO 34a_200016276170_100009815848 [1,1,0,0,0,0|0,0,1]=3 2573 B14R0.337 CCCCCC/C=C/COC[C@@H](O)CO 7a_200016276170_100009815848 [1,1,0,0,0,0|0,0,1]=3 2574 B14R0.337 CCCCCCC#CCOCC(O)CO 34a_200000037284_100011219619 [1,1,0,0,0,0|0,0,2]=4 2575 B14R0.337 CCCCCCC#CCOCC(O)CO 7a_200000037284_100011219619 [1,1,0,0,0,0|0,0,2]=4 2576 B14R0.337 CCCCCCC#CCOC[C@@H](O)CO 34a_200000037284_100009815848 [1,1,0,0,0,0|0,0,2]=4 2577 B14R0.337 CCCCCCC#CCOC[C@@H](O)CO 7a_200000037284_100009815848 [1,1,0,0,0,0|0,0,2]=4 2578 B14R0.337 CCCCCCCC=NNCC(O)CC 4a_100015206393_100000210592 [1,1,0,0,0,0|2,0,0]=4 2579 B14R0.337 CCCCCCCCCNCC(O)CO 2230a_100000212291_100011219619 [1,1,0,0,0,0|1,0,1]=4 2580 B14R0.337 CCCCCCCCCNCC(O)CO 34a_100000212291_100011219619 [1,1,0,0,0,0|1,0,1]=4 2581 B14R0.337 CCCCCCCCCNC[C@@H](O)CO 2230a_100000212291_100009815848 [1,1,0,0,0,0|1,0,1]=4 2582 B14R0.337 CCCCCCCCCNC[C@@H](O)CO 34a_100000212291_100009815848 [1,1,0,0,0,0|1,0,1]=4 2583 B14R0.337 CCCCCCCCCNC[C@H](O)CO 2230a_100020644852_100011214924 [1,1,0,0,0,0|1,0,1]=4 2584 B14R0.337 CCCCCCCCCOCC(O)CC 34a_100000210712_100011218378 [1,1,0,0,0,0|1,0,1]=4 2585 B14R0.337 CCCCCCCCCOCC(O)CC 7a_100000210712_100011218378 [1,1,0,0,0,0|1,0,1]=4 2586 B14R0.337 CCCCCCCCCOCC(O)CO 34a_100000210712_100011219619 [1,1,0,0,0,0|0,0,1]=3 2587 B14R0.337 CCCCCCCCCOCC(O)CO 7a_100000210712_100011219619 [1,1,0,0,0,0|0,0,1]=3 2588 B14R0.337 CCCCCCCCCOC[C@@H](C)CO 34a_100000210712_100000059175 [1,1,0,0,0,0|1,0,1]=4 2589 B14R0.337 CCCCCCCCCOC[C@@H](C)CO 7a_100000210712_100000059175 [1,1,0,0,0,0|1,0,1]=4 2590 B14R0.337 CCCCCCCCCOC[C@@H](O)CF 34a_100000210712_100015614560 [1,1,0,0,0,0|1,0,1]=4 2591 B14R0.337 CCCCCCCCCOC[C@@H](O)CF 7a_100000210712_100015614560 [1,1,0,0,0,0|1,0,1]=4 2592 B14R0.337 CCCCCCCCCOC[C@@H](O)CO 34a_100000210712_100009815848 [1,1,0,0,0,0|0,0,1]=3 2593 B14R0.337 CCCCCCCCCOC[C@@H](O)CO 7a_100000210712_100009815848 [1,1,0,0,0,0|0,0,1]=3 2594 B14R0.337 CCCCCCCCCSCC(O)CO 62a_100011219619_100000210670 [1,1,0,0,0,0|0,1,1]=4 2595 B14R0.337 CCCCCCCCCSC[C@@H](O)CO 62a_100009815848_100000210670 [1,1,0,0,0,0|0,1,1]=4 2596 B14R0.337 CCCCCCOCCOCC(O)CC 34a_100000691444_100011218378 [1,1,0,0,0,0|1,0,1]=4 2597 B14R0.337 CCCCCCOCCOCC(O)CC 7a_100000691444_100011218378 [1,1,0,0,0,0|1,0,1]=4 2598 B14R0.337 CCCCCCOCCOCC(O)CO 34a_100000691444_100011219619 [1,1,0,0,0,0|0,0,1]=3 2599 B14R0.337 CCCCCCOCCOCC(O)CO 7a_100000691444_100011219619 [1,1,0,0,0,0|0,0,1]=3 2600 B14R0.337 CCCCCCOCCOC[C@@H](C)CO 34a_100000691444_100000059175 [1,1,0,0,0,0|1,0,1]=4 2601 B14R0.337 CCCCCCOCCOC[C@@H](C)CO 7a_100000691444_100000059175 [1,1,0,0,0,0|1,0,1]=4 2602 B14R0.337 CCCCCCOCCOC[C@@H](O)CF 34a_100000691444_100015614560 [1,1,0,0,0,0|1,0,1]=4 2603 B14R0.337 CCCCCCOCCOC[C@@H](O)CF 7a_100000691444_100015614560 [1,1,0,0,0,0|1,0,1]=4 2604 B14R0.337 CCCCCCOCCOC[C@@H](O)CO 34a_100000691444_100009815848 [1,1,0,0,0,0|0,0,1]=3 2605 B14R0.337 CCCCCCOCCOC[C@@H](O)CO 7a_100000691444_100009815848 [1,1,0,0,0,0|0,0,1]=3 2606 B14R0.337 CCCCNCCCCOCC(O)CC 34a_200011216965_100011218378 [1,1,0,0,0,0|1,0,1]=4 2607 B14R0.337 CCCCNCCCCOCC(O)CO 34a_200011216965_100011219619 [1,1,0,0,0,0|0,0,1]=3 2608 B14R0.337 CCCCNCCCCOC[C@@H](C)CO 34a_200011216965_100000059175 [1,1,0,0,0,0|1,0,1]=4 2609 B14R0.337 CCCCNCCCCOC[C@@H](O)CF 34a_200011216965_100015614560 [1,1,0,0,0,0|1,0,1]=4 2610 B14R0.337 CCCCNCCCCOC[C@@H](O)CO 34a_200011216965_100009815848 [1,1,0,0,0,0|0,0,1]=3 2611 B14R0.337 CCCCOCCCCOCC(O)CC 34a_200000760531_100011218378 [1,1,0,0,0,0|1,0,1]=4 2612 B14R0.337 CCCCOCCCCOCC(O)CC 7a_200000760531_100011218378 [1,1,0,0,0,0|1,0,1]=4 2613 B14R0.337 CCCCOCCCCOCC(O)CO 34a_200000760531_100011219619 [1,1,0,0,0,0|0,0,1]=3 2614 B14R0.337 CCCCOCCCCOCC(O)CO 7a_200000760531_100011219619 [1,1,0,0,0,0|0,0,1]=3 2615 B14R0.337 CCCCOCCCCOC[C@@H](C)CO 34a_200000760531_100000059175 [1,1,0,0,0,0|1,0,1]=4 2616 B14R0.337 CCCCOCCCCOC[C@@H](C)CO 7a_200000760531_100000059175 [1,1,0,0,0,0|1,0,1]=4 2617 B14R0.337 CCCCOCCCCOC[C@@H](O)CF 34a_200000760531_100015614560 [1,1,0,0,0,0|1,0,1]=4 2618 B14R0.337 CCCCOCCCCOC[C@@H](O)CF 7a_200000760531_100015614560 [1,1,0,0,0,0|1,0,1]=4 2619 B14R0.337 CCCCOCCCCOC[C@@H](O)CO 34a_200000760531_100009815848 [1,1,0,0,0,0|0,0,1]=3 2620 B14R0.337 CCCCOCCCCOC[C@@H](O)CO 7a_200000760531_100009815848 [1,1,0,0,0,0|0,0,1]=3 2621 B14R0.337 COCCCOCCCOCC(O)CO 34a_200011215475_100011219619 [1,1,0,0,0,0|1,0,1]=4 2622 B14R0.337 COCCCOCCCOCC(O)CO 7a_200011215475_100011219619 [1,1,0,0,0,0|1,0,1]=4 2623 B14R0.337 COCCCOCCCOC[C@@H](O)CO 34a_200011215475_100009815848 [1,1,0,0,0,0|1,0,1]=4 2624 B14R0.337 COCCCOCCCOC[C@@H](O)CO 7a_200011215475_100009815848 [1,1,0,0,0,0|1,0,1]=4 2625 B14R0.337 C[C@@H](CO)COCCCCCCCCBr 34a_100009813846_100000059175 [1,1,0,0,0,0|1,0,1]=4 2626 B14R0.337 C[C@@H](CO)COCCCCCCCCBr 7a_100009813846_100000059175 [1,1,0,0,0,0|1,0,1]=4 2627 B14R0.337 C[C@@H](CO)COCCCCCCCCCl 34a_100000033203_100000059175 [1,1,0,0,0,0|1,0,1]=4 2628 B14R0.337 C[C@@H](CO)COCCCCCCCCCl 7a_100000033203_100000059175 [1,1,0,0,0,0|1,0,1]=4 2629 B14R0.337 C[C@@H](CO)COCCCCCCCCN 34a_102515433106_100000059175 [1,1,0,0,0,0|1,0,1]=4 2630 B14R0.337 NCCCCCCCCOCC(O)CO 34a_102515433106_100011219619 [1,1,0,0,0,0|0,0,1]=3 2631 B14R0.337 NCCCCCCCCOC[C@@H](O)CF 34a_102515433106_100015614560 [1,1,0,0,0,0|1,0,1]=4 2632 B14R0.337 NCCCCCCCCOC[C@@H](O)CO 34a_102515433106_100009815848 [1,1,0,0,0,0|0,0,1]=3 2633 B14R0.337 NCCNCCCCCOCC(O)CO 34a_103619048469_100011219619 [1,1,0,0,0,0|1,0,1]=4 2634 B14R0.337 NCCNCCCCCOC[C@@H](O)CO 34a_103619048469_100009815848 [1,1,0,0,0,0|1,0,1]=4 2635 B14R0.337 OCC(O)COCCCCCCCCBr 34a_100009813846_100011219619 [1,1,0,0,0,0|0,0,1]=3 2636 B14R0.337 OCC(O)COCCCCCCCCBr 7a_100009813846_100011219619 [1,1,0,0,0,0|0,0,1]=3 2637 B14R0.337 OCC(O)COCCCCCCCCCl 34a_100000033203_100011219619 [1,1,0,0,0,0|0,0,1]=3 2638 B14R0.337 OCC(O)COCCCCCCCCCl 7a_100000033203_100011219619 [1,1,0,0,0,0|0,0,1]=3 2639 B14R0.337 OCCCCCCCCNCC(O)CO 2230a_102515433106_100011219619 [1,1,0,0,0,0|1,0,1]=4 2640 B14R0.337 OCCCCCCCCNCC(O)CO 34a_102515433106_100011219619 [1,1,0,0,0,0|1,0,1]=4 2641 B14R0.337 OCCCCCCCCNC[C@@H](O)CO 2230a_102515433106_100009815848 [1,1,0,0,0,0|1,0,1]=4 2642 B14R0.337 OCCCCCCCCNC[C@@H](O)CO 34a_102515433106_100009815848 [1,1,0,0,0,0|1,0,1]=4 2643 B14R0.337 OCCCCCCCCNC[C@H](O)CO 2230a_100020644852_100000033203 [1,1,0,0,0,0|1,0,1]=4 2644 B14R0.337 OCCCCCCCCSCC(O)CO 62a_100000033203_100011219619 [1,1,0,0,0,0|0,1,1]=4 2645 B14R0.337 OCCCCCCCCSCC(O)CO 62a_100011219619_100000033203 [1,1,0,0,0,0|0,1,1]=4 2646 B14R0.337 OCCCCCCCCSC[C@@H](O)CO 62a_100000033203_100009815848 [1,1,0,0,0,0|0,1,1]=4 2647 B14R0.337 OCCCCCCCCSC[C@@H](O)CO 62a_100009815848_100000033203 [1,1,0,0,0,0|0,1,1]=4 2648 B14R0.337 OC[C@H](O)COCCCCCCCCBr 34a_100009813846_100009815848 [1,1,0,0,0,0|0,0,1]=3 2649 B14R0.337 OC[C@H](O)COCCCCCCCCBr 7a_100009813846_100009815848 [1,1,0,0,0,0|0,0,1]=3 2650 B14R0.337 OC[C@H](O)COCCCCCCCCCl 34a_100000033203_100009815848 [1,1,0,0,0,0|0,0,1]=3 2651 B14R0.337 OC[C@H](O)COCCCCCCCCCl 7a_100000033203_100009815848 [1,1,0,0,0,0|0,0,1]=3 2652 B14R0.337 O[C@@H](CF)COCCCCCCCCBr 34a_100009813846_100015614560 [1,1,0,0,0,0|1,0,1]=4 2653 B14R0.337 O[C@@H](CF)COCCCCCCCCBr 7a_100009813846_100015614560 [1,1,0,0,0,0|1,0,1]=4 2654 B14R0.337 O[C@@H](CF)COCCCCCCCCCl 34a_100000033203_100015614560 [1,1,0,0,0,0|1,0,1]=4 2655 B14R0.337 O[C@@H](CF)COCCCCCCCCCl 7a_100000033203_100015614560 [1,1,0,0,0,0|1,0,1]=4 2656 B14R0.393 CCCCCCCCNCC(O)COC 2230a_100000756049_100000210759 [1,1,0,0,0,0|1,0,1]=4 2657 B14R0.393 CCCCCCCCNCC(O)COC 34a_100000229939_100011215053 [1,1,0,0,0,0|1,0,1]=4 2658 B14R0.393 CCCCCCCCNCC(O)COC 34a_100000756049_100000210759 [1,1,0,0,0,0|1,0,1]=4 2659 B14R0.393 CCCCCCCCOCC(N)COC 34a_100000724102_100000210759 [1,1,0,0,0,0|1,0,1]=4 2660 B14R0.393 CCCCCCCCOCC(O)COC 34a_100000210232_100011215053 [1,1,0,0,0,0|0,0,1]=3 2661 B14R0.393 CCCCCCCCOCC(O)COC 7a_100000210232_100011215053 [1,1,0,0,0,0|0,0,1]=3 2662 B14R0.393 CCCCCCCCOC[C@@H](O)CC#N 7a_100000210232_100000001066 [1,1,0,0,0,0|1,0,1]=4 2663 B14R0.393 CCCCCCCCSCC(O)COC 62a_100000210759_100011215053 [1,1,0,0,0,0|0,1,1]=4 2664 B14R0.393 CCCCCCCCSCC(O)COC 62a_100011215053_100000210317 [1,1,0,0,0,0|0,1,1]=4 2665 B14R0.393 CCCCCNCCOCC(O)COC 34a_100000224656_100011215053 [1,1,0,0,0,0|1,0,1]=4 2666 B14R0.393 CCCCCOCCOCC(O)COC 34a_100011215259_100011215053 [1,1,0,0,0,0|1,0,1]=4 2667 B14R0.393 CCCCCOCCOCC(O)COC 7a_100011215259_100011215053 [1,1,0,0,0,0|1,0,1]=4 2668 B14R0.393 CCCCOCCCOCC(O)COC 34a_200011215613_100011215053 [1,1,0,0,0,0|1,0,1]=4 2669 B14R0.393 CCCCOCCCOCC(O)COC 7a_200011215613_100011215053 [1,1,0,0,0,0|1,0,1]=4 2670 B14R0.393 COCC(O)COCCCCCCCBr 34a_100000760002_100011215053 [1,1,0,0,0,0|1,0,1]=4 2671 B14R0.393 COCC(O)COCCCCCCCBr 7a_100000760002_100011215053 [1,1,0,0,0,0|1,0,1]=4 2672 B14R0.393 COCC(O)COCCCCCCCN 34a_100011996573_100011215053 [1,1,0,0,0,0|1,0,1]=4 2673 B14R0.393 COCCCCCCOCC(O)COC 34a_200012092642_100011215053 [1,1,0,0,0,0|1,0,1]=4 2674 B14R0.393 COCCCCCCOCC(O)COC 7a_200012092642_100011215053 [1,1,0,0,0,0|1,0,1]=4 2675 B14R0.2056 CCCCCCCCOCC(C)(C)CO 34a_100000210232_100009813988 [1,1,0,0,0,0|1,0,1]=4 2676 B14R0.2056 CCCCCCCCOCC(C)(C)CO 7a_100000210232_100009813988 [1,1,0,0,0,0|1,0,1]=4 2677 B14R0.2297 CCCCCCCCOCC(CC)OC 34a_100011934954_100000210759 [1,1,0,0,0,0|1,0,1]=4 2678 B14R0.2297 CCCCCCCCOCC(CC)OC 7a_100011934954_100000210759 [1,1,0,0,0,0|1,0,1]=4 2679 B14R0.92 CCCCCCCC(=O)NC(C)C(C)C 11a_100000211541_100000211969 [1,1,0,0,0,0|2,0,0]=4 2680 B14R0.92 CCCCCCCC(=O)NC(C)C(C)C 1626a_100000211541_100000211969 [1,1,0,0,0,0|2,0,0]=4 2681 B14R0.92 CCCCCCCC(=O)NC(C)C(C)C 240690a_100000211541_100000211969 [1,1,0,0,0,0|2,0,0]=4 2682 B14R0.92 CCCCCCCC(=O)NC(C)C(C)C 527a_100000211541_100000211969 [1,1,0,0,0,0|2,0,0]=4 2683 B14R0.93 C=CC(CCCCCCC)OCC(C)O 34a_200011934235_100011218427 [1,1,0,0,0,0|1,0,1]=4 2684 B14R0.93 C=CC(CCCCCCC)OCC(C)O 7a_200011934235_100011218427 [1,1,0,0,0,0|1,0,1]=4 2685 B14R0.93 C=CC(CCCCCCC)OC[C@@H](C)O 34a_200011934235_100009817552 [1,1,0,0,0,0|1,0,1]=4 2686 B14R0.93 C=CC(CCCCCCC)OC[C@@H](C)O 7a_200011934235_100009817552 [1,1,0,0,0,0|1,0,1]=4 2687 B14R0.93 CCCCCCCC(CC)OCC(C)O 34a_200011217053_100011218427 [1,1,0,0,0,0|1,0,1]=4 2688 B14R0.93 CCCCCCCC(CC)OCC(C)O 7a_200011217053_100011218427 [1,1,0,0,0,0|1,0,1]=4 2689 B14R0.93 CCCCCCCC(CC)OC[C@@H](C)O 34a_200011217053_100009817552 [1,1,0,0,0,0|1,0,1]=4 2690 B14R0.93 CCCCCCCC(CC)OC[C@@H](C)O 7a_200011217053_100009817552 [1,1,0,0,0,0|1,0,1]=4 2691 B14R0.138 CC(O)CN(C)C(=O)CCCCCCO 240690a_100000227577_100011996774 [1,1,0,0,0,0|2,0,0]=4 2692 B14R0.138 CCCCCCCC(=O)C(C)CC(C)C 1458a_100000211969_100000731052 [1,1,0,0,0,0|2,0,0]=4 2693 B14R0.138 CCCCCCCC(=O)N(C)CC(C)C 11a_100000747067_100000211969 [1,1,0,0,0,0|2,0,0]=4 2694 B14R0.138 CCCCCCCC(=O)N(C)CC(C)C 1626a_100000747067_100000211969 [1,1,0,0,0,0|2,0,0]=4 2695 B14R0.138 CCCCCCCC(=O)N(C)CC(C)C 240690a_100000747067_100000211969 [1,1,0,0,0,0|2,0,0]=4 2696 B14R0.138 CCCCCCCC(=O)N(C)CC(C)C 527a_100000747067_100000211969 [1,1,0,0,0,0|2,0,0]=4 2697 B14R0.138 CCCCCCCC(=O)N(C)CC(C)O 240690a_100000227577_100000211969 [1,1,0,0,0,0|1,0,0]=3 2698 B14R0.138 CCCCCCCC(=O)N(C)CC(C)O 527a_100000227577_100000211969 [1,1,0,0,0,0|1,0,0]=3 2699 B14R0.138 CCCCCCCC(=O)[C@@H](O)CC(C)C 1458a_100012027011_100000210614 [1,1,0,0,0,0|2,0,0]=4 2700 B14R0.138 CCCCCCNC(=O)N(C)CC(C)O 2708a_100000210581_100000227577 [1,1,0,0,0,0|2,0,0]=4 2701 B14R0.138 COCCCCCC(=O)N(C)CC(C)O 240690a_100000227577_100011935119 [1,1,0,0,0,0|2,0,0]=4 2702 B14R0.138 COCCCCCC(=O)N(C)CC(C)O 527a_100000227577_100011935119 [1,1,0,0,0,0|2,0,0]=4 2703 B14R0.161 CCCCC(C)CCC(=O)CCC(C)C 1458a_100000033779_100000210312 [1,1,0,0,0,0|2,0,0]=4 2704 B14R0.161 CCCCC(C)CCC(=O)CCC(C)O 1458a_100000033779_100012276601 [1,1,0,0,0,0|1,0,0]=3 2705 B14R0.161 CCCCC(C)CCC(=O)NCC(C)C 11a_100000210953_100000033779 [1,1,0,0,0,0|2,0,0]=4 2706 B14R0.161 CCCCC(C)CCC(=O)NCC(C)C 1626a_100000210953_100000033779 [1,1,0,0,0,0|2,0,0]=4 2707 B14R0.161 CCCCC(C)CCC(=O)NCC(C)C 240690a_100000210953_100000033779 [1,1,0,0,0,0|2,0,0]=4 2708 B14R0.161 CCCCC(C)CCC(=O)NCC(C)C 527a_100000210953_100000033779 [1,1,0,0,0,0|2,0,0]=4 2709 B14R0.161 CCCCC(C)CCC(=O)NCC(C)O 11a_100000210904_100000033779 [1,1,0,0,0,0|1,0,0]=3 2710 B14R0.161 CCCCC(C)CCC(=O)NCC(C)O 240690a_100000210904_100000033779 [1,1,0,0,0,0|1,0,0]=3 2711 B14R0.161 CCCCC(C)CCC(=O)NCC(C)O 527a_100000210904_100000033779 [1,1,0,0,0,0|1,0,0]=3 2712 B14R0.344 C#CCCCCCCC(=O)CCC(C)O 1458a_100000034748_100012276601 [1,1,0,0,0,0|1,0,1]=4 2713 B14R0.344 C#CCCCCCCC(=O)NCC(C)O 11a_100000210904_100000034748 [1,1,0,0,0,0|1,0,1]=4 2714 B14R0.344 C#CCCCCCCC(=O)NCC(C)O 240690a_100000210904_100000034748 [1,1,0,0,0,0|1,0,1]=4 2715 B14R0.344 C#CCCCCCCC(=O)NCC(C)O 527a_100000210904_100000034748 [1,1,0,0,0,0|1,0,1]=4 2716 B14R0.344 C=CCCCCCCC(=O)CCC(C)O 1458a_100011809334_100012276601 [1,1,0,0,0,0|1,0,1]=4 2717 B14R0.344 C=CCCCCCCC(=O)NCC(C)O 11a_100000210904_100011809334 [1,1,0,0,0,0|1,0,1]=4 2718 B14R0.344 C=CCCCCCCC(=O)NCC(C)O 240690a_100000210904_100011809334 [1,1,0,0,0,0|1,0,1]=4 2719 B14R0.344 C=CCCCCCCC(=O)NCC(C)O 527a_100000210904_100011809334 [1,1,0,0,0,0|1,0,1]=4 2720 B14R0.344 CC(C)CCC(=O)CCCCCCCO 1458a_100000181311_100000760002 [1,1,0,0,0,0|2,0,0]=4 2721 B14R0.344 CC(C)CCC(=O)CCCCCCCO 1458a_100011219782_100000210312 [1,1,0,0,0,0|2,0,0]=4 2722 B14R0.344 CC(C)CNC(=O)CCCCCCCO 240690a_100000210953_100011219782 [1,1,0,0,0,0|2,0,0]=4 2723 B14R0.344 CC(O)CCC(=O)CCCCCCCO 1458a_100011219782_100012276601 [1,1,0,0,0,0|1,0,0]=3 2724 B14R0.344 CC(O)CNC(=O)CCCCCCCO 240690a_100000210904_100011219782 [1,1,0,0,0,0|1,0,0]=3 2725 B14R0.344 CC(O)CNC(=O)NCCCCCCO 273464a_100000210904_100000686447 [1,1,0,0,0,0|2,0,0]=4 2726 B14R0.344 CC(O)CNC(=O)NCCCCCCO 273464a_100000686447_100000210904 [1,1,0,0,0,0|2,0,0]=4 2727 B14R0.344 CC(O)CNC(=O)NCCCCCCO 512a_100000210904_100000686447 [1,1,0,0,0,0|2,0,0]=4 2728 B14R0.344 CC(O)CNC(=O)NCCCCCCO 512a_100000686447_100000210904 [1,1,0,0,0,0|2,0,0]=4 2729 B14R0.344 CCCCC/C=C/CC(=O)CCC(C)O 1458a_100020675968_100012276601 [1,1,0,0,0,0|1,0,1]=4 2730 B14R0.344 CCCCC/C=C/CC(=O)NCC(C)O 11a_100000210904_100020675968 [1,1,0,0,0,0|1,0,1]=4 2731 B14R0.344 CCCCC/C=C/CC(=O)NCC(C)O 240690a_100000210904_100020675968 [1,1,0,0,0,0|1,0,1]=4 2732 B14R0.344 CCCCCCC=CC(=O)CCC(C)O 1458a_200015324643_100012276601 [1,1,0,0,0,0|1,0,1]=4 2733 B14R0.344 CCCCCCC=CC(=O)NCC(C)O 11a_100000210904_200015324643 [1,1,0,0,0,0|1,0,1]=4 2734 B14R0.344 CCCCCCC=CC(=O)NCC(C)O 240690a_100000210904_200015324643 [1,1,0,0,0,0|1,0,1]=4 2735 B14R0.344 CCCCCCCCC(=O)CCC(C)C 1458a_100000181311_100000210759 [1,1,0,0,0,0|2,0,0]=4 2736 B14R0.344 CCCCCCCCC(=O)CCC(C)C 1458a_100000210188_100000210312 [1,1,0,0,0,0|2,0,0]=4 2737 B14R0.344 CCCCCCCCC(=O)CCC(C)O 1458a_100000210188_100012276601 [1,1,0,0,0,0|1,0,0]=3 2738 B14R0.344 CCCCCCCCC(=O)NCC(C)C 11a_100000210953_100000210188 [1,1,0,0,0,0|2,0,0]=4 2739 B14R0.344 CCCCCCCCC(=O)NCC(C)C 1626a_100000210953_100000210188 [1,1,0,0,0,0|2,0,0]=4 2740 B14R0.344 CCCCCCCCC(=O)NCC(C)C 240690a_100000210953_100000210188 [1,1,0,0,0,0|2,0,0]=4 2741 B14R0.344 CCCCCCCCC(=O)NCC(C)C 527a_100000210953_100000210188 [1,1,0,0,0,0|2,0,0]=4 2742 B14R0.344 CCCCCCCCC(=O)NCC(C)O 11a_100000210904_100000210188 [1,1,0,0,0,0|1,0,0]=3 2743 B14R0.344 CCCCCCCCC(=O)NCC(C)O 240690a_100000210904_100000210188 [1,1,0,0,0,0|1,0,0]=3 2744 B14R0.344 CCCCCCCCC(=O)NCC(C)O 527a_100000210904_100000210188 [1,1,0,0,0,0|1,0,0]=3 2745 B14R0.344 CCCCCCCCC(C)OCC(C)O 34a_100000210740_100011218427 [1,1,0,0,0,0|1,0,1]=4 2746 B14R0.344 CCCCCCCCC(C)OCC(C)O 7a_100000210740_100011218427 [1,1,0,0,0,0|1,0,1]=4 2747 B14R0.344 CCCCCCCCC(C)OC[C@@H](C)O 34a_100000210740_100009817552 [1,1,0,0,0,0|1,0,1]=4 2748 B14R0.344 CCCCCCCCC(C)OC[C@@H](C)O 7a_100000210740_100009817552 [1,1,0,0,0,0|1,0,1]=4 2749 B14R0.344 CCCCCCCNC(=O)CCC(C)C 11a_100000229938_100000181311 [1,1,0,0,0,0|2,0,0]=4 2750 B14R0.344 CCCCCCCNC(=O)CCC(C)C 1626a_100000229938_100000181311 [1,1,0,0,0,0|2,0,0]=4 2751 B14R0.344 CCCCCCCNC(=O)CCC(C)C 240690a_100000229938_100000181311 [1,1,0,0,0,0|2,0,0]=4 2752 B14R0.344 CCCCCCCNC(=O)CCC(C)C 527a_100000229938_100000181311 [1,1,0,0,0,0|2,0,0]=4 2753 B14R0.344 CCCCCCCNC(=O)CCC(C)O 1626a_100000229938_100000718519 [1,1,0,0,0,0|1,0,0]=3 2754 B14R0.344 CCCCCCCNC(=O)NCC(C)C 2708a_100000210953_100000229938 [1,1,0,0,0,0|2,0,0]=4 2755 B14R0.344 CCCCCCCNC(=O)NCC(C)C 2708a_100000229938_100000210953 [1,1,0,0,0,0|2,0,0]=4 2756 B14R0.344 CCCCCCCNC(=O)NCC(C)C 273464a_100000210953_100000229938 [1,1,0,0,0,0|2,0,0]=4 2757 B14R0.344 CCCCCCCNC(=O)NCC(C)C 273464a_100000229938_100000210953 [1,1,0,0,0,0|2,0,0]=4 2758 B14R0.344 CCCCCCCNC(=O)NCC(C)C 512a_100000210953_100000229938 [1,1,0,0,0,0|2,0,0]=4 2759 B14R0.344 CCCCCCCNC(=O)NCC(C)C 512a_100000229938_100000210953 [1,1,0,0,0,0|2,0,0]=4 2760 B14R0.344 CCCCCCCNC(=O)NCC(C)O 2708a_100000229938_100000210904 [1,1,0,0,0,0|1,0,0]=3 2761 B14R0.344 CCCCCCCNC(=O)NCC(C)O 273464a_100000210904_100000229938 [1,1,0,0,0,0|1,0,0]=3 2762 B14R0.344 CCCCCCCNC(=O)NCC(C)O 273464a_100000229938_100000210904 [1,1,0,0,0,0|1,0,0]=3 2763 B14R0.344 CCCCCCCNC(=O)NCC(C)O 512a_100000210904_100000229938 [1,1,0,0,0,0|1,0,0]=3 2764 B14R0.344 CCCCCCCNC(=O)NCC(C)O 512a_100000229938_100000210904 [1,1,0,0,0,0|1,0,0]=3 2765 B14R0.344 CCCCCCNCC(=O)NCC(C)C 2230a_100000210581_100000183291 [1,1,0,0,0,0|2,0,0]=4 2766 B14R0.344 CCCCCCOCC(=O)NCC(C)C 34a_100000210259_100000183291 [1,1,0,0,0,0|2,0,0]=4 2767 B14R0.344 CCCCCCOCC(=O)NCC(C)C 7a_100000210259_100000183291 [1,1,0,0,0,0|2,0,0]=4 2768 B14R0.344 CCCCCCSCC(=O)NCC(C)C 62a_100000183291_100000210757 [1,1,0,0,0,0|2,0,0]=4 2769 B14R0.344 CCCCCCSCC(=O)NCC(C)C 62a_100000210314_100000183291 [1,1,0,0,0,0|2,0,0]=4 2770 B14R0.344 CCCCNCCCC(=O)NCC(C)C 2230a_100000102301_100011194448 [1,1,0,0,0,0|2,0,0]=4 2771 B14R0.344 CCCCNCCCC(=O)NCC(C)C 7a_106832991798_100011194448 [1,1,0,0,0,0|2,0,0]=4 2772 B14R0.344 CCCCOCCCC(=O)NCC(C)C 34a_100000210227_100011194448 [1,1,0,0,0,0|2,0,0]=4 2773 B14R0.344 CCCCOCCCC(=O)NCC(C)C 7a_100000210227_100011194448 [1,1,0,0,0,0|2,0,0]=4 2774 B14R0.344 CCCCSCCCC(=O)NCC(C)C 62a_100000210211_100011194448 [1,1,0,0,0,0|2,0,0]=4 2775 B14R0.344 CCCCSCCCC(=O)NCC(C)C 62a_100011194448_100000210210 [1,1,0,0,0,0|2,0,0]=4 2776 B14R0.344 CCCCSCCNC(=O)CCC(C)O 1626a_100025743550_100000718519 [1,1,0,0,0,0|2,0,0]=4 2777 B14R0.344 CCCCSCCNC(=O)NCC(C)O 2708a_100025743550_100000210904 [1,1,0,0,0,0|2,0,0]=4 2778 B14R0.344 CCCCSCCNC(=O)NCC(C)O 273464a_100000210904_100025743550 [1,1,0,0,0,0|2,0,0]=4 2779 B14R0.344 CCCCSCCNC(=O)NCC(C)O 273464a_100025743550_100000210904 [1,1,0,0,0,0|2,0,0]=4 2780 B14R0.344 CCCCSCCNC(=O)NCC(C)O 512a_100000210904_100025743550 [1,1,0,0,0,0|2,0,0]=4 2781 B14R0.344 CCCCSCCNC(=O)NCC(C)O 512a_100025743550_100000210904 [1,1,0,0,0,0|2,0,0]=4 2782 B14R0.344 CCCOCCCNC(=O)CCC(C)O 1626a_100011217757_100000718519 [1,1,0,0,0,0|2,0,0]=4 2783 B14R0.344 CCCOCCCNC(=O)NCC(C)O 2708a_100011217757_100000210904 [1,1,0,0,0,0|2,0,0]=4 2784 B14R0.344 CCCOCCCNC(=O)NCC(C)O 273464a_100000210904_100011217757 [1,1,0,0,0,0|2,0,0]=4 2785 B14R0.344 CCCOCCCNC(=O)NCC(C)O 273464a_100011217757_100000210904 [1,1,0,0,0,0|2,0,0]=4 2786 B14R0.344 CCCOCCCNC(=O)NCC(C)O 512a_100000210904_100011217757 [1,1,0,0,0,0|2,0,0]=4 2787 B14R0.344 CCCOCCCNC(=O)NCC(C)O 512a_100011217757_100000210904 [1,1,0,0,0,0|2,0,0]=4 2788 B14R0.344 COCCCCCCC(=O)CCC(C)C 1458a_100000181311_100011998445 [1,1,0,0,0,0|2,0,0]=4 2789 B14R0.344 COCCCCCNC(=O)CCC(C)O 1626a_100000747528_100000718519 [1,1,0,0,0,0|2,0,0]=4 2790 B14R0.344 COCCCCCNC(=O)NCC(C)O 2708a_100000747528_100000210904 [1,1,0,0,0,0|2,0,0]=4 2791 B14R0.344 COCCCCCNC(=O)NCC(C)O 273464a_100000210904_100000747528 [1,1,0,0,0,0|2,0,0]=4 2792 B14R0.344 COCCCCCNC(=O)NCC(C)O 273464a_100000747528_100000210904 [1,1,0,0,0,0|2,0,0]=4 2793 B14R0.344 COCCCCCNC(=O)NCC(C)O 512a_100000210904_100000747528 [1,1,0,0,0,0|2,0,0]=4 2794 B14R0.344 COCCCCCNC(=O)NCC(C)O 512a_100000747528_100000210904 [1,1,0,0,0,0|2,0,0]=4 2795 B14R0.511 CCCCCCC(C)C(=O)CCC(C)C 1458a_100000181311_100011215978 [1,1,0,0,0,0|2,0,0]=4 2796 B14R0.511 CCCCCCC(O)C(=O)CCC(C)C 1458a_100011215828_100000210312 [1,1,0,0,0,0|2,0,0]=4 2797 B14R0.511 CCCCCCC(O)C(=O)CCC(C)O 1458a_100011215828_100012276601 [1,1,0,0,0,0|1,0,0]=3 2798 B14R0.511 CCCCCCC(O)C(=O)NCC(C)C 240690a_100000210953_100011215828 [1,1,0,0,0,0|2,0,0]=4 2799 B14R0.511 CCCCCCC(O)C(=O)NCC(C)O 240690a_100000210904_100011215828 [1,1,0,0,0,0|1,0,0]=3 2800 B14R0.511 CCCCCCN(C)C(=O)CCC(C)O 1626a_106256046315_100000718519 [1,1,0,0,0,0|2,0,0]=4 2801 B14R0.511 CCCCCCN(C)C(=O)NCC(C)O 273464a_100000210904_106256046315 [1,1,0,0,0,0|2,0,0]=4 2802 B14R0.551 CC(C)CCCCCC(=O)CCC(C)C 1458a_100000181311_100000210682 [1,1,0,0,0,0|2,0,0]=4 2803 B14R0.551 CC(C)CCCCCC(=O)CCC(C)C 1458a_100000766313_100000210312 [1,1,0,0,0,0|2,0,0]=4 2804 B14R0.551 CC(C)CCCCCC(=O)CCC(C)O 1458a_100000766313_100012276601 [1,1,0,0,0,0|1,0,0]=3 2805 B14R0.551 CC(C)CCCCCC(=O)NCC(C)C 11a_100000210953_100000766313 [1,1,0,0,0,0|2,0,0]=4 2806 B14R0.551 CC(C)CCCCCC(=O)NCC(C)C 1626a_100000210953_100000766313 [1,1,0,0,0,0|2,0,0]=4 2807 B14R0.551 CC(C)CCCCCC(=O)NCC(C)C 240690a_100000210953_100000766313 [1,1,0,0,0,0|2,0,0]=4 2808 B14R0.551 CC(C)CCCCCC(=O)NCC(C)C 527a_100000210953_100000766313 [1,1,0,0,0,0|2,0,0]=4 2809 B14R0.551 CC(C)CCCCCC(=O)NCC(C)O 11a_100000210904_100000766313 [1,1,0,0,0,0|1,0,0]=3 2810 B14R0.551 CC(C)CCCCCC(=O)NCC(C)O 240690a_100000210904_100000766313 [1,1,0,0,0,0|1,0,0]=3 2811 B14R0.551 CC(C)CCCCCC(=O)NCC(C)O 527a_100000210904_100000766313 [1,1,0,0,0,0|1,0,0]=3 2812 B14R0.1096 CC(C)(O)CNC(=O)CCCCCCO 240690a_100000751335_100011996774 [1,1,0,0,0,0|2,0,0]=4 2813 B14R0.1096 CCCCCCCC(=O)CCC(C)(C)C 1458a_100000211969_100000755188 [1,1,0,0,0,0|2,0,0]=4 2814 B14R0.1096 CCCCCCCC(=O)CCC(C)(C)C 1458a_100000757465_100000210614 [1,1,0,0,0,0|2,0,0]=4 2815 B14R0.1096 CCCCCCCC(=O)CCC(C)(F)F 1458a_100000030992_100000210614 [1,1,0,0,0,0|2,0,0]=4 2816 B14R0.1096 CCCCCCCC(=O)NCC(C)(C)C 11a_100000743828_100000211969 [1,1,0,0,0,0|2,0,0]=4 2817 B14R0.1096 CCCCCCCC(=O)NCC(C)(C)C 1626a_100000743828_100000211969 [1,1,0,0,0,0|2,0,0]=4 2818 B14R0.1096 CCCCCCCC(=O)NCC(C)(C)C 240690a_100000743828_100000211969 [1,1,0,0,0,0|2,0,0]=4 2819 B14R0.1096 CCCCCCCC(=O)NCC(C)(C)C 527a_100000743828_100000211969 [1,1,0,0,0,0|2,0,0]=4 2820 B14R0.1096 CCCCCCCC(=O)NCC(C)(C)F 11a_100020643315_100000211969 [1,1,0,0,0,0|2,0,0]=4 2821 B14R0.1096 CCCCCCCC(=O)NCC(C)(C)F 1626a_100020643315_100000211969 [1,1,0,0,0,0|2,0,0]=4 2822 B14R0.1096 CCCCCCCC(=O)NCC(C)(C)F 240690a_100020643315_100000211969 [1,1,0,0,0,0|2,0,0]=4 2823 B14R0.1096 CCCCCCCC(=O)NCC(C)(C)F 527a_100020643315_100000211969 [1,1,0,0,0,0|2,0,0]=4 2824 B14R0.1096 CCCCCCCC(=O)NCC(C)(C)O 1626a_100000751335_100000211969 [1,1,0,0,0,0|1,0,0]=3 2825 B14R0.1096 CCCCCCCC(=O)NCC(C)(C)O 240690a_100000751335_100000211969 [1,1,0,0,0,0|1,0,0]=3 2826 B14R0.1096 CCCCCCCC(=O)NCC(C)(C)O 527a_100000751335_100000211969 [1,1,0,0,0,0|1,0,0]=3 2827 B14R0.1096 CCCCCCCC(=O)NCC(C)(F)F 11a_100000731000_100000211969 [1,1,0,0,0,0|2,0,0]=4 2828 B14R0.1096 CCCCCCCC(=O)NCC(C)(F)F 1626a_100000731000_100000211969 [1,1,0,0,0,0|2,0,0]=4 2829 B14R0.1096 CCCCCCCC(=O)NCC(C)(F)F 240690a_100000731000_100000211969 [1,1,0,0,0,0|2,0,0]=4 2830 B14R0.1096 CCCCCCCC(=O)NCC(C)(F)F 527a_100000731000_100000211969 [1,1,0,0,0,0|2,0,0]=4 2831 B14R0.1096 CCCCCCCC(C)OCC(C)(C)O 34a_200011215852_100000764493 [1,1,0,0,0,0|1,0,1]=4 2832 B14R0.1096 CCCCCCCC(C)OCC(C)(C)O 7a_200011215852_100000764493 [1,1,0,0,0,0|1,0,1]=4 2833 B14R0.1096 CCCCCCNC(=O)NCC(C)(C)O 2708a_100000210581_100000751335 [1,1,0,0,0,0|2,0,0]=4 2834 B14R0.1096 CCCCCCNC(=O)NCC(C)(C)O 273464a_100000210581_100000751335 [1,1,0,0,0,0|2,0,0]=4 2835 B14R0.1096 CCCCCCNC(=O)NCC(C)(C)O 512a_100000210581_100000751335 [1,1,0,0,0,0|2,0,0]=4 2836 B14R0.1096 CCCCCCNC(=O)NCC(C)(C)O 512a_100000751335_100000210581 [1,1,0,0,0,0|2,0,0]=4 2837 B14R0.1096 CCCCCNCC(=O)OCC(C)(C)C 2230a_100000209983_200010402935 [1,1,0,0,0,0|2,0,0]=4 2838 B14R0.1096 CCCCCOCC(=O)OCC(C)(C)C 34a_100000210253_200010402935 [1,1,0,0,0,0|2,0,0]=4 2839 B14R0.1096 CCCCCOCC(=O)OCC(C)(C)C 7a_100000210253_200010402935 [1,1,0,0,0,0|2,0,0]=4 2840 B14R0.1096 CCCCCSCC(=O)OCC(C)(C)C 62a_100000210326_200010402935 [1,1,0,0,0,0|2,0,0]=4 2841 B14R0.1096 CCCCCSCC(=O)OCC(C)(C)C 62a_200010402935_100000210326 [1,1,0,0,0,0|2,0,0]=4 2842 B14R0.1096 COCCCCCC(=O)NCC(C)(C)O 1626a_100000751335_100011935119 [1,1,0,0,0,0|2,0,0]=4 2843 B14R0.1096 COCCCCCC(=O)NCC(C)(C)O 240690a_100000751335_100011935119 [1,1,0,0,0,0|2,0,0]=4 2844 B14R0.1096 COCCCCCC(=O)NCC(C)(C)O 527a_100000751335_100011935119 [1,1,0,0,0,0|2,0,0]=4 2845 B14R0.2430 CCCCCC(C)NC(=O)CCC(C)O 1626a_100000211957_100000718519 [1,1,0,0,0,0|2,0,0]=4 2846 B14R0.2430 CCCCCC(C)NC(=O)NCC(C)O 2708a_100000211957_100000210904 [1,1,0,0,0,0|2,0,0]=4 2847 B14R0.2430 CCCCCC(C)NC(=O)NCC(C)O 273464a_100000210904_100000211957 [1,1,0,0,0,0|2,0,0]=4 2848 B14R0.2430 CCCCCC(C)NC(=O)NCC(C)O 273464a_100000211957_100000210904 [1,1,0,0,0,0|2,0,0]=4 2849 B14R0.2430 CCCCCC(C)NC(=O)NCC(C)O 512a_100000210904_100000211957 [1,1,0,0,0,0|2,0,0]=4 2850 B14R0.2430 CCCCCC(C)NC(=O)NCC(C)O 512a_100000211957_100000210904 [1,1,0,0,0,0|2,0,0]=4 2851 B14R0.2 CC(O)CCCC(=O)CCCCCCO 1458a_100011996774_200000718107 [1,1,0,0,0,0|2,0,0]=4 2852 B14R0.2 CC(O)CCNC(=O)CCCCCCO 240690a_200000755665_100011996774 [1,1,0,0,0,0|2,0,0]=4 2853 B14R0.2 CCCCCCCC(=O)CCCC(C)C 1458a_100000211969_100011214892 [1,1,0,0,0,0|2,0,0]=4 2854 B14R0.2 CCCCCCCC(=O)CCCC(C)C 1458a_100011216857_100000210614 [1,1,0,0,0,0|2,0,0]=4 2855 B14R0.2 CCCCCCCC(=O)CCCC(C)O 1458a_100000211969_200000718107 [1,1,0,0,0,0|1,0,0]=3 2856 B14R0.2 CCCCCCCC(=O)NCCC(C)C 11a_100000210545_100000211969 [1,1,0,0,0,0|2,0,0]=4 2857 B14R0.2 CCCCCCCC(=O)NCCC(C)C 1626a_100000210545_100000211969 [1,1,0,0,0,0|2,0,0]=4 2858 B14R0.2 CCCCCCCC(=O)NCCC(C)C 240690a_100000210545_100000211969 [1,1,0,0,0,0|2,0,0]=4 2859 B14R0.2 CCCCCCCC(=O)NCCC(C)C 527a_100000210545_100000211969 [1,1,0,0,0,0|2,0,0]=4 2860 B14R0.2 CCCCCCCC(=O)NCCC(C)O 240690a_200000755665_100000211969 [1,1,0,0,0,0|1,0,0]=3 2861 B14R0.2 CCCCCCCC(=O)NCCC(C)O 527a_200000755665_100000211969 [1,1,0,0,0,0|1,0,0]=3 2862 B14R0.2 CCCCCCCC(=O)NNCC(C)O 22a_200000730056_100000211969 [1,1,0,0,0,0|2,0,0]=4 2863 B14R0.2 CCCCCCCC(=O)OCNC(C)C 2230a_100138425928_100009852258 [1,1,0,0,0,0|2,0,0]=4 2864 B14R0.2 CCCCCCCC(=O)OCNC(C)C 34a_100138425928_100009852258 [1,1,0,0,0,0|2,0,0]=4 2865 B14R0.2 CCCCCCCC(=O)OCOC(C)C 34a_100000212225_100009852258 [1,1,0,0,0,0|2,0,0]=4 2866 B14R0.2 CCCCCCCC(=O)OCSC(C)C 62a_100000210206_100009852258 [1,1,0,0,0,0|2,0,0]=4 2867 B14R0.2 CCCCCCCC(C)OCCC(C)O 34a_200011215852_100012276601 [1,1,0,0,0,0|1,0,1]=4 2868 B14R0.2 CCCCCCCC(C)OCCC(C)O 7a_200011215852_100012276601 [1,1,0,0,0,0|1,0,1]=4 2869 B14R0.2 CCCCCCNC(=O)CCCC(C)O 1626a_100000210581_100000761597 [1,1,0,0,0,0|2,0,0]=4 2870 B14R0.2 CCCCCCNC(=O)CCCC(C)O 527a_100000210581_100000761597 [1,1,0,0,0,0|2,0,0]=4 2871 B14R0.2 CCCCCCNC(=O)NCCC(C)O 2708a_100000210581_200000755665 [1,1,0,0,0,0|2,0,0]=4 2872 B14R0.2 CCCCCCNC(=O)NCCC(C)O 273464a_200000755665_100000210581 [1,1,0,0,0,0|2,0,0]=4 2873 B14R0.2 CCCCCCNC(=O)NCCC(C)O 512a_100000210581_200000755665 [1,1,0,0,0,0|2,0,0]=4 2874 B14R0.2 CCCCCCNC(=O)NCCC(C)O 512a_200000755665_100000210581 [1,1,0,0,0,0|2,0,0]=4 2875 B14R0.2 COCCCCCC(=O)CCCC(C)O 1458a_100011935119_200000718107 [1,1,0,0,0,0|2,0,0]=4 2876 B14R0.2 COCCCCCC(=O)NCCC(C)O 240690a_200000755665_100011935119 [1,1,0,0,0,0|2,0,0]=4 2877 B14R0.2 COCCCCCC(=O)NCCC(C)O 527a_200000755665_100011935119 [1,1,0,0,0,0|2,0,0]=4 2878 B14R0.73 CCCCCCCC(=O)CC(C)CCC 1458a_100000211969_100011216630 [1,1,0,0,0,0|2,0,0]=4 2879 B14R0.73 CCCCCCCC(=O)CC(C)CCC 1458a_100000748435_100000210614 [1,1,0,0,0,0|2,0,0]=4 2880 B14R0.73 CCCCCCCC(=O)NC(C)CCC 11a_100000741246_100000211969 [1,1,0,0,0,0|2,0,0]=4 2881 B14R0.73 CCCCCCCC(=O)NC(C)CCC 1626a_100000741246_100000211969 [1,1,0,0,0,0|2,0,0]=4 2882 B14R0.73 CCCCCCCC(=O)NC(C)CCC 240690a_100000741246_100000211969 [1,1,0,0,0,0|2,0,0]=4 2883 B14R0.73 CCCCCCCC(=O)NC(C)CCC 527a_100000741246_100000211969 [1,1,0,0,0,0|2,0,0]=4 2884 B14R0.73 CCCCCCCC(=O)N[C@H](C)CCO 240690a_100000706166_100000211969 [1,1,0,0,0,0|1,0,0]=3 2885 B14R0.73 CCCCCCCC(=O)N[C@H](C)CCO 527a_100000706166_100000211969 [1,1,0,0,0,0|1,0,0]=3 2886 B14R0.73 CCCCCCCC(C)OC(C)CCO 34a_200011215852_100009893172 [1,1,0,0,0,0|1,0,1]=4 2887 B14R0.73 CCCCCCCC(C)OC(C)CCO 7a_200011215852_100009893172 [1,1,0,0,0,0|1,0,1]=4 2888 B14R0.73 CCCCCCNC(=O)N[C@H](C)CCO 2708a_100000210581_100000706166 [1,1,0,0,0,0|2,0,0]=4 2889 B14R0.73 CCCCCCNC(=O)N[C@H](C)CCO 273464a_100000706166_100000210581 [1,1,0,0,0,0|2,0,0]=4 2890 B14R0.73 CCCCCCNC(=O)N[C@H](C)CCO 512a_100000210581_100000706166 [1,1,0,0,0,0|2,0,0]=4 2891 B14R0.73 CCCCCCNC(=O)N[C@H](C)CCO 512a_100000706166_100000210581 [1,1,0,0,0,0|2,0,0]=4 2892 B14R0.73 COCCCCCC(=O)N[C@H](C)CCO 240690a_100000706166_100011935119 [1,1,0,0,0,0|2,0,0]=4 2893 B14R0.73 COCCCCCC(=O)N[C@H](C)CCO 527a_100000706166_100011935119 [1,1,0,0,0,0|2,0,0]=4 2894 B14R0.73 C[C@H](CCO)NC(=O)CCCCCCO 240690a_100000706166_100011996774 [1,1,0,0,0,0|2,0,0]=4 2895 B14R0.86 C=CC(CCCCCCC)OCCCO 34a_200011934235_100000230001 [1,1,0,0,0,0|1,0,1]=4 2896 B14R0.86 C=CC(CCCCCCC)OCCCO 7a_200011934235_100011215043 [1,1,0,0,0,0|1,0,1]=4 2897 B14R0.86 CCCCCCCC(CC)OCCCO 34a_200011217053_100000230001 [1,1,0,0,0,0|1,0,1]=4 2898 B14R0.86 CCCCCCCC(CC)OCCCO 7a_200011217053_100011215043 [1,1,0,0,0,0|1,0,1]=4 2899 B14R0.145 C#CCCCCC(=O)CCCCCCC 1458a_100000211969_100010269958 [1,1,0,0,0,0|2,0,0]=4 2900 B14R0.145 C#CCCCCC(=O)CCCCCCC 1458a_100000696528_100000210614 [1,1,0,0,0,0|2,0,0]=4 2901 B14R0.145 C#CCCCNC(=O)CCCCCCC 11a_100000718082_100000211969 [1,1,0,0,0,0|2,0,0]=4 2902 B14R0.145 C#CCCCNC(=O)CCCCCCC 1626a_100000718082_100000211969 [1,1,0,0,0,0|2,0,0]=4 2903 B14R0.145 C#CCCCNC(=O)CCCCCCC 240690a_100000718082_100000211969 [1,1,0,0,0,0|2,0,0]=4 2904 B14R0.145 C#CCCCNC(=O)CCCCCCC 527a_100000718082_100000211969 [1,1,0,0,0,0|2,0,0]=4 2905 B14R0.145 C#CCNCOC(=O)CCCCCCC 34a_100000212058_100009852258 [1,1,0,0,0,0|1,0,1]=4 2906 B14R0.145 C#CCOCOC(=O)CCCCCCC 34a_100000210247_100009852258 [1,1,0,0,0,0|1,0,1]=4 2907 B14R0.145 C#CCSCOC(=O)CCCCCCC 62a_100000038162_100009852258 [1,1,0,0,0,0|1,0,1]=4 2908 B14R0.145 C=CCCCCC(=O)CCCCCCC 1458a_100000211969_100011215482 [1,1,0,0,0,0|2,0,0]=4 2909 B14R0.145 C=CCCCCC(=O)CCCCCCC 1458a_100011215552_100000210614 [1,1,0,0,0,0|2,0,0]=4 2910 B14R0.145 C=CCCCNC(=O)CCCCCCC 11a_100000700776_100000211969 [1,1,0,0,0,0|2,0,0]=4 2911 B14R0.145 C=CCCCNC(=O)CCCCCCC 1626a_100000700776_100000211969 [1,1,0,0,0,0|2,0,0]=4 2912 B14R0.145 C=CCCCNC(=O)CCCCCCC 240690a_100000700776_100000211969 [1,1,0,0,0,0|2,0,0]=4 2913 B14R0.145 C=CCCCNC(=O)CCCCCCC 527a_100000700776_100000211969 [1,1,0,0,0,0|2,0,0]=4 2914 B14R0.145 C=CCNCOC(=O)CCCCCCC 2230a_100020586998_100009852258 [1,1,0,0,0,0|1,0,1]=4 2915 B14R0.145 C=CCOCOC(=O)CCCCCCC 34a_200000210373_100009852258 [1,1,0,0,0,0|1,0,1]=4 2916 B14R0.145 C=CCSCOC(=O)CCCCCCC 62a_100000210623_100009852258 [1,1,0,0,0,0|1,0,1]=4 2917 B14R0.145 CCCCC=CC(=O)CCCCCCC 1458a_100016266645_100000210614 [1,1,0,0,0,0|2,0,0]=4 2918 B14R0.145 CCCCCCCC(=O)CCCCC#N 1458a_100000211969_100000211819 [1,1,0,0,0,0|2,0,0]=4 2919 B14R0.145 CCCCCCCC(=O)CCCCCC 1458a_100000211969_100000210757 [1,1,0,0,0,0|2,0,0]=4 2920 B14R0.145 CCCCCCCC(=O)CCCCCC 1458a_100102632555_100000210614 [1,1,0,0,0,0|2,0,0]=4 2921 B14R0.145 CCCCCCCC(=O)CCCCCF 1458a_100000211969_100000729378 [1,1,0,0,0,0|2,0,0]=4 2922 B14R0.145 CCCCCCCC(=O)CCCCCO 1458a_100000211969_100000746330 [1,1,0,0,0,0|1,0,0]=3 2923 B14R0.145 CCCCCCCC(=O)CCCCCO 1458a_100102619762_100000210614 [1,1,0,0,0,0|1,0,0]=3 2924 B14R0.145 CCCCCCCC(=O)CCCCOC 1458a_100000211969_100000755781 [1,1,0,0,0,0|1,0,0]=3 2925 B14R0.145 CCCCCCCC(=O)CCCOCC 1458a_100000211969_100012232248 [1,1,0,0,0,0|2,0,0]=4 2926 B14R0.145 CCCCCCCC(=O)CCOCCC 1458a_100000211969_100011215938 [1,1,0,0,0,0|2,0,0]=4 2927 B14R0.145 CCCCCCCC(=O)CCOCCO 1458a_100000211969_100011215305 [1,1,0,0,0,0|1,0,0]=3 2928 B14R0.145 CCCCCCCC(=O)CCOCCO 1458a_100011229844_100000210614 [1,1,0,0,0,0|1,0,0]=3 2929 B14R0.145 CCCCCCCC(=O)COCCCC 1458a_100000211969_100011995733 [1,1,0,0,0,0|1,0,0]=3 2930 B14R0.145 CCCCCCCC(=O)COCCCC 1458a_100000757543_100000210614 [1,1,0,0,0,0|1,0,0]=3 2931 B14R0.145 CCCCCCCC(=O)COCCOC 1458a_100000211095_100000210614 [1,1,0,0,0,0|2,0,0]=4 2932 B14R0.145 CCCCCCCC(=O)CSCCCC 1458a_100000191162_100000210614 [1,1,0,0,0,0|1,1,0]=4 2933 B14R0.145 CCCCCCCC(=O)NCCCCC 11a_100000209983_100000211969 [1,1,0,0,0,0|2,0,0]=4 2934 B14R0.145 CCCCCCCC(=O)NCCCCC 1626a_100000209983_100000211969 [1,1,0,0,0,0|2,0,0]=4 2935 B14R0.145 CCCCCCCC(=O)NCCCCC 240690a_100000209983_100000211969 [1,1,0,0,0,0|2,0,0]=4 2936 B14R0.145 CCCCCCCC(=O)NCCCCC 527a_100000209983_100000211969 [1,1,0,0,0,0|2,0,0]=4 2937 B14R0.145 CCCCCCCC(=O)NCCCCO 240690a_100000750430_100000211969 [1,1,0,0,0,0|1,0,0]=3 2938 B14R0.145 CCCCCCCC(=O)NCCCCO 527a_100000750430_100000211969 [1,1,0,0,0,0|1,0,0]=3 2939 B14R0.145 CCCCCCCC(=O)NCCCOC 1626a_100150723488_100000211969 [1,1,0,0,0,0|1,0,0]=3 2940 B14R0.145 CCCCCCCC(=O)NCCCOC 240690a_100150723488_100000211969 [1,1,0,0,0,0|1,0,0]=3 2941 B14R0.145 CCCCCCCC(=O)NCCCOC 527a_100150723488_100000211969 [1,1,0,0,0,0|1,0,0]=3 2942 B14R0.145 CCCCCCCC(=O)NCCCSC 11a_100000749238_100000211969 [1,1,0,0,0,0|1,1,0]=4 2943 B14R0.145 CCCCCCCC(=O)NCCCSC 1626a_100000749238_100000211969 [1,1,0,0,0,0|1,1,0]=4 2944 B14R0.145 CCCCCCCC(=O)NCCCSC 240690a_100000749238_100000211969 [1,1,0,0,0,0|1,1,0]=4 2945 B14R0.145 CCCCCCCC(=O)NCCCSC 527a_100000749238_100000211969 [1,1,0,0,0,0|1,1,0]=4 2946 B14R0.145 CCCCCCCC(=O)NCCOCC 11a_100011200944_100000211969 [1,1,0,0,0,0|2,0,0]=4 2947 B14R0.145 CCCCCCCC(=O)NCCOCC 1626a_102516460346_100000211969 [1,1,0,0,0,0|2,0,0]=4 2948 B14R0.145 CCCCCCCC(=O)NCCOCC 240690a_100011200944_100000211969 [1,1,0,0,0,0|2,0,0]=4 2949 B14R0.145 CCCCCCCC(=O)NCCOCC 527a_100011200944_100000211969 [1,1,0,0,0,0|2,0,0]=4 2950 B14R0.145 CCCCCCCC(=O)NCCSCC 11a_100000106463_100000211969 [1,1,0,0,0,0|2,0,0]=4 2951 B14R0.145 CCCCCCCC(=O)NCCSCC 1626a_100000106463_100000211969 [1,1,0,0,0,0|2,0,0]=4 2952 B14R0.145 CCCCCCCC(=O)NCCSCC 240690a_100000106463_100000211969 [1,1,0,0,0,0|2,0,0]=4 2953 B14R0.145 CCCCCCCC(=O)NCCSCC 527a_100000106463_100000211969 [1,1,0,0,0,0|2,0,0]=4 2954 B14R0.145 CCCCCCCC(=O)NNCCCC 22a_100025702795_100000211969 [1,1,0,0,0,0|2,0,0]=4 2955 B14R0.145 CCCCCCCC(=O)NNCCOC 22a_100000741390_100000211969 [1,1,0,0,0,0|2,0,0]=4 2956 B14R0.145 CCCCCCCC(=O)OCNCCF 34a_100000724931_100009852258 [1,1,0,0,0,0|1,0,0]=3 2957 B14R0.145 CCCCCCCC(=O)OCNCCO 2230a_100016997473_100009852258 [1,1,0,0,0,0|0,0,0]=2 2958 B14R0.145 CCCCCCCC(=O)OCNCCO 34a_100016990907_100009852258 [1,1,0,0,0,0|0,0,0]=2 2959 B14R0.145 CCCCCCCC(=O)OCOCCBr 34a_100000211926_100009852258 [1,1,0,0,0,0|1,0,0]=3 2960 B14R0.145 CCCCCCCC(=O)OCOCCC 34a_100000210258_100009852258 [1,1,0,0,0,0|1,0,0]=3 2961 B14R0.145 CCCCCCCC(=O)OCOCCN 34a_100000210304_100009852258 [1,1,0,0,0,0|1,0,0]=3 2962 B14R0.145 CCCCCCCC(=O)OCSCC#N 62a_100011215382_100009852258 [1,1,0,0,0,0|1,0,1]=4 2963 B14R0.145 CCCCCCCC(=O)OCSCC=O 62a_200015260668_100009852258 [1,1,0,0,0,0|0,0,2]=4 2964 B14R0.145 CCCCCCCC(=O)OCSCCC 62a_100000210303_100009852258 [1,1,0,0,0,0|1,0,0]=3 2965 B14R0.145 CCCCCCCC(=O)OCSCCF 62a_100011217306_100009852258 [1,1,0,0,0,0|1,0,0]=3 2966 B14R0.145 CCCCCCCC(=O)OCSCCO 62a_100000211926_100009852258 [1,1,0,0,0,0|0,0,0]=2 2967 B14R0.145 CCCCCCCC(=O)OCSCOC 62a_100000766300_100009852258 [1,1,0,0,0,0|1,0,0]=3 2968 B14R0.145 CCCCCCCC(=O)OCSCSC 62a_100011218213_100009852258 [1,1,0,0,0,0|1,1,0]=4 2969 B14R0.145 CCCCCCCC(C)OCCCCO 34a_200011215852_100011216708 [1,1,0,0,0,0|1,0,1]=4 2970 B14R0.145 CCCCCCCC(C)OCCCCO 7a_200011215852_100000210776 [1,1,0,0,0,0|1,0,1]=4 2971 B14R0.145 CCCCCCCC(C)OCCCOC 34a_100000740835_200011218727 [1,1,0,0,0,0|1,0,1]=4 2972 B14R0.145 CCCCCCCC(C)OCCCOC 34a_200011215852_100000740836 [1,1,0,0,0,0|1,0,1]=4 2973 B14R0.145 CCCCCCCC(C)OCCCOC 7a_200011215852_100000740836 [1,1,0,0,0,0|1,0,1]=4 2974 B14R0.145 CCCCCCNC(=O)CCCCCO 240690a_100000210581_100102619762 [1,1,0,0,0,0|2,0,0]=4 2975 B14R0.145 CCCCCCNC(=O)CCOCCO 1626a_100000210581_100011229844 [1,1,0,0,0,0|2,0,0]=4 2976 B14R0.145 CCCCCCNC(=O)CCOCCO 240690a_100000210581_100011229844 [1,1,0,0,0,0|2,0,0]=4 2977 B14R0.145 CCCCCCNC(=O)COCCCBr 34a_100011217188_100000230325 [1,1,0,0,0,0|2,0,0]=4 2978 B14R0.145 CCCCCCNC(=O)COCCCC 11a_100000210581_100000757543 [1,1,0,0,0,0|2,0,0]=4 2979 B14R0.145 CCCCCCNC(=O)COCCCC 1626a_100000210581_100000757543 [1,1,0,0,0,0|2,0,0]=4 2980 B14R0.145 CCCCCCNC(=O)COCCCC 240690a_100000210581_100000757543 [1,1,0,0,0,0|2,0,0]=4 2981 B14R0.145 CCCCCCNC(=O)COCCCC 34a_100000210227_100000230325 [1,1,0,0,0,0|2,0,0]=4 2982 B14R0.145 CCCCCCNC(=O)COCCCC 527a_100000210581_100000757543 [1,1,0,0,0,0|2,0,0]=4 2983 B14R0.145 CCCCCCNC(=O)COCCCC 7a_100000210227_100000230325 [1,1,0,0,0,0|2,0,0]=4 2984 B14R0.145 CCCCCCNC(=O)COCCCCl 34a_100000230001_100000230325 [1,1,0,0,0,0|2,0,0]=4 2985 B14R0.145 CCCCCCNC(=O)COCCCF 34a_100000759539_100000230325 [1,1,0,0,0,0|2,0,0]=4 2986 B14R0.145 CCCCCCNC(=O)COCCCN 34a_100000182051_100000230325 [1,1,0,0,0,0|2,0,0]=4 2987 B14R0.145 CCCCCCNC(=O)CSCCCO 62a_100000230325_100011215043 [1,1,0,0,0,0|1,1,0]=4 2988 B14R0.145 CCCCCCNC(=O)NCCCCO 2708a_100000210581_100000750430 [1,1,0,0,0,0|2,0,0]=4 2989 B14R0.145 CCCCCCNC(=O)NCCCCO 2708a_100000750430_100000210581 [1,1,0,0,0,0|2,0,0]=4 2990 B14R0.145 CCCCCCNC(=O)NCCCCO 273464a_100000210581_100000750430 [1,1,0,0,0,0|2,0,0]=4 2991 B14R0.145 CCCCCCNC(=O)NCCCCO 273464a_100000750430_100000210581 [1,1,0,0,0,0|2,0,0]=4 2992 B14R0.145 CCCCCCNC(=O)NCCCCO 512a_100000210581_100000750430 [1,1,0,0,0,0|2,0,0]=4 2993 B14R0.145 CCCCCCNC(=O)NCCCCO 512a_100000750430_100000210581 [1,1,0,0,0,0|2,0,0]=4 2994 B14R0.145 CCCCCCNC(=O)NCCCOC 2708a_100000210581_100150723488 [1,1,0,0,0,0|2,0,0]=4 2995 B14R0.145 CCCCCCNC(=O)NCCCOC 2708a_100150723488_100000210581 [1,1,0,0,0,0|2,0,0]=4 2996 B14R0.145 CCCCCCNC(=O)NCCCOC 273464a_100000210581_100150723488 [1,1,0,0,0,0|2,0,0]=4 2997 B14R0.145 CCCCCCNC(=O)NCCCOC 273464a_100150723488_100000210581 [1,1,0,0,0,0|2,0,0]=4 2998 B14R0.145 CCCCCCNC(=O)NCCCOC 512a_100000210581_100150723488 [1,1,0,0,0,0|2,0,0]=4 2999 B14R0.145 CCCCCNCC(=O)NCCCOC 2230a_100000209983_100000183178 [1,1,0,0,0,0|2,0,0]=4 3000 B14R0.145 CCCCCNCC(=O)OCCOCC 2230a_100000209983_200000101388 [1,1,0,0,0,0|2,0,0]=4 3001 B14R0.145 CCCCCOCC(=O)NCCCOC 34a_100000210253_100000183178 [1,1,0,0,0,0|2,0,0]=4 3002 B14R0.145 CCCCCOCC(=O)NCCCOC 7a_100000210253_100000183178 [1,1,0,0,0,0|2,0,0]=4 3003 B14R0.145 CCCCCOCC(=O)OCCOCC 34a_100000210253_200000101388 [1,1,0,0,0,0|2,0,0]=4 3004 B14R0.145 CCCCCOCC(=O)OCCOCC 7a_100000210253_200000101388 [1,1,0,0,0,0|2,0,0]=4 3005 B14R0.145 CCCCCSCC(=O)NCCCOC 62a_100000183178_100000210326 [1,1,0,0,0,0|2,0,0]=4 3006 B14R0.145 CCCCCSCC(=O)OCCOCC 62a_100000210326_200000101388 [1,1,0,0,0,0|2,0,0]=4 3007 B14R0.145 CCCCCSCC(=O)OCCOCC 62a_200000101388_100000210326 [1,1,0,0,0,0|2,0,0]=4 3008 B14R0.145 CCCCOCC(=O)CCCCCCF 1458a_100000757543_100015922095 [1,1,0,0,0,0|2,0,0]=4 3009 B14R0.145 CCCCOCC(=O)CCCCCCO 1458a_100000757543_100000766143 [1,1,0,0,0,0|2,0,0]=4 3010 B14R0.145 CCCCOCC(=O)CCCCCCO 1458a_100011996774_100011995733 [1,1,0,0,0,0|2,0,0]=4 3011 B14R0.145 CCCCOCC(=O)CCCCCOC 1458a_100011935119_100011995733 [1,1,0,0,0,0|2,0,0]=4 3012 B14R0.145 CCCCOCCC(=O)CCCCCO 1458a_100102619762_100000743108 [1,1,0,0,0,0|2,0,0]=4 3013 B14R0.145 CCCCOCCC(=O)CCOCCO 1458a_100011229844_100000743108 [1,1,0,0,0,0|2,0,0]=4 3014 B14R0.145 CCCCOCCC(=O)COCCCC 1458a_100000757543_100000743108 [1,1,0,0,0,0|2,0,0]=4 3015 B14R0.145 COCCCCC(=O)CCCCCCO 1458a_100011996774_100000755781 [1,1,0,0,0,0|2,0,0]=4 3016 B14R0.145 COCCCCCC(=O)CCCCCO 1458a_100011935119_100000746330 [1,1,0,0,0,0|2,0,0]=4 3017 B14R0.145 COCCCCCC(=O)CCCCOC 1458a_100011935119_100000755781 [1,1,0,0,0,0|2,0,0]=4 3018 B14R0.145 COCCCCCC(=O)CCOCCO 1458a_100011935119_100011215305 [1,1,0,0,0,0|2,0,0]=4 3019 B14R0.145 COCCCCCC(=O)NCCCCO 240690a_100000750430_100011935119 [1,1,0,0,0,0|2,0,0]=4 3020 B14R0.145 COCCCCCC(=O)NCCCCO 527a_100000750430_100011935119 [1,1,0,0,0,0|2,0,0]=4 3021 B14R0.145 COCCCCCC(=O)NCCCOC 1626a_100150723488_100011935119 [1,1,0,0,0,0|2,0,0]=4 3022 B14R0.145 COCCCCCC(=O)NCCCOC 240690a_100150723488_100011935119 [1,1,0,0,0,0|2,0,0]=4 3023 B14R0.145 COCCCCCC(=O)NCCCOC 527a_100150723488_100011935119 [1,1,0,0,0,0|2,0,0]=4 3024 B14R0.145 COCCCNC(=O)CCCCCCO 240690a_100150723488_100011996774 [1,1,0,0,0,0|2,0,0]=4 3025 B14R0.145 O=C(CCCCCCF)CCOCCO 1458a_100011229844_100015922095 [1,1,0,0,0,0|2,0,0]=4 3026 B14R0.145 O=C(CCCCCCO)CCOCCO 1458a_100011229844_100000766143 [1,1,0,0,0,0|2,0,0]=4 3027 B14R0.145 O=C(CCCCCCO)CCOCCO 1458a_100011996774_100011215305 [1,1,0,0,0,0|2,0,0]=4 3028 B14R0.145 O=C(CCCCCCO)NCCCCO 240690a_100000750430_100011996774 [1,1,0,0,0,0|2,0,0]=4 3029 B14R0.145 O=C(CCCCCO)CCCCCCF 1458a_100102619762_100015922095 [1,1,0,0,0,0|2,0,0]=4 3030 B14R0.145 O=C(CCCCCO)CCCCCCO 1458a_100011996774_100000746330 [1,1,0,0,0,0|2,0,0]=4 3031 B14R0.145 O=C(CCCCCO)CCCCCCO 1458a_100102619762_100000766143 [1,1,0,0,0,0|2,0,0]=4 3032 B14R0.179 C#CCCCCCCC(=O)CCCCO 1458a_100000034748_100000210776 [1,1,0,0,0,0|1,0,1]=4 3033 B14R0.179 C#CCCCCCCC(=O)CCCCO 1458a_100000695505_100012276617 [1,1,0,0,0,0|1,0,1]=4 3034 B14R0.179 C#CCCCCCCC(=O)NCCCO 240690a_100000182051_100000034748 [1,1,0,0,0,0|1,0,1]=4 3035 B14R0.179 C#CCCCCCCC(=O)NCCCO 527a_100000182051_100000034748 [1,1,0,0,0,0|1,0,1]=4 3036 B14R0.179 C=CCCCCCCC(=O)CCCCO 1458a_100000695505_100011215473 [1,1,0,0,0,0|1,0,1]=4 3037 B14R0.179 C=CCCCCCCC(=O)CCCCO 1458a_100011809334_100000210776 [1,1,0,0,0,0|1,0,1]=4 3038 B14R0.179 C=CCCCCCCC(=O)NCCCO 240690a_100000182051_100011809334 [1,1,0,0,0,0|1,0,1]=4 3039 B14R0.179 C=CCCCCCCC(=O)NCCCO 527a_100000182051_100011809334 [1,1,0,0,0,0|1,0,1]=4 3040 B14R0.179 CCCCC/C=C/CC(=O)CCCCO 1458a_100020675968_100000210776 [1,1,0,0,0,0|1,0,1]=4 3041 B14R0.179 CCCCC/C=C/CC(=O)NCCCO 240690a_100000182051_100020675968 [1,1,0,0,0,0|1,0,1]=4 3042 B14R0.179 CCCCCC#CCC(=O)CCCCO 1458a_100000695505_100009816472 [1,1,0,0,0,0|1,0,1]=4 3043 B14R0.179 CCCCCC(=O)CCCCCCCO 1458a_100000212188_100000760002 [1,1,0,0,0,0|2,0,0]=4 3044 B14R0.179 CCCCCC(=O)CCCCCCCO 1458a_100011219782_100000210326 [1,1,0,0,0,0|2,0,0]=4 3045 B14R0.179 CCCCCC(=O)CCCCCCOC 1458a_100000212188_100011998445 [1,1,0,0,0,0|2,0,0]=4 3046 B14R0.179 CCCCCCC=CC(=O)CCCCO 1458a_200015324643_100000210776 [1,1,0,0,0,0|1,0,1]=4 3047 B14R0.179 CCCCCCC=CC(=O)NCCCO 240690a_100000182051_200015324643 [1,1,0,0,0,0|1,0,1]=4 3048 B14R0.179 CCCCCCCCC(=O)CCCCC 1458a_100000210188_100000210326 [1,1,0,0,0,0|2,0,0]=4 3049 B14R0.179 CCCCCCCCC(=O)CCCCC 1458a_100000212188_100000210759 [1,1,0,0,0,0|2,0,0]=4 3050 B14R0.179 CCCCCCCCC(=O)CCCCF 1458a_100000210188_100000729493 [1,1,0,0,0,0|2,0,0]=4 3051 B14R0.179 CCCCCCCCC(=O)CCCCO 1458a_100000210188_100000210776 [1,1,0,0,0,0|1,0,0]=3 3052 B14R0.179 CCCCCCCCC(=O)CCCCO 1458a_100000695505_100000210759 [1,1,0,0,0,0|1,0,0]=3 3053 B14R0.179 CCCCCCCCC(=O)COCCO 1458a_100000708028_100000210759 [1,1,0,0,0,0|2,0,0]=4 3054 B14R0.179 CCCCCCCCC(=O)NCCCC 11a_100000102301_100000210188 [1,1,0,0,0,0|2,0,0]=4 3055 B14R0.179 CCCCCCCCC(=O)NCCCC 1626a_100000102301_100000210188 [1,1,0,0,0,0|2,0,0]=4 3056 B14R0.179 CCCCCCCCC(=O)NCCCC 240690a_100000102301_100000210188 [1,1,0,0,0,0|2,0,0]=4 3057 B14R0.179 CCCCCCCCC(=O)NCCCC 527a_100000102301_100000210188 [1,1,0,0,0,0|2,0,0]=4 3058 B14R0.179 CCCCCCCCC(=O)NCCCF 11a_100015189416_100000210188 [1,1,0,0,0,0|2,0,0]=4 3059 B14R0.179 CCCCCCCCC(=O)NCCCF 1626a_100015189416_100000210188 [1,1,0,0,0,0|2,0,0]=4 3060 B14R0.179 CCCCCCCCC(=O)NCCCF 240690a_100015189416_100000210188 [1,1,0,0,0,0|2,0,0]=4 3061 B14R0.179 CCCCCCCCC(=O)NCCCF 527a_100015189416_100000210188 [1,1,0,0,0,0|2,0,0]=4 3062 B14R0.179 CCCCCCCCC(=O)NCCCO 240690a_100000182051_100000210188 [1,1,0,0,0,0|1,0,0]=3 3063 B14R0.179 CCCCCCCCC(=O)NCCCO 527a_100000182051_100000210188 [1,1,0,0,0,0|1,0,0]=3 3064 B14R0.179 CCCCCCCCC(=O)NNCCO 22a_100000210001_100000210188 [1,1,0,0,0,0|2,0,0]=4 3065 B14R0.179 CCCCCCCCC(C)OCCCO 34a_100000210740_100000230001 [1,1,0,0,0,0|1,0,1]=4 3066 B14R0.179 CCCCCCCCC(C)OCCCO 7a_100000210740_100011215043 [1,1,0,0,0,0|1,0,1]=4 3067 B14R0.179 CCCCCCCNC(=O)CCCCC 11a_100000229938_100000212188 [1,1,0,0,0,0|2,0,0]=4 3068 B14R0.179 CCCCCCCNC(=O)CCCCC 1626a_100000229938_100000212188 [1,1,0,0,0,0|2,0,0]=4 3069 B14R0.179 CCCCCCCNC(=O)CCCCC 240690a_100000229938_100000212188 [1,1,0,0,0,0|2,0,0]=4 3070 B14R0.179 CCCCCCCNC(=O)CCCCC 527a_100000229938_100000212188 [1,1,0,0,0,0|2,0,0]=4 3071 B14R0.179 CCCCCCCNC(=O)CCCCO 1626a_100000229938_100000695505 [1,1,0,0,0,0|1,0,0]=3 3072 B14R0.179 CCCCCCCNC(=O)COCCO 1626a_100000229938_100000708028 [1,1,0,0,0,0|2,0,0]=4 3073 B14R0.179 CCCCCCCNC(=O)COCCO 240690a_100000229938_100000708028 [1,1,0,0,0,0|2,0,0]=4 3074 B14R0.179 CCCCCCCNC(=O)NCCCC 2708a_100000102301_100000229938 [1,1,0,0,0,0|2,0,0]=4 3075 B14R0.179 CCCCCCCNC(=O)NCCCC 2708a_100000229938_100000102301 [1,1,0,0,0,0|2,0,0]=4 3076 B14R0.179 CCCCCCCNC(=O)NCCCC 273464a_100000102301_100000229938 [1,1,0,0,0,0|2,0,0]=4 3077 B14R0.179 CCCCCCCNC(=O)NCCCC 273464a_100000229938_100000102301 [1,1,0,0,0,0|2,0,0]=4 3078 B14R0.179 CCCCCCCNC(=O)NCCCC 512a_100000102301_100000229938 [1,1,0,0,0,0|2,0,0]=4 3079 B14R0.179 CCCCCCCNC(=O)NCCCC 512a_100000229938_100000102301 [1,1,0,0,0,0|2,0,0]=4 3080 B14R0.179 CCCCCCCNC(=O)NCCCF 2708a_100000229938_100015189416 [1,1,0,0,0,0|2,0,0]=4 3081 B14R0.179 CCCCCCCNC(=O)NCCCF 2708a_100015189416_100000229938 [1,1,0,0,0,0|2,0,0]=4 3082 B14R0.179 CCCCCCCNC(=O)NCCCF 273464a_100000229938_100015189416 [1,1,0,0,0,0|2,0,0]=4 3083 B14R0.179 CCCCCCCNC(=O)NCCCF 273464a_100015189416_100000229938 [1,1,0,0,0,0|2,0,0]=4 3084 B14R0.179 CCCCCCCNC(=O)NCCCF 512a_100000229938_100015189416 [1,1,0,0,0,0|2,0,0]=4 3085 B14R0.179 CCCCCCCNC(=O)NCCCF 512a_100015189416_100000229938 [1,1,0,0,0,0|2,0,0]=4 3086 B14R0.179 CCCCCCCNC(=O)NCCCO 2708a_100000229938_100000182051 [1,1,0,0,0,0|1,0,0]=3 3087 B14R0.179 CCCCCCCNC(=O)NCCCO 273464a_100000182051_100000229938 [1,1,0,0,0,0|1,0,0]=3 3088 B14R0.179 CCCCCCCNC(=O)NCCCO 273464a_100000229938_100000182051 [1,1,0,0,0,0|1,0,0]=3 3089 B14R0.179 CCCCCCCNC(=O)NCCCO 512a_100000229938_100000182051 [1,1,0,0,0,0|1,0,0]=3 3090 B14R0.179 CCCCCCCNC(=O)NNCCO 273464a_100000229938_100000210001 [1,1,0,0,0,0|2,0,0]=4 3091 B14R0.179 CCCCCCCNC(=O)NNCCO 512a_100000229938_100000210001 [1,1,0,0,0,0|2,0,0]=4 3092 B14R0.179 CCCCCCNCC(=O)CCCCC 2230a_100000210581_200012276598 [1,1,0,0,0,0|2,0,0]=4 3093 B14R0.179 CCCCCCNCC(=O)NCCCC 2230a_100000210581_100000182744 [1,1,0,0,0,0|2,0,0]=4 3094 B14R0.179 CCCCCCNCC(=O)OCCCC 2230a_100000210581_100000211628 [1,1,0,0,0,0|1,0,0]=3 3095 B14R0.179 CCCCCCNCC(=O)OCCOC 2230a_100000210581_200000040189 [1,1,0,0,0,0|2,0,0]=4 3096 B14R0.179 CCCCCCOCC(=O)CCCCC 34a_100000210259_200012276598 [1,1,0,0,0,0|2,0,0]=4 3097 B14R0.179 CCCCCCOCC(=O)CCCCC 7a_100000210259_200012276598 [1,1,0,0,0,0|2,0,0]=4 3098 B14R0.179 CCCCCCOCC(=O)NCCCC 34a_100000210259_100000182744 [1,1,0,0,0,0|2,0,0]=4 3099 B14R0.179 CCCCCCOCC(=O)NCCCC 7a_100000210259_100000182744 [1,1,0,0,0,0|2,0,0]=4 3100 B14R0.179 CCCCCCOCC(=O)OCCCC 34a_100000210259_100000211628 [1,1,0,0,0,0|1,0,0]=3 3101 B14R0.179 CCCCCCOCC(=O)OCCCC 7a_100000210259_100000211628 [1,1,0,0,0,0|1,0,0]=3 3102 B14R0.179 CCCCCCOCC(=O)OCCOC 34a_100000210259_200000040189 [1,1,0,0,0,0|2,0,0]=4 3103 B14R0.179 CCCCCCOCC(=O)OCCOC 7a_100000210259_200000040189 [1,1,0,0,0,0|2,0,0]=4 3104 B14R0.179 CCCCCCSCC(=O)CCCCC 62a_100000210314_200012276598 [1,1,0,0,0,0|2,0,0]=4 3105 B14R0.179 CCCCCCSCC(=O)CCCCC 62a_200012276598_100000210757 [1,1,0,0,0,0|2,0,0]=4 3106 B14R0.179 CCCCCCSCC(=O)NCCCC 62a_100000182744_100000210757 [1,1,0,0,0,0|2,0,0]=4 3107 B14R0.179 CCCCCCSCC(=O)NCCCC 62a_100000210314_100000182744 [1,1,0,0,0,0|2,0,0]=4 3108 B14R0.179 CCCCCCSCC(=O)OCCCC 62a_100000210314_100000211628 [1,1,0,0,0,0|1,0,0]=3 3109 B14R0.179 CCCCCCSCC(=O)OCCCC 62a_100000211628_100000210757 [1,1,0,0,0,0|1,0,0]=3 3110 B14R0.179 CCCCCCSCC(=O)OCCOC 62a_100000210314_200000040189 [1,1,0,0,0,0|2,0,0]=4 3111 B14R0.179 CCCCCCSCC(=O)OCCOC 62a_200000040189_100000210757 [1,1,0,0,0,0|2,0,0]=4 3112 B14R0.179 CCCCNC(=O)CCCCCCCO 240690a_100000102301_100011219782 [1,1,0,0,0,0|2,0,0]=4 3113 B14R0.179 CCCCOC(=O)CNCCCCCO 2230a_100000762737_100000211628 [1,1,0,0,0,0|2,0,0]=4 3114 B14R0.179 CCCCOC(=O)CNCCCCCO 34a_100000762737_100000211628 [1,1,0,0,0,0|2,0,0]=4 3115 B14R0.179 CCCCOC(=O)CNCCCOCC 2230a_100000210961_100000211628 [1,1,0,0,0,0|2,0,0]=4 3116 B14R0.179 CCCCOC(=O)CNCCCOCC 34a_100000210961_100000211628 [1,1,0,0,0,0|2,0,0]=4 3117 B14R0.179 CCCCOC(=O)CNCCOCCC 2230a_100161115042_100000211628 [1,1,0,0,0,0|2,0,0]=4 3118 B14R0.179 CCCCOC(=O)CNCCOCCC 34a_100161115042_100000211628 [1,1,0,0,0,0|2,0,0]=4 3119 B14R0.179 CCCCOC(=O)CNCCSCCC 2230a_100020603323_100000211628 [1,1,0,0,0,0|2,0,0]=4 3120 B14R0.179 CCCCOC(=O)COCCCCCBr 34a_100000746331_100000211628 [1,1,0,0,0,0|2,0,0]=4 3121 B14R0.179 CCCCOC(=O)COCCCCCBr 7a_100000746331_100000211628 [1,1,0,0,0,0|2,0,0]=4 3122 B14R0.179 CCCCOC(=O)COCCCCCCl 34a_100000746330_100000211628 [1,1,0,0,0,0|2,0,0]=4 3123 B14R0.179 CCCCOC(=O)COCCCCCCl 7a_100000746330_100000211628 [1,1,0,0,0,0|2,0,0]=4 3124 B14R0.179 CCCCOC(=O)COCCCCCI 34a_200012148887_100000211628 [1,1,0,0,0,0|2,0,0]=4 3125 B14R0.179 CCCCOC(=O)COCCCCCI 7a_200012148887_100000211628 [1,1,0,0,0,0|2,0,0]=4 3126 B14R0.179 CCCCOC(=O)COCCCCCN 34a_100000762737_100000211628 [1,1,0,0,0,0|2,0,0]=4 3127 B14R0.179 CCCCOC(=O)COCCCCOC 34a_100000740925_100000211628 [1,1,0,0,0,0|2,0,0]=4 3128 B14R0.179 CCCCOC(=O)COCCCCSC 34a_100011217163_100000211628 [1,1,0,0,0,0|2,0,0]=4 3129 B14R0.179 CCCCOC(=O)COCCCCSC 7a_100011217163_100000211628 [1,1,0,0,0,0|2,0,0]=4 3130 B14R0.179 CCCCOC(=O)COCCCOCC 34a_100000757476_100000211628 [1,1,0,0,0,0|2,0,0]=4 3131 B14R0.179 CCCCOC(=O)COCCCOCC 7a_100000757476_100000211628 [1,1,0,0,0,0|2,0,0]=4 3132 B14R0.179 CCCCOC(=O)COCCCSCC 34a_100011216438_100000211628 [1,1,0,0,0,0|2,0,0]=4 3133 B14R0.179 CCCCOC(=O)COCCCSCC 7a_100011216438_100000211628 [1,1,0,0,0,0|2,0,0]=4 3134 B14R0.179 CCCCOC(=O)COCCOCCC 34a_100000752267_100000211628 [1,1,0,0,0,0|2,0,0]=4 3135 B14R0.179 CCCCOC(=O)COCCOCCC 7a_100000752267_100000211628 [1,1,0,0,0,0|2,0,0]=4 3136 B14R0.179 CCCCOC(=O)COCCSCCC 34a_200000230433_100000211628 [1,1,0,0,0,0|2,0,0]=4 3137 B14R0.179 CCCCOC(=O)COCCSCCC 7a_200000230433_100000211628 [1,1,0,0,0,0|2,0,0]=4 3138 B14R0.179 CCCCOC(=O)CSCCCCCF 62a_100000211628_100000729378 [1,1,0,0,0,0|2,0,0]=4 3139 B14R0.179 CCCCOC(=O)CSCCCCCF 62a_100000729378_100000211628 [1,1,0,0,0,0|2,0,0]=4 3140 B14R0.179 CCCCOC(=O)CSCCCCCO 62a_100000211628_100000746330 [1,1,0,0,0,0|2,0,0]=4 3141 B14R0.179 CCCCOC(=O)CSCCCCCO 62a_100000746330_100000211628 [1,1,0,0,0,0|2,0,0]=4 3142 B14R0.179 CCCCOC(=O)CSCCCCOC 62a_100000211628_100000730899 [1,1,0,0,0,0|2,0,0]=4 3143 B14R0.179 CCCCOC(=O)CSCCCCOC 62a_100000730899_100000211628 [1,1,0,0,0,0|2,0,0]=4 3144 B14R0.179 CCCCOC(=O)CSCCCOCC 62a_100000211628_100012232248 [1,1,0,0,0,0|2,0,0]=4 3145 B14R0.179 CCCCOC(=O)CSCCCOCC 62a_100012232248_100000211628 [1,1,0,0,0,0|2,0,0]=4 3146 B14R0.179 CCCCOC(=O)CSCCOCCC 62a_100000211628_100011215938 [1,1,0,0,0,0|2,0,0]=4 3147 B14R0.179 CCCCOC(=O)CSCCOCCC 62a_100011215938_100000211628 [1,1,0,0,0,0|2,0,0]=4 3148 B14R0.179 CCCCOCSCC(=O)OCCCC 62a_100000211628_100011995733 [1,1,0,0,0,0|2,0,0]=4 3149 B14R0.179 CCCCOCSCC(=O)OCCCC 62a_100011995733_100000211628 [1,1,0,0,0,0|2,0,0]=4 3150 B14R0.179 CCCCSCCNC(=O)CCCCO 1626a_100025743550_100000695505 [1,1,0,0,0,0|2,0,0]=4 3151 B14R0.179 CCCCSCCNC(=O)NCCCO 2708a_100025743550_100000182051 [1,1,0,0,0,0|2,0,0]=4 3152 B14R0.179 CCCCSCCNC(=O)NCCCO 273464a_100000182051_100025743550 [1,1,0,0,0,0|2,0,0]=4 3153 B14R0.179 CCCCSCCNC(=O)NCCCO 273464a_100025743550_100000182051 [1,1,0,0,0,0|2,0,0]=4 3154 B14R0.179 CCCCSCCNC(=O)NCCCO 512a_100025743550_100000182051 [1,1,0,0,0,0|2,0,0]=4 3155 B14R0.179 CCCOCCCNC(=O)CCCCO 1626a_100011217757_100000695505 [1,1,0,0,0,0|2,0,0]=4 3156 B14R0.179 CCCOCCCNC(=O)NCCCO 2708a_100011217757_100000182051 [1,1,0,0,0,0|2,0,0]=4 3157 B14R0.179 CCCOCCCNC(=O)NCCCO 273464a_100000182051_100011217757 [1,1,0,0,0,0|2,0,0]=4 3158 B14R0.179 CCCOCCCNC(=O)NCCCO 273464a_100011217757_100000182051 [1,1,0,0,0,0|2,0,0]=4 3159 B14R0.179 CCCOCCCNC(=O)NCCCO 512a_100011217757_100000182051 [1,1,0,0,0,0|2,0,0]=4 3160 B14R0.179 CCOCCOCCC(=O)CCCCO 1458a_100000695505_100011211534 [1,1,0,0,0,0|2,0,0]=4 3161 B14R0.179 COCCCCCCC(=O)CCCCO 1458a_100000695505_100011998445 [1,1,0,0,0,0|1,0,0]=3 3162 B14R0.179 COCCCCCCC(=O)COCCO 1458a_100000708028_100011998445 [1,1,0,0,0,0|2,0,0]=4 3163 B14R0.179 COCCCCCNC(=O)CCCCO 1626a_100000747528_100000695505 [1,1,0,0,0,0|2,0,0]=4 3164 B14R0.179 COCCCCCNC(=O)NCCCO 2708a_100000747528_100000182051 [1,1,0,0,0,0|2,0,0]=4 3165 B14R0.179 COCCCCCNC(=O)NCCCO 273464a_100000182051_100000747528 [1,1,0,0,0,0|2,0,0]=4 3166 B14R0.179 COCCCCCNC(=O)NCCCO 273464a_100000747528_100000182051 [1,1,0,0,0,0|2,0,0]=4 3167 B14R0.179 COCCCCCNC(=O)NCCCO 512a_100000747528_100000182051 [1,1,0,0,0,0|2,0,0]=4 3168 B14R0.179 COCCOCCCC(=O)CCCCO 1458a_100000695505_100011216529 [1,1,0,0,0,0|2,0,0]=4 3169 B14R0.179 N#CCCCCCCC(=O)CCCCO 1458a_100000695505_100009813337 [1,1,0,0,0,0|1,0,1]=4 3170 B14R0.179 O=C(CCCCCCCO)COCCO 1458a_100000708028_100000760002 [1,1,0,0,0,0|2,0,0]=4 3171 B14R0.179 O=C(CCCCCCCO)NCCCF 240690a_100015189416_100011219782 [1,1,0,0,0,0|2,0,0]=4 3172 B14R0.179 O=C(CCCCCCCO)NCCCO 240690a_100000182051_100011219782 [1,1,0,0,0,0|1,0,0]=3 3173 B14R0.179 O=C(CCCCCCCO)NNCCO 22a_100000210001_100011219782 [1,1,0,0,0,0|2,0,0]=4 3174 B14R0.179 O=C(CCCCF)CCCCCCCO 1458a_100011219782_100000729493 [1,1,0,0,0,0|2,0,0]=4 3175 B14R0.179 O=C(CCCCO)CCCCCCCO 1458a_100000695505_100000760002 [1,1,0,0,0,0|1,0,0]=3 3176 B14R0.179 O=C(CCCCO)CCCCCCCO 1458a_100011219782_100000210776 [1,1,0,0,0,0|1,0,0]=3 3177 B14R0.179 O=C(NCCCO)NCCCCCCO 273464a_100000182051_100000686447 [1,1,0,0,0,0|2,0,0]=4 3178 B14R0.179 O=C(NCCCO)NCCCCCCO 273464a_100000686447_100000182051 [1,1,0,0,0,0|2,0,0]=4 3179 B14R0.179 O=C(NCCCO)NCCCCCCO 512a_100000686447_100000182051 [1,1,0,0,0,0|2,0,0]=4 3180 B14R0.231 CC(C)CCCCCC(=O)CCCCF 1458a_100000766313_100000729493 [1,1,0,0,0,0|2,0,0]=4 3181 B14R0.231 CC(C)CCCCCC(=O)CCCCO 1458a_100000695505_100000210682 [1,1,0,0,0,0|1,0,0]=3 3182 B14R0.231 CC(C)CCCCCC(=O)CCCCO 1458a_100000766313_100000210776 [1,1,0,0,0,0|1,0,0]=3 3183 B14R0.231 CC(C)CCCCCC(=O)COCCO 1458a_100000708028_100000210682 [1,1,0,0,0,0|2,0,0]=4 3184 B14R0.231 CC(C)CCCCCC(=O)NCCCF 11a_100015189416_100000766313 [1,1,0,0,0,0|2,0,0]=4 3185 B14R0.231 CC(C)CCCCCC(=O)NCCCF 1626a_100015189416_100000766313 [1,1,0,0,0,0|2,0,0]=4 3186 B14R0.231 CC(C)CCCCCC(=O)NCCCF 240690a_100015189416_100000766313 [1,1,0,0,0,0|2,0,0]=4 3187 B14R0.231 CC(C)CCCCCC(=O)NCCCF 527a_100015189416_100000766313 [1,1,0,0,0,0|2,0,0]=4 3188 B14R0.231 CC(C)CCCCCC(=O)NCCCO 240690a_100000182051_100000766313 [1,1,0,0,0,0|1,0,0]=3 3189 B14R0.231 CC(C)CCCCCC(=O)NCCCO 527a_100000182051_100000766313 [1,1,0,0,0,0|1,0,0]=3 3190 B14R0.231 CC(C)CCCCCC(=O)NNCCO 22a_100000210001_100000766313 [1,1,0,0,0,0|2,0,0]=4 3191 B14R0.231 CCCCCC(=O)CCCCCC(C)C 1458a_100000212188_100000210682 [1,1,0,0,0,0|2,0,0]=4 3192 B14R0.231 CCCCCC(=O)CCCCCC(C)C 1458a_100000766313_100000210326 [1,1,0,0,0,0|2,0,0]=4 3193 B14R0.231 CCCCNC(=O)CCCCCC(C)C 11a_100000102301_100000766313 [1,1,0,0,0,0|2,0,0]=4 3194 B14R0.231 CCCCNC(=O)CCCCCC(C)C 1626a_100000102301_100000766313 [1,1,0,0,0,0|2,0,0]=4 3195 B14R0.231 CCCCNC(=O)CCCCCC(C)C 240690a_100000102301_100000766313 [1,1,0,0,0,0|2,0,0]=4 3196 B14R0.231 CCCCNC(=O)CCCCCC(C)C 527a_100000102301_100000766313 [1,1,0,0,0,0|2,0,0]=4 3197 B14R0.231 CCCCOC(=O)CNCCCC(C)C 2230a_200000737386_100000211628 [1,1,0,0,0,0|2,0,0]=4 3198 B14R0.231 CCCCOC(=O)CNCCCC(C)C 34a_200000737386_100000211628 [1,1,0,0,0,0|2,0,0]=4 3199 B14R0.231 CCCCOC(=O)COCCCC(C)C 34a_100000210774_100000211628 [1,1,0,0,0,0|2,0,0]=4 3200 B14R0.231 CCCCOC(=O)COCCCC(C)C 7a_100000210774_100000211628 [1,1,0,0,0,0|2,0,0]=4 3201 B14R0.231 CCCCOC(=O)CSCCCC(C)C 62a_100000211628_100011214892 [1,1,0,0,0,0|2,0,0]=4 3202 B14R0.231 CCCCOC(=O)CSCCCC(C)C 62a_100011214892_100000211628 [1,1,0,0,0,0|2,0,0]=4 3203 B14R0.231 CCCCOC(=O)CSCCCC(C)O 62a_100000211628_200000718107 [1,1,0,0,0,0|2,0,0]=4 3204 B14R0.231 CCCCOC(=O)CSCCCC(C)O 62a_200000718107_100000211628 [1,1,0,0,0,0|2,0,0]=4 3205 B14R0.529 CCCCC(C)CCC(=O)CCCCF 1458a_100000033779_100000729493 [1,1,0,0,0,0|2,0,0]=4 3206 B14R0.529 CCCCC(C)CCC(=O)CCCCO 1458a_100000033779_100000210776 [1,1,0,0,0,0|1,0,0]=3 3207 B14R0.529 CCCCC(C)CCC(=O)NCCCF 11a_100015189416_100000033779 [1,1,0,0,0,0|2,0,0]=4 3208 B14R0.529 CCCCC(C)CCC(=O)NCCCF 1626a_100015189416_100000033779 [1,1,0,0,0,0|2,0,0]=4 3209 B14R0.529 CCCCC(C)CCC(=O)NCCCF 240690a_100015189416_100000033779 [1,1,0,0,0,0|2,0,0]=4 3210 B14R0.529 CCCCC(C)CCC(=O)NCCCF 527a_100015189416_100000033779 [1,1,0,0,0,0|2,0,0]=4 3211 B14R0.529 CCCCC(C)CCC(=O)NCCCO 240690a_100000182051_100000033779 [1,1,0,0,0,0|1,0,0]=3 3212 B14R0.529 CCCCC(C)CCC(=O)NCCCO 527a_100000182051_100000033779 [1,1,0,0,0,0|1,0,0]=3 3213 B14R0.529 CCCCC(C)CCC(=O)NNCCO 22a_100000210001_100000033779 [1,1,0,0,0,0|2,0,0]=4 3214 B14R0.529 CCCCCC(=O)CCC(C)CCCC 1458a_100000033779_100000210326 [1,1,0,0,0,0|2,0,0]=4 3215 B14R0.529 CCCCNC(=O)CCC(C)CCCC 11a_100000102301_100000033779 [1,1,0,0,0,0|2,0,0]=4 3216 B14R0.529 CCCCNC(=O)CCC(C)CCCC 1626a_100000102301_100000033779 [1,1,0,0,0,0|2,0,0]=4 3217 B14R0.529 CCCCNC(=O)CCC(C)CCCC 240690a_100000102301_100000033779 [1,1,0,0,0,0|2,0,0]=4 3218 B14R0.529 CCCCNC(=O)CCC(C)CCCC 527a_100000102301_100000033779 [1,1,0,0,0,0|2,0,0]=4 3219 B14R0.529 CCCCOC(=O)CNC(C)CCCC 2230a_100000126638_100000211628 [1,1,0,0,0,0|2,0,0]=4 3220 B14R0.529 CCCCOC(=O)COC(C)CCCC 34a_100000687866_100000211628 [1,1,0,0,0,0|2,0,0]=4 3221 B14R0.529 CCCCOC(=O)COC(C)CCCC 7a_100000687866_100000211628 [1,1,0,0,0,0|2,0,0]=4 3222 B14R0.529 CCCCOC(=O)CSC(C)CCCC 62a_100000211628_200011215066 [1,1,0,0,0,0|2,0,0]=4 3223 B14R0.529 CCCCOC(=O)CSC(C)CCCC 62a_200011215066_100000211628 [1,1,0,0,0,0|2,0,0]=4 3224 B14R0.1095 CCCCCCCC(=O)C(C)CCCC 1458a_100000211969_200011215066 [1,1,0,0,0,0|2,0,0]=4 3225 B14R0.1095 CCCCCCCC(=O)C(C)CCCC 1458a_100000725509_100000210614 [1,1,0,0,0,0|2,0,0]=4 3226 B14R0.1095 CCCCCCCC(=O)C(O)CCCC 1458a_100000720857_100000210614 [1,1,0,0,0,0|2,0,0]=4 3227 B14R0.1095 CCCCCCCC(=O)N(C)CCCC 11a_100000207549_100000211969 [1,1,0,0,0,0|2,0,0]=4 3228 B14R0.1095 CCCCCCCC(=O)N(C)CCCC 1626a_100000207549_100000211969 [1,1,0,0,0,0|2,0,0]=4 3229 B14R0.1095 CCCCCCCC(=O)N(C)CCCC 240690a_100000207549_100000211969 [1,1,0,0,0,0|2,0,0]=4 3230 B14R0.1095 CCCCCCCC(=O)N(C)CCCC 527a_100000207549_100000211969 [1,1,0,0,0,0|2,0,0]=4 3231 B14R0.1095 CCCCCCCC(=O)N(C)CCCO 240690a_100000213112_100000211969 [1,1,0,0,0,0|1,0,0]=3 3232 B14R0.1095 CCCCCCCC(=O)N(C)CCCO 527a_100000213112_100000211969 [1,1,0,0,0,0|1,0,0]=3 3233 B14R0.1095 CCCCCCNC(=O)N(C)CCCO 2708a_100000210581_100000213112 [1,1,0,0,0,0|2,0,0]=4 3234 B14R0.1095 CCCCCCNC(=O)N(C)CCCO 273464a_100000210581_100000213112 [1,1,0,0,0,0|2,0,0]=4 3235 B14R0.1095 CN(CCCO)C(=O)CCCCCCO 240690a_100000213112_100011996774 [1,1,0,0,0,0|2,0,0]=4 3236 B14R0.1095 COCCCCCC(=O)N(C)CCCO 240690a_100000213112_100011935119 [1,1,0,0,0,0|2,0,0]=4 3237 B14R0.1095 COCCCCCC(=O)N(C)CCCO 527a_100000213112_100011935119 [1,1,0,0,0,0|2,0,0]=4 3238 B14R0.1444 CCCCCC(=O)CC(=O)CCCCO 1458a_100000695505_200012276598 [1,1,0,0,0,0|1,0,1]=4 3239 B14R0.1444 CCCCCC(=O)CC(=O)OCCCC 1458a_100000212188_100000211628 [1,1,0,0,0,0|1,0,1]=4 3240 B14R0.1444 CCCCCC(C)NC(=O)CCCCO 1626a_100000211957_100000695505 [1,1,0,0,0,0|2,0,0]=4 3241 B14R0.1444 CCCCCC(C)NC(=O)NCCCO 2708a_100000211957_100000182051 [1,1,0,0,0,0|2,0,0]=4 3242 B14R0.1444 CCCCCC(C)NC(=O)NCCCO 273464a_100000182051_100000211957 [1,1,0,0,0,0|2,0,0]=4 3243 B14R0.1444 CCCCCC(C)NC(=O)NCCCO 273464a_100000211957_100000182051 [1,1,0,0,0,0|2,0,0]=4 3244 B14R0.1444 CCCCCC(C)NC(=O)NCCCO 512a_100000211957_100000182051 [1,1,0,0,0,0|2,0,0]=4 3245 B14R0.1444 CCCCCN(C)CC(=O)OCCCC 2230a_100000223495_100000211628 [1,1,0,0,0,0|2,0,0]=4 3246 B14R0.1444 CCCCCN(C)CC(=O)OCCCC 269982a_100000223495_100000211628 [1,1,0,0,0,0|2,0,0]=4 3247 B14R0.2256 CCCCCCC(C)C(=O)CCCCC 1458a_100000212188_100011215978 [1,1,0,0,0,0|2,0,0]=4 3248 B14R0.2256 CCCCCCC(C)C(=O)CCCCO 1458a_100000695505_100011215978 [1,1,0,0,0,0|1,0,0]=3 3249 B14R0.2256 CCCCCCC(C)C(=O)COCCO 1458a_100000708028_100011215978 [1,1,0,0,0,0|2,0,0]=4 3250 B14R0.2256 CCCCCCC(O)C(=O)CCCCC 1458a_100011215828_100000210326 [1,1,0,0,0,0|2,0,0]=4 3251 B14R0.2256 CCCCCCC(O)C(=O)CCCCF 1458a_100011215828_100000729493 [1,1,0,0,0,0|2,0,0]=4 3252 B14R0.2256 CCCCCCC(O)C(=O)CCCCO 1458a_100011215828_100000210776 [1,1,0,0,0,0|1,0,0]=3 3253 B14R0.2256 CCCCCCC(O)C(=O)NCCCC 240690a_100000102301_100011215828 [1,1,0,0,0,0|2,0,0]=4 3254 B14R0.2256 CCCCCCC(O)C(=O)NCCCF 240690a_100015189416_100011215828 [1,1,0,0,0,0|2,0,0]=4 3255 B14R0.2256 CCCCCCC(O)C(=O)NCCCO 240690a_100000182051_100011215828 [1,1,0,0,0,0|1,0,0]=3 3256 B14R0.2256 CCCCCCC(O)C(=O)NNCCO 22a_100000210001_100011215828 [1,1,0,0,0,0|2,0,0]=4 3257 B14R0.2256 CCCCCCN(C)C(=O)CCCCO 1626a_106256046315_100000695505 [1,1,0,0,0,0|2,0,0]=4 3258 B14R0.2256 CCCCCCN(C)C(=O)NCCCO 273464a_100000182051_106256046315 [1,1,0,0,0,0|2,0,0]=4 3259 B14R0.2256 CCCCCNC(C)C(=O)OCCCC 2230a_100000209983_100000759602 [1,1,0,0,0,0|2,0,0]=4 3260 B14R0.2256 CCCCCOC(C)C(=O)OCCCC 34a_100000038973_100000718602 [1,1,0,0,0,0|2,0,0]=4 3261 B14R0.2256 CCCCCOC(C)C(=O)OCCCC 34a_100000210253_100000759602 [1,1,0,0,0,0|2,0,0]=4 3262 B14R0.2256 CCCCCOC(C)C(=O)OCCCC 7a_100000038973_100000210326 [1,1,0,0,0,0|2,0,0]=4 3263 B14R0.2256 CCCCCOC(C)C(=O)OCCCC 7a_100000210253_100000759602 [1,1,0,0,0,0|2,0,0]=4 3264 B14R0.2256 CCCCCSC(C)C(=O)OCCCC 62a_100000210326_100000759602 [1,1,0,0,0,0|2,0,0]=4 3265 B14R0.2256 CCCCCSC(C)C(=O)OCCCC 62a_100000759602_100000210326 [1,1,0,0,0,0|2,0,0]=4 3266 B14R0.2432 CCCCOC(=O)COCC(C)CCC 34a_100000688023_100000211628 [1,1,0,0,0,0|2,0,0]=4 3267 B14R0.2432 CCCCOC(=O)COCC(C)CCC 7a_100000688023_100000211628 [1,1,0,0,0,0|2,0,0]=4 3268 B14R0.2432 CCCCOC(=O)COC[C@@H](N)CCC 34a_100000732646_100000211628 [1,1,0,0,0,0|2,0,0]=4 3269 B14R0.2432 CCCCOC(=O)CSCC(C)CCC 62a_100000211628_100011216630 [1,1,0,0,0,0|2,0,0]=4 3270 B14R0.2432 CCCCOC(=O)CSCC(C)CCC 62a_100011216630_100000211628 [1,1,0,0,0,0|2,0,0]=4 3271 B14R0.18 CCC(C)CCNC(=O)NC[C@H](O)CO 2708a_100020591266_100020644852 [1,1,0,0,0,0|2,0,0]=4 3272 B14R0.18 CCC(C)CCNC(=O)NC[C@H](O)CO 273464a_100020591266_100020644852 [1,1,0,0,0,0|2,0,0]=4 3273 B14R0.18 CCC(C)CCNC(=O)NC[C@H](O)CO 273464a_100020644852_100020591266 [1,1,0,0,0,0|2,0,0]=4 3274 B14R0.18 CCC(C)CNCC(=O)NCC(O)CO 2230a_100020588543_200012027429 [1,1,0,0,0,0|2,0,0]=4 3275 B14R0.18 CCC(C)CSCC(=O)NCC(O)CO 62a_100000748023_200012027429 [1,1,0,0,0,0|2,0,0]=4 3276 B14R0.18 CCC(C)CSCC(=O)NCC(O)CO 62a_200012027429_100000748023 [1,1,0,0,0,0|2,0,0]=4 3277 B14R0.18 CCC(O)CSCC(=O)NCC(O)CO 62a_100011218378_200012027429 [1,1,0,0,0,0|2,0,0]=4 3278 B14R0.18 CCC(O)CSCC(=O)NCC(O)CO 62a_200012027429_100011218378 [1,1,0,0,0,0|2,0,0]=4 3279 B14R0.18 CC[C@H](C)COCC(=O)NCC(O)CO 7a_100009816381_200012027429 [1,1,0,0,0,0|2,0,0]=4 3280 B14R0.18 CC[C@H](C)CSCC(=O)NCC(O)CO 62a_100009816398_200012027429 [1,1,0,0,0,0|2,0,0]=4 3281 B14R0.18 CC[C@H](C)CSCC(=O)NCC(O)CO 62a_200012027429_100009816398 [1,1,0,0,0,0|2,0,0]=4 3282 B14R0.180 CCCCCCC(=O)NCC(O)C(C)C 11a_100000759067_100102632555 [1,1,0,0,0,0|2,0,0]=4 3283 B14R0.180 CCCCCCC(=O)NCC(O)C(C)C 240690a_100000759067_100102632555 [1,1,0,0,0,0|2,0,0]=4 3284 B14R0.180 CCCCCCC(=O)NCC(O)C(C)C 527a_100000759067_100102632555 [1,1,0,0,0,0|2,0,0]=4 3285 B14R0.199 CCCCCCC(=O)NCC(O)COC 240690a_100000756049_100102632555 [1,1,0,0,0,0|1,0,0]=3 3286 B14R0.199 CCCCCCC(=O)NCC(O)COC 527a_100000756049_100102632555 [1,1,0,0,0,0|1,0,0]=3 3287 B14R0.199 CCCCCCC(C)OCC(O)COC 34a_100000210265_100011215053 [1,1,0,0,0,0|1,0,1]=4 3288 B14R0.199 CCCCCCC(C)OCC(O)COC 7a_100000210265_100011215053 [1,1,0,0,0,0|1,0,1]=4 3289 B14R0.199 CCCCCNC(=O)NCC(O)COC 2708a_100000209983_100000756049 [1,1,0,0,0,0|2,0,0]=4 3290 B14R0.199 CCCCCNC(=O)NCC(O)COC 273464a_100000209983_100000756049 [1,1,0,0,0,0|2,0,0]=4 3291 B14R0.199 CCCCCNC(=O)NCC(O)COC 273464a_100000756049_100000209983 [1,1,0,0,0,0|2,0,0]=4 3292 B14R0.199 CCCCCNC(=O)NCC(O)COC 512a_100000209983_100000756049 [1,1,0,0,0,0|2,0,0]=4 3293 B14R0.199 CCCCCNC(=O)NCC(O)COC 512a_100000756049_100000209983 [1,1,0,0,0,0|2,0,0]=4 3294 B14R0.199 CCCCOCC(=O)NCC(O)COC 240690a_100000756049_100000757543 [1,1,0,0,0,0|2,0,0]=4 3295 B14R0.199 CCCCOCC(=O)NCC(O)COC 527a_100000756049_100000757543 [1,1,0,0,0,0|2,0,0]=4 3296 B14R0.199 CCCCSCC(=O)NCC(O)COC 240690a_100000756049_100000191162 [1,1,0,0,0,0|2,0,0]=4 3297 B14R0.199 CCCCSCC(=O)NCC(O)COC 527a_100000756049_100000191162 [1,1,0,0,0,0|2,0,0]=4 3298 B14R0.199 COCC(O)CNC(=O)CCCCCO 240690a_100000756049_100102619762 [1,1,0,0,0,0|2,0,0]=4 3299 B14R0.201 CCCCCCC(=O)NCC(CC)OC 11a_100000731041_100102632555 [1,1,0,0,0,0|2,0,0]=4 3300 B14R0.201 CCCCCCC(=O)NCC(CC)OC 1626a_100000731041_100102632555 [1,1,0,0,0,0|2,0,0]=4 3301 B14R0.201 CCCCCCC(=O)NCC(CC)OC 240690a_100000731041_100102632555 [1,1,0,0,0,0|2,0,0]=4 3302 B14R0.201 CCCCCCC(=O)NCC(CC)OC 527a_100000731041_100102632555 [1,1,0,0,0,0|2,0,0]=4 3303 B14R0.202 CCCCCCC(=O)NCC(C)(C)CO 240690a_100020635058_100102632555 [1,1,0,0,0,0|2,0,0]=4 3304 B14R0.202 CCCCCCC(=O)NCC(C)(C)CO 527a_100020635058_100102632555 [1,1,0,0,0,0|2,0,0]=4 3305 B14R0.202 CCCCCCC(=O)NCC(F)(F)CO 240690a_100000703232_100102632555 [1,1,0,0,0,0|2,0,0]=4 3306 B14R0.202 CCCCCCC(=O)NCC(F)(F)CO 527a_100000703232_100102632555 [1,1,0,0,0,0|2,0,0]=4 3307 B14R0.341 CCCCCCC(=O)N(C)CC(O)CO 240690a_100011216503_100102632555 [1,1,0,0,0,0|1,0,0]=3 3308 B14R0.341 CCCCCCC(=O)N(C)CC(O)CO 527a_100011216503_100102632555 [1,1,0,0,0,0|1,0,0]=3 3309 B14R0.341 CCCCCNC(=O)N(C)CC(O)CO 2708a_100000209983_100011216503 [1,1,0,0,0,0|2,0,0]=4 3310 B14R0.341 CCCCOCC(=O)N(C)CC(O)CO 240690a_100011216503_100000757543 [1,1,0,0,0,0|2,0,0]=4 3311 B14R0.341 CCCCOCC(=O)N(C)CC(O)CO 527a_100011216503_100000757543 [1,1,0,0,0,0|2,0,0]=4 3312 B14R0.341 CCCCSCC(=O)N(C)CC(O)CO 240690a_100011216503_100000191162 [1,1,0,0,0,0|2,0,0]=4 3313 B14R0.341 CCCCSCC(=O)N(C)CC(O)CO 527a_100011216503_100000191162 [1,1,0,0,0,0|2,0,0]=4 3314 B14R0.341 CN(CC(O)CO)C(=O)CCCCCO 240690a_100011216503_100102619762 [1,1,0,0,0,0|2,0,0]=4 3315 B14R0.449 CCCCC(=O)CC(=O)NCC(O)CO 1458a_100000210183_200012027429 [1,1,0,0,0,0|1,0,1]=4 3316 B14R0.449 CCCCC(C)NC(=O)NC[C@H](O)CO 2708a_100000126638_100020644852 [1,1,0,0,0,0|2,0,0]=4 3317 B14R0.449 CCCCC(C)NC(=O)NC[C@H](O)CO 273464a_100000126638_100020644852 [1,1,0,0,0,0|2,0,0]=4 3318 B14R0.449 CCCCC(C)NC(=O)NC[C@H](O)CO 273464a_100020644852_100000126638 [1,1,0,0,0,0|2,0,0]=4 3319 B14R0.449 CCCCN(C)CC(=O)NCC(O)CO 2230a_100000207549_200012027429 [1,1,0,0,0,0|2,0,0]=4 3320 B14R0.449 CCCCN(C)CC(=O)NCC(O)CO 269982a_100000207549_200012027429 [1,1,0,0,0,0|2,0,0]=4 3321 B14R0.473 CCCCCC(C)C(=O)NCC(C)CO 240690a_100000744482_100011215998 [1,1,0,0,0,0|2,0,0]=4 3322 B14R0.473 CCCCCC(C)C(=O)NCC(C)CO 527a_100000744482_100011215998 [1,1,0,0,0,0|2,0,0]=4 3323 B14R0.473 CCCCCC(C)C(=O)NCC(O)CC 11a_100011218483_100011215998 [1,1,0,0,0,0|2,0,0]=4 3324 B14R0.473 CCCCCC(C)C(=O)NCC(O)CC 240690a_100011218483_100011215998 [1,1,0,0,0,0|2,0,0]=4 3325 B14R0.473 CCCCCC(C)C(=O)NCC(O)CC 527a_100011218483_100011215998 [1,1,0,0,0,0|2,0,0]=4 3326 B14R0.473 CCCCCC(C)C(=O)NC[C@@H](F)CO 240690a_100015665980_100011215998 [1,1,0,0,0,0|2,0,0]=4 3327 B14R0.473 CCCCCC(C)C(=O)NC[C@@H](F)CO 527a_100015665980_100011215998 [1,1,0,0,0,0|2,0,0]=4 3328 B14R0.473 CCCCCC(C)C(=O)NC[C@H](O)CO 240690a_100020644852_100011215998 [1,1,0,0,0,0|1,0,0]=3 3329 B14R0.473 CCCCCC(C)C(=O)NC[C@H](O)CO 527a_100020644852_100011215998 [1,1,0,0,0,0|1,0,0]=3 3330 B14R0.473 CCCCCN(C)C(=O)NC[C@H](O)CO 273464a_100020644852_100000223495 [1,1,0,0,0,0|2,0,0]=4 3331 B14R0.473 CCCCSC(C)C(=O)NC[C@H](O)CO 240690a_100020644852_100000191163 [1,1,0,0,0,0|2,0,0]=4 3332 B14R0.473 CCCCSC(C)C(=O)NC[C@H](O)CO 527a_100020644852_100000191163 [1,1,0,0,0,0|2,0,0]=4 3333 B14R0.956 C=CC(CCCCCC)OCC(O)CO 34a_200011215977_100011219619 [1,1,0,0,0,0|1,0,1]=4 3334 B14R0.956 C=CC(CCCCCC)OCC(O)CO 7a_200011215977_100011219619 [1,1,0,0,0,0|1,0,1]=4 3335 B14R0.956 C=CC(CCCCCC)OC[C@@H](O)CO 34a_200011215977_100009815848 [1,1,0,0,0,0|1,0,1]=4 3336 B14R0.956 C=CC(CCCCCC)OC[C@@H](O)CO 7a_200011215977_100009815848 [1,1,0,0,0,0|1,0,1]=4 3337 B14R0.956 CCCCCCC(CC)OCC(O)CO 34a_100011215785_100011219619 [1,1,0,0,0,0|1,0,1]=4 3338 B14R0.956 CCCCCCC(CC)OCC(O)CO 7a_100011215785_100011219619 [1,1,0,0,0,0|1,0,1]=4 3339 B14R0.956 CCCCCCC(CC)OC[C@@H](O)CO 34a_100011215785_100009815848 [1,1,0,0,0,0|1,0,1]=4 3340 B14R0.956 CCCCCCC(CC)OC[C@@H](O)CO 7a_100011215785_100009815848 [1,1,0,0,0,0|1,0,1]=4 3341 B14R0.1240 CCCC(C)NCC(=O)NCC(O)CO 2230a_100000741246_200012027429 [1,1,0,0,0,0|2,0,0]=4 3342 B14R0.1240 CCCC(C)OCC(=O)NCC(O)CO 34a_100000764384_200012027429 [1,1,0,0,0,0|2,0,0]=4 3343 B14R0.1240 CCCC(C)OCC(=O)NCC(O)CO 7a_100000764384_200012027429 [1,1,0,0,0,0|2,0,0]=4 3344 B14R0.1240 CCCC(C)SCC(=O)NCC(O)CO 62a_100000766640_200012027429 [1,1,0,0,0,0|2,0,0]=4 3345 B14R0.1240 CCCC(C)SCC(=O)NCC(O)CO 62a_200012027429_100000766640 [1,1,0,0,0,0|2,0,0]=4 3346 B14R0.1749 CC(Br)CCOCC(=O)NCC(O)CO 34a_100009893172_200012027429 [1,1,0,0,0,0|2,0,0]=4 3347 B14R0.1749 CC(C)CCCCC(=O)NCC(C)CO 240690a_100000744482_100011933920 [1,1,0,0,0,0|2,0,0]=4 3348 B14R0.1749 CC(C)CCCCC(=O)NCC(C)CO 527a_100000744482_100011933920 [1,1,0,0,0,0|2,0,0]=4 3349 B14R0.1749 CC(C)CCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100011933920 [1,1,0,0,0,0|2,0,0]=4 3350 B14R0.1749 CC(C)CCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100011933920 [1,1,0,0,0,0|2,0,0]=4 3351 B14R0.1749 CC(C)CCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100011933920 [1,1,0,0,0,0|1,0,0]=3 3352 B14R0.1749 CC(C)CCCCC(=O)NC[C@H](O)CO 527a_100020644852_100011933920 [1,1,0,0,0,0|1,0,0]=3 3353 B14R0.1749 CC(C)CCCNC(=O)NC[C@H](O)CO 2708a_200000737386_100020644852 [1,1,0,0,0,0|2,0,0]=4 3354 B14R0.1749 CC(C)CCCNC(=O)NC[C@H](O)CO 273464a_100020644852_200000737386 [1,1,0,0,0,0|2,0,0]=4 3355 B14R0.1749 CC(C)CCCNC(=O)NC[C@H](O)CO 273464a_200000737386_100020644852 [1,1,0,0,0,0|2,0,0]=4 3356 B14R0.1749 CC(C)CCOCC(=O)NCC(O)CO 34a_100000210254_200012027429 [1,1,0,0,0,0|2,0,0]=4 3357 B14R0.1749 CC(C)CCOCC(=O)NCC(O)CO 7a_100000210254_200012027429 [1,1,0,0,0,0|2,0,0]=4 3358 B14R0.1749 CC(C)CCSCC(=O)NCC(O)CO 62a_100000210312_200012027429 [1,1,0,0,0,0|2,0,0]=4 3359 B14R0.1749 CC(C)CCSCC(=O)NCC(O)CO 62a_200012027429_100000210312 [1,1,0,0,0,0|2,0,0]=4 3360 B14R0.1749 CC(O)CCSCC(=O)NCC(O)CO 62a_100012276601_200012027429 [1,1,0,0,0,0|2,0,0]=4 3361 B14R0.1749 CC(O)CCSCC(=O)NCC(O)CO 62a_200012027429_100012276601 [1,1,0,0,0,0|2,0,0]=4 3362 B14R0.1749 CCC(O)CNC(=O)CCCCC(C)C 11a_100011218483_100011933920 [1,1,0,0,0,0|2,0,0]=4 3363 B14R0.1749 CCC(O)CNC(=O)CCCCC(C)C 240690a_100011218483_100011933920 [1,1,0,0,0,0|2,0,0]=4 3364 B14R0.1749 CCC(O)CNC(=O)CCCCC(C)C 527a_100011218483_100011933920 [1,1,0,0,0,0|2,0,0]=4 3365 B14R0.1749 CN(C)CCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000751710 [1,1,0,0,0,0|2,0,0]=4 3366 B14R0.1749 CN(C)CCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000751710 [1,1,0,0,0,0|2,0,0]=4 3367 B14R0.1749 C[C@@H](N)CCOCC(=O)NCC(O)CO 34a_100000706166_200012027429 [1,1,0,0,0,0|2,0,0]=4 3368 B14R0.2146 CCCCCCC(C)(C)OCC(O)CO 7a_200011995690_100011219619 [1,1,0,0,0,0|1,0,1]=4 3369 B14R0.2146 CCCCCCC(C)(C)OC[C@@H](O)CO 7a_200011995690_100009815848 [1,1,0,0,0,0|1,0,1]=4 3370 B14R0.2146 CCCCCCS(=O)(=O)NC[C@H](O)CO 270084a_100020644852_100011361803 [1,1,0,0,0,0|2,0,0]=4 3371 B14R0.95 CCCCCCCN(CC)CC(O)CO 2230a_100000228213_100011219619 [0,1,0,0,1,0|2,0,0]=4 3372 B14R0.95 CCCCCCCN(CC)C[C@@H](O)CO 2230a_100000228213_100009815848 [0,1,0,0,1,0|2,0,0]=4 3373 B14R0.101 CC(C)CCCCCC(=O)C[C@@H](C)CO 1458a_100000766313_100000059175 [0,1,0,0,1,0|1,0,0]=3 3374 B14R0.101 CC(C)CCCCCC(=O)N[C@H](C)CO 240690a_100000737577_100000766313 [0,1,0,0,1,0|2,0,0]=4 3375 B14R0.101 CC(C)CCCCCC(=O)N[C@H](C)CO 527a_100000737577_100000766313 [0,1,0,0,1,0|2,0,0]=4 3376 B14R0.101 CC(C)CCCCCN(C)CC(O)CO 2230a_100011216503_100000210682 [0,1,0,0,1,0|2,0,0]=4 3377 B14R0.101 CC(C)CCCCCN(C)CC(O)CO 269982a_100011216503_100000210682 [0,1,0,0,1,0|2,0,0]=4 3378 B14R0.101 CCC(C)CC(=O)CCCCCC(C)C 1458a_100000708755_100000210682 [0,1,0,0,1,0|2,0,0]=4 3379 B14R0.101 CCC(C)CC(=O)CCCCCC(C)C 1458a_100000766313_100000748023 [0,1,0,0,1,0|2,0,0]=4 3380 B14R0.101 CCC(O)CC(=O)CCCCCC(C)C 1458a_100000766313_100011218378 [0,1,0,0,1,0|1,0,0]=3 3381 B14R0.101 CCC(O)CC(=O)CCCCCC(C)C 1458a_100011667805_100000210682 [0,1,0,0,1,0|1,0,0]=3 3382 B14R0.101 CC[C@H](C)CC(=O)CCCCCC(C)C 1458a_100000766313_100009816398 [0,1,0,0,1,0|2,0,0]=4 3383 B14R0.142 C=C[C@@H](CO)NC(=O)CCCCCCC 240690a_100016989147_100000211969 [0,1,0,0,1,0|2,0,0]=4 3384 B14R0.142 C=C[C@@H](CO)NC(=O)CCCCCCC 527a_100016989147_100000211969 [0,1,0,0,1,0|2,0,0]=4 3385 B14R0.142 CCCCCCCC(=O)CC(CC)CC 1458a_100000211969_100011215472 [0,1,0,0,1,0|2,0,0]=4 3386 B14R0.142 CCCCCCCC(=O)CC(OC)OC 1458a_100000082724_100000210614 [0,1,0,0,1,0|2,0,0]=4 3387 B14R0.142 CCCCCCCC(=O)CC(OC)OC 1458a_100000211969_100000751394 [0,1,0,0,1,0|2,0,0]=4 3388 B14R0.142 CCCCCCCC(=O)NC(CO)CO 240690a_100000759517_100000211969 [0,1,0,0,1,0|1,0,0]=3 3389 B14R0.142 CCCCCCCC(=O)NC(CO)CO 527a_100000759517_100000211969 [0,1,0,0,1,0|1,0,0]=3 3390 B14R0.142 CCCCCCCC(=O)N[C@@H](CC)CO 240690a_100000709445_100000211969 [0,1,0,0,1,0|2,0,0]=4 3391 B14R0.142 CCCCCCCC(=O)N[C@@H](CC)CO 527a_100000709445_100000211969 [0,1,0,0,1,0|2,0,0]=4 3392 B14R0.142 CCCCCCNC(=O)NC(CO)CO 2708a_100000210581_100000759517 [0,1,0,0,1,0|2,0,0]=4 3393 B14R0.142 CCCCCCNC(=O)NC(CO)CO 273464a_100000210581_100000759517 [0,1,0,0,1,0|2,0,0]=4 3394 B14R0.142 CCCCCCNC(=O)NC(CO)CO 273464a_100000759517_100000210581 [0,1,0,0,1,0|2,0,0]=4 3395 B14R0.142 CCCCCCNC(=O)NC(CO)CO 512a_100000210581_100000759517 [0,1,0,0,1,0|2,0,0]=4 3396 B14R0.142 COCCCCCC(=O)NC(CO)CO 240690a_100000759517_100011935119 [0,1,0,0,1,0|2,0,0]=4 3397 B14R0.142 COCCCCCC(=O)NC(CO)CO 527a_100000759517_100011935119 [0,1,0,0,1,0|2,0,0]=4 3398 B14R0.142 O=C(CCCCCCO)NC(CO)CO 240690a_100000759517_100011996774 [0,1,0,0,1,0|2,0,0]=4 3399 B14R0.143 C#CCCCCCC(=O)[C@H](O)[C@H](O)CO 1458a_100015448053_100012094781 [0,1,0,0,1,0|0,0,2]=4 3400 B14R0.143 C=CCCCCCC(=O)[C@H](O)[C@H](O)CO 1458a_100015448053_100000700193 [0,1,0,0,1,0|0,0,2]=4 3401 B14R0.143 CCCCCCCC(=O)N(C)C(C)CO 240690a_100000693034_100000211969 [0,1,0,0,1,0|2,0,0]=4 3402 B14R0.143 CCCCCCCC(=O)N(C)C(C)CO 527a_100000693034_100000211969 [0,1,0,0,1,0|2,0,0]=4 3403 B14R0.143 CCCCCCCC(=O)[C@H](O)[C@H](O)CO 1458a_100015448053_100000210614 [0,1,0,0,1,0|0,0,0]=2 3404 B14R0.143 CCCCCCNC(=O)[C@H](O)[C@H](O)CO 240690a_100000210581_100015448053 [0,1,0,0,1,0|1,0,0]=3 3405 B14R0.143 CCCCOCCC(=O)[C@H](O)[C@H](O)CO 1458a_100015448053_100000743108 [0,1,0,0,1,0|1,0,0]=3 3406 B14R0.143 CCCOCCNC(=O)[C@H](O)[C@H](O)CO 240690a_100161115042_100015448053 [0,1,0,0,1,0|2,0,0]=4 3407 B14R0.143 CCCSCCNC(=O)[C@H](O)[C@H](O)CO 240690a_100020603323_100015448053 [0,1,0,0,1,0|2,0,0]=4 3408 B14R0.143 CCOCCCNC(=O)[C@H](O)[C@H](O)CO 240690a_100000210961_100015448053 [0,1,0,0,1,0|2,0,0]=4 3409 B14R0.143 COCCOCCC(=O)[C@H](O)[C@H](O)CO 1458a_100015448053_100000695917 [0,1,0,0,1,0|2,0,0]=4 3410 B14R0.143 N#CCCCCCC(=O)[C@H](O)[C@H](O)CO 1458a_100015448053_100009813376 [0,1,0,0,1,0|1,0,1]=4 3411 B14R0.143 O=C(CCCCCCF)[C@H](O)[C@H](O)CO 1458a_100015448053_100015922095 [0,1,0,0,1,0|1,0,0]=3 3412 B14R0.143 O=C(CCCCCCO)[C@H](O)[C@H](O)CO 1458a_100015448053_100000766143 [0,1,0,0,1,0|1,0,0]=3 3413 B14R0.206 CCCCC(C)CCC(=O)CC(C)CC 1458a_100000033779_100000748023 [0,1,0,0,1,0|2,0,0]=4 3414 B14R0.206 CCCCC(C)CCC(=O)CC(O)CC 1458a_100000033779_100011218378 [0,1,0,0,1,0|1,0,0]=3 3415 B14R0.206 CCCCC(C)CCC(=O)C[C@@H](C)CC 1458a_100000033779_100009816398 [0,1,0,0,1,0|2,0,0]=4 3416 B14R0.206 CCCCC(C)CCC(=O)C[C@@H](C)CO 1458a_100000033779_100000059175 [0,1,0,0,1,0|1,0,0]=3 3417 B14R0.206 CCCCC(C)CCC(=O)N[C@H](C)CO 240690a_100000737577_100000033779 [0,1,0,0,1,0|2,0,0]=4 3418 B14R0.206 CCCCC(C)CCC(=O)N[C@H](C)CO 527a_100000737577_100000033779 [0,1,0,0,1,0|2,0,0]=4 3419 B14R0.230 CCCCCC(=O)CC(=O)CC(O)CC 1458a_100011667805_200012276598 [0,1,0,0,1,0|1,0,1]=4 3420 B14R0.230 CCCCCC(C)NC(=O)CC(O)CC 1626a_100000211957_100011667805 [0,1,0,0,1,0|2,0,0]=4 3421 B14R0.230 CCCCCC(C)NC(=O)CC(O)CC 240690a_100000211957_100011667805 [0,1,0,0,1,0|2,0,0]=4 3422 B14R0.2120 CCC(C)(O)CC(=O)CCCCCCF 1458a_200011219800_100015922095 [0,1,0,0,1,0|2,0,0]=4 3423 B14R0.2120 CCC(C)(O)CC(=O)CCCCCCO 1458a_200011219800_100000766143 [0,1,0,0,1,0|2,0,0]=4 3424 B14R0.2120 CCCCCCCC(=O)CC(C)(C)CC 1458a_200000763500_100000210614 [0,1,0,0,1,0|2,0,0]=4 3425 B14R0.2120 CCCCCCCC(=O)CC(C)(O)CC 1458a_200011219800_100000210614 [0,1,0,0,1,0|1,0,0]=3 3426 B14R0.2120 CCCCCCCC(=O)NC(C)(C)CO 240690a_100000210608_100000211969 [0,1,0,0,1,0|2,0,0]=4 3427 B14R0.2120 CCCCCCCC(=O)NC(C)(C)CO 527a_100020618417_100000211969 [0,1,0,0,1,0|2,0,0]=4 3428 B14R0.2120 CCCCCCNC(=O)CC(C)(O)CC 240690a_100000210581_200011219800 [0,1,0,0,1,0|2,0,0]=4 3429 B14R0.2120 CCCCCCNC(=O)CC(C)(O)CC 527a_100000210581_200011219800 [0,1,0,0,1,0|2,0,0]=4 3430 B14R0.2120 CCCCOCCC(=O)CC(C)(O)CC 1458a_200011219800_100000743108 [0,1,0,0,1,0|2,0,0]=4 3431 B16R0.25 CC(C)CCCCCC(=O)NCCC(C)CO 240690a_106354213184_100000766313 [0,1,0,0,0,1|2,0,0]=4 3432 B16R0.25 CC(C)CCCCCC(=O)NCCC(C)CO 527a_106354213184_100000766313 [0,1,0,0,0,1|2,0,0]=4 3433 B16R0.25 CCC(O)CNNC(=O)CCCCCC(C)C 22a_100015206393_100000766313 [0,1,0,0,0,1|2,0,0]=4 3434 B16R0.112 CCCCCCCC(=O)OCNC(C)C(C)C 2230a_100000211541_100009852258 [0,1,0,0,0,1|2,0,0]=4 3435 B16R0.112 CCCCCCCC(=O)OCN[C@@H](C)C(=O)O 269956a_100000743915_100009852258 [0,1,0,0,0,1|1,0,1]=4 3436 B16R0.112 CCCCCCCC(=O)OCOC(C)C(C)C 7a_100000748068_100009852258 [0,1,0,0,0,1|2,0,0]=4 3437 B16R0.113 CCCCCCNC(=O)CN(C)CC(O)CO 2230a_100011216503_100000230325 [0,1,0,0,0,1|2,0,0]=4 3438 B16R0.113 CCCCCCNC(=O)CN(C)CC(O)CO 269982a_100011216503_100000230325 [0,1,0,0,0,1|2,0,0]=4 3439 B16R0.127 CCCCCCCC(=O)NNC(=O)C(O)CO 22a_100000181853_100011215603 [0,1,0,0,0,1|1,0,1]=4 3440 B16R0.127 CCCCCCCC(=O)OCC(=O)C(C)CC 1458a_100011192722_100009852258 [0,1,0,0,0,1|2,0,0]=4 3441 B16R0.127 CCCCCCCC(=O)OCC(=O)C(O)CC 1458a_100011196387_100009852258 [0,1,0,0,0,1|1,0,0]=3 3442 B16R0.127 CCCCCCCC(=O)OCC(=O)C(O)CO 1458a_100011215603_100009852258 [0,1,0,0,0,1|0,0,0]=2 3443 B16R0.127 CCCCCCCC(=O)OCN(C)C(C)CC 2230a_100000741768_100009852258 [0,1,0,0,0,1|2,0,0]=4 3444 B16R0.127 CCCCCCCC(=O)OCN(C)C(C)CC 269982a_100000741768_100009852258 [0,1,0,0,0,1|2,0,0]=4 3445 B16R0.127 CCCCCCCC(=O)OCN(C)C(C)CO 2230a_100000693034_100009852258 [0,1,0,0,0,1|1,0,0]=3 3446 B16R0.127 CCCCCCCC(=O)OCN(C)C(C)CO 269982a_100000693034_100009852258 [0,1,0,0,0,1|1,0,0]=3 3447 B16R0.1134 CCCCCCC(O)C(=O)NCCC(C)CO 240690a_106354213184_100011215828 [0,1,0,0,0,1|2,0,0]=4 3448 B16R0.1134 CCCCCCC(O)C(=O)NNCC(O)CC 22a_100015206393_100011215828 [0,1,0,0,0,1|2,0,0]=4 3449 B16R0.1817 CC(CO)CCNC(=O)CCCCCCCO 240690a_106354213184_100011219782 [0,1,0,0,0,1|2,0,0]=4 3450 B16R0.1817 CCC(O)CNNC(=O)CCCCCCCO 22a_100015206393_100011219782 [0,1,0,0,0,1|2,0,0]=4 3451 B16R0.1817 CCCCCCCCC(=O)NCCC(C)CO 240690a_106354213184_100000210188 [0,1,0,0,0,1|2,0,0]=4 3452 B16R0.1817 CCCCCCCCC(=O)NCCC(C)CO 527a_106354213184_100000210188 [0,1,0,0,0,1|2,0,0]=4 3453 B16R0.1817 CCCCCCCCC(=O)NNCC(O)CC 22a_100015206393_100000210188 [0,1,0,0,0,1|2,0,0]=4 3454 B16R0.1817 CCCCCCCCC(C)COCC(O)CO 34a_200012125181_100011219619 [0,1,0,0,0,1|1,0,1]=4 3455 B16R0.1817 CCCCCCCCC(C)COCC(O)CO 7a_200012125181_100011219619 [0,1,0,0,0,1|1,0,1]=4 3456 B16R0.1817 CCCCCCCCC(C)COC[C@@H](O)CO 34a_200012125181_100009815848 [0,1,0,0,0,1|1,0,1]=4 3457 B16R0.1817 CCCCCCCCC(C)COC[C@@H](O)CO 7a_200012125181_100009815848 [0,1,0,0,0,1|1,0,1]=4 3458 B16R0.1817 CCCCCCCNC(=O)NCCC(C)CO 2708a_100000229938_106354213184 [0,1,0,0,0,1|2,0,0]=4 3459 B16R0.1817 CCCCCCCNC(=O)NCCC(C)CO 273464a_100000229938_106354213184 [0,1,0,0,0,1|2,0,0]=4 3460 B16R0.1817 CCCCCCCNC(=O)NCCC(C)CO 273464a_106354213184_100000229938 [0,1,0,0,0,1|2,0,0]=4 3461 B16R0.1817 CCCCCCCNC(=O)NCCC(C)CO 512a_100000229938_106354213184 [0,1,0,0,0,1|2,0,0]=4 3462 B16R0.1817 CCCCCCCNC(=O)NCCC(C)CO 512a_106354213184_100000229938 [0,1,0,0,0,1|2,0,0]=4 3463 B16R0.1817 CCCCCCCNC(=O)NNCC(O)CC 273464a_100000229938_100015206393 [0,1,0,0,0,1|2,0,0]=4 3464 B16R0.1817 CCCCCCCNC(=O)NNCC(O)CC 512a_100000229938_100015206393 [0,1,0,0,0,1|2,0,0]=4 3465 B16R0.1817 CCCCCCCNC(=O)NNCC(O)CC 512a_100015206393_100000229938 [0,1,0,0,0,1|2,0,0]=4 3466 B16R0.3247 C#CC(CC)OCOC(=O)CCCCCCC 34a_100000758843_100009852258 [0,1,0,0,0,1|2,0,0]=4 3467 B16R0.3247 C#CC(CC)OCOC(=O)CCCCCCC 7a_100000758843_100009852258 [0,1,0,0,0,1|2,0,0]=4 3468 B16R0.3247 C=CC(CC)OCOC(=O)CCCCCCC 34a_100000766422_100009852258 [0,1,0,0,0,1|2,0,0]=4 3469 B16R0.3247 C=CC(CC)OCOC(=O)CCCCCCC 7a_100000766422_100009852258 [0,1,0,0,0,1|2,0,0]=4 3470 B16R0.3247 C=C[C@@H](CO)NCOC(=O)CCCCCCC 2230a_100016989147_100009852258 [0,1,0,0,0,1|1,0,0]=3 3471 B16R0.3247 C=C[C@@H](CO)NCOC(=O)CCCCCCC 34a_100016989147_100009852258 [0,1,0,0,0,1|1,0,0]=3 3472 B16R0.3247 CCCCCCCC(=O)OCNC(CC)CC 2230a_100000199018_100009852258 [0,1,0,0,0,1|2,0,0]=4 3473 B16R0.3247 CCCCCCCC(=O)OCNC(CO)CO 2230a_100000759517_100009852258 [0,1,0,0,0,1|0,0,0]=2 3474 B16R0.3247 CCCCCCCC(=O)OCN[C@@H](CC)CO 2230a_100000709445_100009852258 [0,1,0,0,0,1|1,0,0]=3 3475 B16R0.3247 CCCCCCCC(=O)OCOC(CC)CC 7a_100000688536_100009852258 [0,1,0,0,0,1|2,0,0]=4 3476 B16R0.3247 CCCCCCCC(=O)OCOC(CCl)CCl 7a_100000737055_100009852258 [0,1,0,0,0,1|2,0,0]=4 3477 B16R0.3247 CCCCCCCC(=O)OCOC(CF)CF 34a_100000032261_100009852258 [0,1,0,0,0,1|2,0,0]=4 3478 B16R0.3247 CCCCCCCC(=O)OCOC(CF)CF 7a_100000032261_100009852258 [0,1,0,0,0,1|2,0,0]=4 3479 B16R0.3247 CCCCCCCC(=O)OCOC(CN)CN 34a_100000031598_100009852258 [0,1,0,0,0,1|2,0,0]=4 3480 B16R0.3247 CCCCCCCC(=O)OCO[C@@H](CF)CCl 34a_100015614560_100009852258 [0,1,0,0,0,1|2,0,0]=4 3481 B16R0.3247 CCCCCCCC(=O)OCO[C@@H](CF)CCl 7a_100015614560_100009852258 [0,1,0,0,0,1|2,0,0]=4 3482 B16R0.3247 CCCCCCCC(=O)OCSC(CC)CC 62a_100000210505_100009852258 [0,1,0,0,0,1|2,0,0]=4 3483 B16R0.3247 CCCCCCNC(=O)COCC(CC)OC 34a_100011934954_100000230325 [0,1,0,0,0,1|2,0,0]=4 3484 B16R0.3247 CCCCCCNC(=O)COCC(CC)OC 7a_100011934954_100000230325 [0,1,0,0,0,1|2,0,0]=4 3485 B16R0.5205 C#CCC(C)OCOC(=O)CCCCCCC 34a_100000685586_100009852258 [0,1,0,0,0,1|2,0,0]=4 3486 B16R0.5205 C#CCC(C)OCOC(=O)CCCCCCC 7a_100000685586_100009852258 [0,1,0,0,0,1|2,0,0]=4 3487 B16R0.5205 C=CC[C@@H](C)OCOC(=O)CCCCCCC 34a_100000731007_100009852258 [0,1,0,0,0,1|2,0,0]=4 3488 B16R0.5205 C=CC[C@@H](C)OCOC(=O)CCCCCCC 7a_100000731007_100009852258 [0,1,0,0,0,1|2,0,0]=4 3489 B16R0.5205 CCCCCCCC(=O)NNCC(O)CSC 22a_200000122717_100000211969 [0,1,0,0,0,1|1,1,0]=4 3490 B16R0.5205 CCCCCCCC(=O)OCNC(C)CCC 2230a_100000741246_100009852258 [0,1,0,0,0,1|2,0,0]=4 3491 B16R0.5205 CCCCCCCC(=O)OCN[C@@H](C)CC#N 2230a_100016994482_100009852258 [0,1,0,0,0,1|2,0,0]=4 3492 B16R0.5205 CCCCCCCC(=O)OCN[C@H](C)CCO 2230a_100000706166_100009852258 [0,1,0,0,0,1|1,0,0]=3 3493 B16R0.5205 CCCCCCCC(=O)OCN[C@H](C)CCO 34a_100000706166_100009852258 [0,1,0,0,0,1|1,0,0]=3 3494 B16R0.5205 CCCCCCCC(=O)OCN[C@H](C)COC 2230a_100000764878_100009852258 [0,1,0,0,0,1|1,0,0]=3 3495 B16R0.5205 CCCCCCCC(=O)OCOC(C)CCBr 34a_100012276601_100009852258 [0,1,0,0,0,1|2,0,0]=4 3496 B16R0.5205 CCCCCCCC(=O)OCOC(C)CCC 34a_100000764384_100009852258 [0,1,0,0,0,1|2,0,0]=4 3497 B16R0.5205 CCCCCCCC(=O)OCOC(C)CCC 7a_100000764384_100009852258 [0,1,0,0,0,1|2,0,0]=4 3498 B16R0.5205 CCCCCCCC(=O)OCO[C@H](C)COC 34a_100011934205_100009852258 [0,1,0,0,0,1|1,0,0]=3 3499 B16R0.5205 CCCCCCCC(=O)OCSC(C)CC#N 62a_100009813641_100009852258 [0,1,0,0,0,1|2,0,0]=4 3500 B16R0.5205 CCCCCCCC(=O)OCSC(C)CCC 62a_100000766640_100009852258 [0,1,0,0,0,1|2,0,0]=4 3501 B16R0.5205 CCCCCCCC(=O)OCSC(C)CCO 62a_100009893172_100009852258 [0,1,0,0,0,1|1,0,0]=3 3502 B16R0.5205 CCCCCCCC(=O)OCSC(C)COC 62a_100000765312_100009852258 [0,1,0,0,0,1|1,0,0]=3 3503 B16R0.5205 CCCCCCNC(=O)CNCC(O)COC 2230a_100000756049_100000230325 [0,1,0,0,0,1|2,0,0]=4 3504 B16R0.5205 CCCCCCNC(=O)CNCC(O)COC 34a_100000756049_100000230325 [0,1,0,0,0,1|2,0,0]=4 3505 B16R0.5205 CCCCCCNC(=O)COCC(N)COC 34a_100000724102_100000230325 [0,1,0,0,0,1|2,0,0]=4 3506 B16R0.5205 CCCCCCNC(=O)CSCC(O)COC 62a_100000230325_100011215053 [0,1,0,0,0,1|1,1,0]=4 3507 B16R0.6229 CCCCC(C)CCC(=O)NCCC(C)CO 240690a_106354213184_100000033779 [0,1,0,0,0,1|2,0,0]=4 3508 B16R0.6229 CCCCC(C)CCC(=O)NCCC(C)CO 527a_106354213184_100000033779 [0,1,0,0,0,1|2,0,0]=4 3509 B16R0.6229 CCCCC(C)CCC(=O)NNCC(O)CC 22a_100015206393_100000033779 [0,1,0,0,0,1|2,0,0]=4 3510 B16R0.6965 CCCCCC(C)NC(=O)CNC[C@H](O)CO 2230a_100020644852_100000230335 [0,1,0,0,0,1|2,0,0]=4 3511 B16R0.6965 CCCCCC(C)NC(=O)CSCC(O)CO 62a_100000230335_100011219619 [0,1,0,0,0,1|1,1,0]=4 3512 B16R0.6965 CCCCCC(C)NC(=O)CSCC(O)CO 62a_100011219619_100000230335 [0,1,0,0,0,1|1,1,0]=4 3513 B16R0.6965 CCCCCC(C)NC(=O)CSC[C@@H](O)CO 62a_100000230335_100009815848 [0,1,0,0,0,1|1,1,0]=4 3514 B16R0.6965 CCCCCC(C)NC(=O)CSC[C@@H](O)CO 62a_100009815848_100000230335 [0,1,0,0,0,1|1,1,0]=4 3515 B16R0.6965 CCCCCC(C)OC(=O)CNC[C@H](O)CO 2230a_100020644852_200000092394 [0,1,0,0,0,1|2,0,0]=4 3516 B16R0.6965 CCCCCC(C)OC(=O)CSCC(O)CO 62a_100011219619_200000092394 [0,1,0,0,0,1|1,1,0]=4 3517 B16R0.6965 CCCCCC(C)OC(=O)CSCC(O)CO 62a_200000092394_100011219619 [0,1,0,0,0,1|1,1,0]=4 3518 B16R0.6965 CCCCCC(C)OC(=O)CSC[C@@H](O)CO 62a_100009815848_200000092394 [0,1,0,0,0,1|1,1,0]=4 3519 B16R0.6965 CCCCCC(C)OC(=O)CSC[C@@H](O)CO 62a_200000092394_100009815848 [0,1,0,0,0,1|1,1,0]=4 3520 B16R0.8575 CCCCCCCC(=O)OCNC(C)(C)CC 2230a_100000211385_100009852258 [0,1,0,0,0,1|2,0,0]=4 3521 B16R0.8575 CCCCCCCC(=O)OCNC(C)(C)CO 2230a_100000210608_100009852258 [0,1,0,0,0,1|1,0,0]=3 3522 B16R0.8575 CCCCCCCC(=O)OCOC(C)(C)CC 7a_100000210230_100009852258 [0,1,0,0,0,1|2,0,0]=4 3523 B16R0.8575 CCCCCCCC(=O)OCOC(C)(C)CCl 7a_100000764493_100009852258 [0,1,0,0,0,1|2,0,0]=4 3524 B16R0.8575 CCCCCCCC(=O)OCSC(C)(C)CC 62a_100000032637_100009852258 [0,1,0,0,0,1|2,0,0]=4 3525 B16R0.8575 CCCCCCCC(=O)OCSC(F)(F)CO 62a_100011217949_100009852258 [0,1,0,0,0,1|1,0,0]=3 3526 B16R0.12 CCCCC(C)CCC(=O)N(C)CC(O)CO 240690a_100011216503_100000033779 [0,2,0,0,0,0|1,0,0]=3 3527 B16R0.12 CCCCC(C)CCC(=O)N(C)CC(O)CO 527a_100011216503_100000033779 [0,2,0,0,0,0|1,0,0]=3 3528 B16R0.128 CCCCCCCC(=O)N(CC)CC(O)CC 11a_100011365200_100000211969 [0,2,0,0,0,0|2,0,0]=4 3529 B16R0.128 CCCCCCCC(=O)N(CC)CC(O)CC 1626a_100011365200_100000211969 [0,2,0,0,0,0|2,0,0]=4 3530 B16R0.128 CCCCCCCC(=O)N(CC)CC(O)CC 240690a_100011365200_100000211969 [0,2,0,0,0,0|2,0,0]=4 3531 B16R0.128 CCCCCCCC(=O)N(CC)CC(O)CC 527a_100011365200_100000211969 [0,2,0,0,0,0|2,0,0]=4 3532 B16R0.3180 C#CCCCCCCC(=O)N(C)CC(O)CO 240690a_100011216503_100000034748 [0,2,0,0,0,0|1,0,1]=4 3533 B16R0.3180 C#CCCCCCCC(=O)N(C)CC(O)CO 527a_100011216503_100000034748 [0,2,0,0,0,0|1,0,1]=4 3534 B16R0.3180 C=CCCCCCCC(=O)N(C)CC(O)CO 240690a_100011216503_100011809334 [0,2,0,0,0,0|1,0,1]=4 3535 B16R0.3180 C=CCCCCCCC(=O)N(C)CC(O)CO 527a_100011216503_100011809334 [0,2,0,0,0,0|1,0,1]=4 3536 B16R0.3180 CCCCC/C=C/CC(=O)N(C)CC(O)CO 240690a_100011216503_100020675968 [0,2,0,0,0,0|1,0,1]=4 3537 B16R0.3180 CCCCCCC=CC(=O)N(C)CC(O)CO 240690a_100011216503_200015324643 [0,2,0,0,0,0|1,0,1]=4 3538 B16R0.3180 CCCCCCCCC(=O)N(C)CC(O)CO 240690a_100011216503_100000210188 [0,2,0,0,0,0|1,0,0]=3 3539 B16R0.3180 CCCCCCCCC(=O)N(C)CC(O)CO 527a_100011216503_100000210188 [0,2,0,0,0,0|1,0,0]=3 3540 B16R0.3180 CCCCCCCNC(=O)N(C)CC(O)CO 2708a_100000229938_100011216503 [0,2,0,0,0,0|1,0,0]=3 3541 B16R0.3180 CCCCSCCNC(=O)N(C)CC(O)CO 2708a_100025743550_100011216503 [0,2,0,0,0,0|2,0,0]=4 3542 B16R0.3180 CCCOCCCNC(=O)N(C)CC(O)CO 2708a_100011217757_100011216503 [0,2,0,0,0,0|2,0,0]=4 3543 B16R0.3180 CN(CC(O)CO)C(=O)CCCCCCCO 240690a_100011216503_100011219782 [0,2,0,0,0,0|1,0,0]=3 3544 B16R0.3180 COCCCCCNC(=O)N(C)CC(O)CO 2708a_100000747528_100011216503 [0,2,0,0,0,0|2,0,0]=4 3545 B16R0.3262 CCCCCC(C)NC(=O)N(C)CC(O)CO 2708a_100000211957_100011216503 [0,2,0,0,0,0|2,0,0]=4 3546 B16R0.3282 CCCCCCC(O)C(=O)N(C)CC(O)CO 240690a_100011216503_100011215828 [0,2,0,0,0,0|1,0,0]=3 3547 B16R0.5022 CCCCCCCC(=O)N(C)CC(C)(C)CO 240690a_100000732702_100000211969 [0,2,0,0,0,0|2,0,0]=4 3548 B16R0.5022 CCCCCCCC(=O)N(C)CC(C)(C)CO 527a_100000732702_100000211969 [0,2,0,0,0,0|2,0,0]=4 3549 B16R0.5197 CCCCCCCC(=O)N(C)CC(O)COC 240690a_100000739405_100000211969 [0,2,0,0,0,0|1,0,0]=3 3550 B16R0.5197 CCCCCCCC(=O)N(C)CC(O)COC 527a_100000739405_100000211969 [0,2,0,0,0,0|1,0,0]=3 3551 B16R0.5197 CCCCCCNC(=O)N(C)CC(O)COC 273464a_100000210581_100000739405 [0,2,0,0,0,0|2,0,0]=4 3552 B16R0.5197 COCC(O)CN(C)C(=O)CCCCCCO 240690a_100000739405_100011996774 [0,2,0,0,0,0|2,0,0]=4 3553 B16R0.5197 COCCCCCC(=O)N(C)CC(O)COC 240690a_100000739405_100011935119 [0,2,0,0,0,0|2,0,0]=4 3554 B16R0.5197 COCCCCCC(=O)N(C)CC(O)COC 527a_100000739405_100011935119 [0,2,0,0,0,0|2,0,0]=4 3555 B16R0.7185 CC(C)CCCCCC(=O)N(C)CC(O)CO 240690a_100011216503_100000766313 [0,2,0,0,0,0|1,0,0]=3 3556 B16R0.7185 CC(C)CCCCCC(=O)N(C)CC(O)CO 527a_100011216503_100000766313 [0,2,0,0,0,0|1,0,0]=3 3557 B16R0.110 CCCCCCCC(=O)NCC(O)CN(C)C 240690a_100000737402_100000211969 [0,2,0,0,0,0|2,0,0]=4 3558 B16R0.110 CCCCCCCC(=O)NCC(O)CN(C)C 527a_100000737402_100000211969 [0,2,0,0,0,0|2,0,0]=4 3559 B16R0.110 CCCCCCCC(=O)OCC(=O)C[C@@H](C)O 1458a_100011933948_100009852258 [0,2,0,0,0,0|0,0,2]=4 3560 B16R0.110 CCCCCCCC(=O)OCN(C)CC(=O)O 269956a_100000746989_100009852258 [0,2,0,0,0,0|2,0,0]=4 3561 B16R0.110 CCCCCCCC(=O)OCN(C)CC(C)O 2230a_100000227577_100009852258 [0,2,0,0,0,0|2,0,0]=4 3562 B16R0.110 CCCCCCCC(=O)OCN(C)CC(C)O 269982a_100000227577_100009852258 [0,2,0,0,0,0|2,0,0]=4 3563 B16R0.122 CCCCCCCC(=O)NCC(CC)OCC 11a_100015183923_100000211969 [0,2,0,0,0,0|2,0,0]=4 3564 B16R0.122 CCCCCCCC(=O)NCC(CC)OCC 1626a_100015183923_100000211969 [0,2,0,0,0,0|2,0,0]=4 3565 B16R0.122 CCCCCCCC(=O)NCC(CC)OCC 240690a_100015183923_100000211969 [0,2,0,0,0,0|2,0,0]=4 3566 B16R0.122 CCCCCCCC(=O)NCC(CC)OCC 527a_100015183923_100000211969 [0,2,0,0,0,0|2,0,0]=4 3567 B16R0.122 CCCCCCCC(=O)OCN(CC)CCO 2230a_100000210973_100009852258 [0,2,0,0,0,0|2,0,0]=4 3568 B16R0.122 CCCCCCCC(=O)OCN(CC)CCO 269982a_100000210973_100009852258 [0,2,0,0,0,0|2,0,0]=4 3569 B16R0.137 C#CCCCCCCC(=O)NCC(O)COC 240690a_100000756049_100000034748 [0,2,0,0,0,0|1,0,1]=4 3570 B16R0.137 C#CCCCCCCC(=O)NCC(O)COC 527a_100000756049_100000034748 [0,2,0,0,0,0|1,0,1]=4 3571 B16R0.137 C=CCCCCCCC(=O)NCC(O)COC 240690a_100000756049_100011809334 [0,2,0,0,0,0|1,0,1]=4 3572 B16R0.137 C=CCCCCCCC(=O)NCC(O)COC 527a_100000756049_100011809334 [0,2,0,0,0,0|1,0,1]=4 3573 B16R0.137 CCCCC/C=C/CC(=O)NCC(O)COC 240690a_100000756049_100020675968 [0,2,0,0,0,0|1,0,1]=4 3574 B16R0.137 CCCCCCC=CC(=O)NCC(O)COC 240690a_100000756049_200015324643 [0,2,0,0,0,0|1,0,1]=4 3575 B16R0.137 CCCCCCCCC(=O)NCC(O)COC 240690a_100000756049_100000210188 [0,2,0,0,0,0|1,0,0]=3 3576 B16R0.137 CCCCCCCCC(=O)NCC(O)COC 527a_100000756049_100000210188 [0,2,0,0,0,0|1,0,0]=3 3577 B16R0.137 CCCCCCCCC(C)OCC(O)COC 34a_100000210740_100011215053 [0,2,0,0,0,0|1,0,1]=4 3578 B16R0.137 CCCCCCCCC(C)OCC(O)COC 7a_100000210740_100011215053 [0,2,0,0,0,0|1,0,1]=4 3579 B16R0.137 CCCCCCCNC(=O)NCC(O)COC 2708a_100000229938_100000756049 [0,2,0,0,0,0|1,0,0]=3 3580 B16R0.137 CCCCCCCNC(=O)NCC(O)COC 273464a_100000229938_100000756049 [0,2,0,0,0,0|1,0,0]=3 3581 B16R0.137 CCCCCCCNC(=O)NCC(O)COC 273464a_100000756049_100000229938 [0,2,0,0,0,0|1,0,0]=3 3582 B16R0.137 CCCCCCCNC(=O)NCC(O)COC 512a_100000229938_100000756049 [0,2,0,0,0,0|1,0,0]=3 3583 B16R0.137 CCCCCCCNC(=O)NCC(O)COC 512a_100000756049_100000229938 [0,2,0,0,0,0|1,0,0]=3 3584 B16R0.137 CCCCSCCNC(=O)NCC(O)COC 2708a_100025743550_100000756049 [0,2,0,0,0,0|2,0,0]=4 3585 B16R0.137 CCCCSCCNC(=O)NCC(O)COC 273464a_100000756049_100025743550 [0,2,0,0,0,0|2,0,0]=4 3586 B16R0.137 CCCCSCCNC(=O)NCC(O)COC 273464a_100025743550_100000756049 [0,2,0,0,0,0|2,0,0]=4 3587 B16R0.137 CCCCSCCNC(=O)NCC(O)COC 512a_100000756049_100025743550 [0,2,0,0,0,0|2,0,0]=4 3588 B16R0.137 CCCCSCCNC(=O)NCC(O)COC 512a_100025743550_100000756049 [0,2,0,0,0,0|2,0,0]=4 3589 B16R0.137 CCCOCCCNC(=O)NCC(O)COC 2708a_100011217757_100000756049 [0,2,0,0,0,0|2,0,0]=4 3590 B16R0.137 CCCOCCCNC(=O)NCC(O)COC 273464a_100000756049_100011217757 [0,2,0,0,0,0|2,0,0]=4 3591 B16R0.137 CCCOCCCNC(=O)NCC(O)COC 273464a_100011217757_100000756049 [0,2,0,0,0,0|2,0,0]=4 3592 B16R0.137 CCCOCCCNC(=O)NCC(O)COC 512a_100000756049_100011217757 [0,2,0,0,0,0|2,0,0]=4 3593 B16R0.137 CCCOCCCNC(=O)NCC(O)COC 512a_100011217757_100000756049 [0,2,0,0,0,0|2,0,0]=4 3594 B16R0.137 COCC(O)CNC(=O)CCCCCCCO 240690a_100000756049_100011219782 [0,2,0,0,0,0|1,0,0]=3 3595 B16R0.137 COCC(O)CNC(=O)NCCCCCCO 273464a_100000686447_100000756049 [0,2,0,0,0,0|2,0,0]=4 3596 B16R0.137 COCC(O)CNC(=O)NCCCCCCO 273464a_100000756049_100000686447 [0,2,0,0,0,0|2,0,0]=4 3597 B16R0.137 COCC(O)CNC(=O)NCCCCCCO 512a_100000686447_100000756049 [0,2,0,0,0,0|2,0,0]=4 3598 B16R0.137 COCC(O)CNC(=O)NCCCCCCO 512a_100000756049_100000686447 [0,2,0,0,0,0|2,0,0]=4 3599 B16R0.137 COCCCCCNC(=O)NCC(O)COC 2708a_100000747528_100000756049 [0,2,0,0,0,0|2,0,0]=4 3600 B16R0.137 COCCCCCNC(=O)NCC(O)COC 273464a_100000747528_100000756049 [0,2,0,0,0,0|2,0,0]=4 3601 B16R0.137 COCCCCCNC(=O)NCC(O)COC 273464a_100000756049_100000747528 [0,2,0,0,0,0|2,0,0]=4 3602 B16R0.137 COCCCCCNC(=O)NCC(O)COC 512a_100000747528_100000756049 [0,2,0,0,0,0|2,0,0]=4 3603 B16R0.137 COCCCCCNC(=O)NCC(O)COC 512a_100000756049_100000747528 [0,2,0,0,0,0|2,0,0]=4 3604 B16R0.789 CCCCCCCC(=O)NCC(O)COCC 240690a_102515437182_100000211969 [0,2,0,0,0,0|1,0,0]=3 3605 B16R0.789 CCCCCCCC(=O)NCC(O)COCC 527a_102515437182_100000211969 [0,2,0,0,0,0|1,0,0]=3 3606 B16R0.789 CCCCCCCC(=O)NC[C@H](C)CCCO 240690a_100160569302_100000211969 [0,2,0,0,0,0|2,0,0]=4 3607 B16R0.789 CCCCCCCC(=O)NC[C@H](C)CCCO 527a_100160569302_100000211969 [0,2,0,0,0,0|2,0,0]=4 3608 B16R0.789 CCCCCCCC(=O)OCC(=O)C#CCO 1458a_100000049017_100009852258 [0,2,0,0,0,0|0,0,2]=4 3609 B16R0.789 CCCCCCCC(=O)OCC(=O)CCOC 1458a_100000749529_100009852258 [0,2,0,0,0,0|0,0,2]=4 3610 B16R0.789 CCCCCCCC(=O)OCC(=O)COCC 1458a_100000211967_100009852258 [0,2,0,0,0,0|0,0,2]=4 3611 B16R0.789 CCCCCCCC(=O)OCN(C)CCCO 2230a_100000213112_100009852258 [0,2,0,0,0,0|2,0,0]=4 3612 B16R0.789 CCCCCCCC(=O)OCN(C)CCCO 269982a_100000213112_100009852258 [0,2,0,0,0,0|2,0,0]=4 3613 B16R0.789 CCCCCCCC(=O)OCN(C)CCOC 2230a_100000743101_100009852258 [0,2,0,0,0,0|2,0,0]=4 3614 B16R0.789 CCCCCCCC(=O)OCN(C)CCOC 269982a_100000743101_100009852258 [0,2,0,0,0,0|2,0,0]=4 3615 B16R0.789 CCCCCCNC(=O)NCC(O)COCC 2708a_100000210581_102515437182 [0,2,0,0,0,0|2,0,0]=4 3616 B16R0.789 CCCCCCNC(=O)NCC(O)COCC 273464a_100000210581_102515437182 [0,2,0,0,0,0|2,0,0]=4 3617 B16R0.789 CCCCCCNC(=O)NCC(O)COCC 273464a_102515437182_100000210581 [0,2,0,0,0,0|2,0,0]=4 3618 B16R0.789 CCCCCCNC(=O)NCC(O)COCC 512a_102515437182_100000210581 [0,2,0,0,0,0|2,0,0]=4 3619 B16R0.789 CCOCC(O)CNC(=O)CCCCCCO 240690a_102515437182_100011996774 [0,2,0,0,0,0|2,0,0]=4 3620 B16R0.789 CCOCC(O)CNC(=O)CCCCCOC 240690a_102515437182_100011935119 [0,2,0,0,0,0|2,0,0]=4 3621 B16R0.789 CCOCC(O)CNC(=O)CCCCCOC 527a_102515437182_100011935119 [0,2,0,0,0,0|2,0,0]=4 3622 B16R0.914 CCCCCCC(O)C(=O)NCC(O)COC 240690a_100000756049_100011215828 [0,2,0,0,0,0|1,0,0]=3 3623 B16R0.914 CCCCCCN(C)C(=O)NCC(O)COC 273464a_100000756049_106256046315 [0,2,0,0,0,0|2,0,0]=4 3624 B16R0.946 C=CC(CCCCCCC)OCC(O)COC 34a_200011934235_100011215053 [0,2,0,0,0,0|1,0,1]=4 3625 B16R0.946 C=CC(CCCCCCC)OCC(O)COC 7a_200011934235_100011215053 [0,2,0,0,0,0|1,0,1]=4 3626 B16R0.946 CCCCCCCC(CC)OCC(O)COC 34a_200011217053_100011215053 [0,2,0,0,0,0|1,0,1]=4 3627 B16R0.946 CCCCCCCC(CC)OCC(O)COC 7a_200011217053_100011215053 [0,2,0,0,0,0|1,0,1]=4 3628 B16R0.1035 CCCCC(C)CCC(=O)NCC(O)COC 240690a_100000756049_100000033779 [0,2,0,0,0,0|1,0,0]=3 3629 B16R0.1035 CCCCC(C)CCC(=O)NCC(O)COC 527a_100000756049_100000033779 [0,2,0,0,0,0|1,0,0]=3 3630 B16R0.3455 CCCCCC(C)NC(=O)NCC(O)COC 2708a_100000211957_100000756049 [0,2,0,0,0,0|2,0,0]=4 3631 B16R0.3455 CCCCCC(C)NC(=O)NCC(O)COC 273464a_100000211957_100000756049 [0,2,0,0,0,0|2,0,0]=4 3632 B16R0.3455 CCCCCC(C)NC(=O)NCC(O)COC 273464a_100000756049_100000211957 [0,2,0,0,0,0|2,0,0]=4 3633 B16R0.3455 CCCCCC(C)NC(=O)NCC(O)COC 512a_100000211957_100000756049 [0,2,0,0,0,0|2,0,0]=4 3634 B16R0.3455 CCCCCC(C)NC(=O)NCC(O)COC 512a_100000756049_100000211957 [0,2,0,0,0,0|2,0,0]=4 3635 B16R0.5761 COCC(O)CNC(=O)CCCCCC(C)C 240690a_100000756049_100000766313 [0,2,0,0,0,0|1,0,0]=3 3636 B16R0.5761 COCC(O)CNC(=O)CCCCCC(C)C 527a_100000756049_100000766313 [0,2,0,0,0,0|1,0,0]=3 3637 B16R0.6007 CCCCCCCC(=O)NCC(C)(C)COC 11a_100000734190_100000211969 [0,2,0,0,0,0|2,0,0]=4 3638 B16R0.6007 CCCCCCCC(=O)NCC(C)(C)COC 1626a_100000734190_100000211969 [0,2,0,0,0,0|2,0,0]=4 3639 B16R0.6007 CCCCCCCC(=O)NCC(C)(C)COC 240690a_100000734190_100000211969 [0,2,0,0,0,0|2,0,0]=4 3640 B16R0.6007 CCCCCCCC(=O)NCC(C)(C)COC 527a_100000734190_100000211969 [0,2,0,0,0,0|2,0,0]=4 3641 B16R0.69 CC(C)C(O)CNC(=O)CCCCCCCO 240690a_100000759067_100011219782 [0,2,0,0,0,0|2,0,0]=4 3642 B16R0.69 CCCCCCCCC(=O)NCC(O)C(C)C 11a_100000759067_100000210188 [0,2,0,0,0,0|2,0,0]=4 3643 B16R0.69 CCCCCCCCC(=O)NCC(O)C(C)C 240690a_100000759067_100000210188 [0,2,0,0,0,0|2,0,0]=4 3644 B16R0.69 CCCCCCCCC(=O)NCC(O)C(C)C 527a_100000759067_100000210188 [0,2,0,0,0,0|2,0,0]=4 3645 B16R0.69 CCCCCCCNC(=O)NCC(O)C(C)C 2708a_100000229938_100000759067 [0,2,0,0,0,0|2,0,0]=4 3646 B16R0.69 CCCCCCCNC(=O)NCC(O)C(C)C 273464a_100000229938_100000759067 [0,2,0,0,0,0|2,0,0]=4 3647 B16R0.69 CCCCCCCNC(=O)NCC(O)C(C)C 273464a_100000759067_100000229938 [0,2,0,0,0,0|2,0,0]=4 3648 B16R0.69 CCCCCCCNC(=O)NCC(O)C(C)C 512a_100000229938_100000759067 [0,2,0,0,0,0|2,0,0]=4 3649 B16R0.69 CCCCCCCNC(=O)NCC(O)C(C)C 512a_100000759067_100000229938 [0,2,0,0,0,0|2,0,0]=4 3650 B16R0.197 CCCCC(C)CCC(=O)NCC(O)C(C)C 11a_100000759067_100000033779 [0,2,0,0,0,0|2,0,0]=4 3651 B16R0.197 CCCCC(C)CCC(=O)NCC(O)C(C)C 240690a_100000759067_100000033779 [0,2,0,0,0,0|2,0,0]=4 3652 B16R0.197 CCCCC(C)CCC(=O)NCC(O)C(C)C 527a_100000759067_100000033779 [0,2,0,0,0,0|2,0,0]=4 3653 B16R0.276 CCCCCCC(O)C(=O)NCC(O)C(C)C 240690a_100000759067_100011215828 [0,2,0,0,0,0|2,0,0]=4 3654 B16R0.782 CCCCCCCC(=O)NCC(O)C(F)(F)F 11a_100000743304_100000211969 [0,2,0,0,0,0|2,0,0]=4 3655 B16R0.782 CCCCCCCC(=O)NCC(O)C(F)(F)F 240690a_100000743304_100000211969 [0,2,0,0,0,0|2,0,0]=4 3656 B16R0.782 CCCCCCCC(=O)NCC(O)C(F)(F)F 527a_100000743304_100000211969 [0,2,0,0,0,0|2,0,0]=4 3657 B16R0.782 CCCCCCCC(=O)NC[C@@H](F)C(C)(C)O 1626a_100015379105_100000211969 [0,2,0,0,0,0|2,0,0]=4 3658 B16R0.782 CCCCCCCC(=O)NC[C@@H](F)C(C)(C)O 527a_100015379105_100000211969 [0,2,0,0,0,0|2,0,0]=4 3659 B16R0.782 CCCCCCCC(=O)OCC(=O)C(C)(C)O 1458a_100000242741_100009852258 [0,2,0,0,0,0|0,0,2]=4 3660 B16R0.783 CCCCCCCC(=O)NCC(CO)C(C)C 240690a_100000692819_100000211969 [0,2,0,0,0,0|2,0,0]=4 3661 B16R0.783 CCCCCCCC(=O)NCC(CO)C(C)C 527a_100000692819_100000211969 [0,2,0,0,0,0|2,0,0]=4 3662 B16R0.2322 CC(C)CCCCCC(=O)NCC(O)C(C)C 11a_100000759067_100000766313 [0,2,0,0,0,0|2,0,0]=4 3663 B16R0.2322 CC(C)CCCCCC(=O)NCC(O)C(C)C 240690a_100000759067_100000766313 [0,2,0,0,0,0|2,0,0]=4 3664 B16R0.2322 CC(C)CCCCCC(=O)NCC(O)C(C)C 527a_100000759067_100000766313 [0,2,0,0,0,0|2,0,0]=4 3665 B16R0.218 CC(C)CCCC(=O)CC(=O)NCC(O)CO 1458a_100011216857_200012027429 [0,2,0,0,0,0|1,0,1]=4 3666 B16R0.218 CC(C)CCCC(C)NC(=O)NC[C@H](O)CO 2708a_100000210607_100020644852 [0,2,0,0,0,0|2,0,0]=4 3667 B16R0.218 CC(C)CCCC(C)NC(=O)NC[C@H](O)CO 273464a_100000210607_100020644852 [0,2,0,0,0,0|2,0,0]=4 3668 B16R0.219 CC(C)C[C@H](N)COCC(=O)NCC(O)CO 34a_100011830311_200012027429 [0,2,0,0,0,0|2,0,0]=4 3669 B16R0.1015 CCC(CNC(=O)CCCCCC(C)C)OC 11a_100000731041_100000766313 [0,2,0,0,0,0|2,0,0]=4 3670 B16R0.1015 CCC(CNC(=O)CCCCCC(C)C)OC 1626a_100000731041_100000766313 [0,2,0,0,0,0|2,0,0]=4 3671 B16R0.1015 CCC(CNC(=O)CCCCCC(C)C)OC 240690a_100000731041_100000766313 [0,2,0,0,0,0|2,0,0]=4 3672 B16R0.1015 CCC(CNC(=O)CCCCCC(C)C)OC 527a_100000731041_100000766313 [0,2,0,0,0,0|2,0,0]=4 3673 B16R0.3396 CC(C)C(N)CCOCC(=O)NCC(O)CO 34a_100161115045_200012027429 [0,2,0,0,0,0|2,0,0]=4 3674 B16R0.3400 CC(C)CCC(C)NCC(=O)NCC(O)CO 2230a_100138410893_200012027429 [0,2,0,0,0,0|2,0,0]=4 3675 B16R0.3400 CC(C)CCC(C)OCC(=O)NCC(O)CO 34a_100011215350_200012027429 [0,2,0,0,0,0|2,0,0]=4 3676 B16R0.3400 CC(C)CCC(C)OCC(=O)NCC(O)CO 7a_100011215350_200012027429 [0,2,0,0,0,0|2,0,0]=4 3677 B16R0.3400 CC(C)CCC(C)SCC(=O)NCC(O)CO 62a_100011261404_200012027429 [0,2,0,0,0,0|2,0,0]=4 3678 B16R0.3400 CC(C)CCC(C)SCC(=O)NCC(O)CO 62a_200012027429_100011261404 [0,2,0,0,0,0|2,0,0]=4 3679 B16R0.7311 CCC(C)CCCOCC(=O)NCC(O)CO 7a_100011216074_200012027429 [0,2,0,0,0,0|1,0,0]=3 3680 B16R0.7311 CCN(C)CCCSCC(=O)NCC(O)CO 62a_200012027429_100015186262 [0,2,0,0,0,0|2,0,0]=4 3681 B16R0.7311 COC(=O)CCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100009848860 [0,2,0,0,0,0|1,0,1]=4 3682 B16R0.7311 C[C@@H](CN)CCCOCC(=O)NCC(O)CO 34a_100160569302_200012027429 [0,2,0,0,0,0|2,0,0]=4 3683 B16R0.7878 CC(C)(C)CCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100012017116 [0,2,0,0,0,0|2,0,0]=4 3684 B16R0.7878 CC(C)(C)CCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100012017116 [0,2,0,0,0,0|2,0,0]=4 3685 B16R0.7878 CC(C)(C)CCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100012017116 [0,2,0,0,0,0|1,0,0]=3 3686 B16R0.7878 CC(C)(C)CCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100012017116 [0,2,0,0,0,0|1,0,0]=3 3687 B16R0.7878 CC(C)(O)CCCSCC(=O)NCC(O)CO 62a_100009888830_200012027429 [0,2,0,0,0,0|2,0,0]=4 3688 B16R0.7878 CC(C)(O)CCCSCC(=O)NCC(O)CO 62a_200012027429_100009888830 [0,2,0,0,0,0|2,0,0]=4 3689 B16R0.7878 CC(CO)CNC(=O)CCCCCC(C)(C)C 240690a_100000744482_100012017116 [0,2,0,0,0,0|2,0,0]=4 3690 B16R0.7878 CC(CO)CNC(=O)CCCCCC(C)(C)C 527a_100000744482_100012017116 [0,2,0,0,0,0|2,0,0]=4 3691 B16R0.7878 CCC(O)CNC(=O)CCCCCC(C)(C)C 11a_100011218483_100012017116 [0,2,0,0,0,0|2,0,0]=4 3692 B16R0.7878 CCC(O)CNC(=O)CCCCCC(C)(C)C 240690a_100011218483_100012017116 [0,2,0,0,0,0|2,0,0]=4 3693 B16R0.7878 CCC(O)CNC(=O)CCCCCC(C)(C)C 527a_100011218483_100012017116 [0,2,0,0,0,0|2,0,0]=4 3694 B16R0.8818 CC(C)CCCCCC(=O)NCC(C)(C)CO 240690a_100020635058_100000766313 [0,2,0,0,0,0|2,0,0]=4 3695 B16R0.8818 CC(C)CCCCCC(=O)NCC(C)(C)CO 527a_100020635058_100000766313 [0,2,0,0,0,0|2,0,0]=4 3696 B16R0.8818 CC(C)CCCCCC(=O)NCC(F)(F)CO 240690a_100000703232_100000766313 [0,2,0,0,0,0|2,0,0]=4 3697 B16R0.8818 CC(C)CCCCCC(=O)NCC(F)(F)CO 527a_100000703232_100000766313 [0,2,0,0,0,0|2,0,0]=4 3698 B16R0.5780 CCCC(C)CCOCC(=O)NCC(O)CO 34a_100011217855_200012027429 [0,2,0,0,0,0|1,0,0]=3 3699 B16R0.5780 CCCC(C)CCOCC(=O)NCC(O)CO 7a_100011217855_200012027429 [0,2,0,0,0,0|1,0,0]=3 3700 B16R0.5780 CCC[C@H](N)CCOCC(=O)NCC(O)CO 34a_100015193777_200012027429 [0,2,0,0,0,0|1,0,0]=3 3701 B16R0.5780 CCOC(=O)CCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100011217402 [0,2,0,0,0,0|1,0,1]=4 3702 B16R0.5780 CCOC(=O)CCCCC(=O)NC[C@H](O)CO 527a_100020644852_100011217402 [0,2,0,0,0,0|1,0,1]=4 3703 B16R0.7875 CCC(C)CC(C)NCC(=O)NCC(O)CO 2230a_100000763565_200012027429 [0,2,0,0,0,0|2,0,0]=4 3704 B16R0.7918 CCC(C)CCC(=O)CC(=O)NCC(O)CO 1458a_100000701222_200012027429 [0,2,0,0,0,0|1,0,1]=4 3705 B16R0.139 CCC(CNC(=O)CCCCCCCO)OC 240690a_100000731041_100011219782 [0,2,0,0,0,0|2,0,0]=4 3706 B16R0.139 CCCCCCCCC(=O)NCC(CC)OC 11a_100000731041_100000210188 [0,2,0,0,0,0|2,0,0]=4 3707 B16R0.139 CCCCCCCCC(=O)NCC(CC)OC 1626a_100000731041_100000210188 [0,2,0,0,0,0|2,0,0]=4 3708 B16R0.139 CCCCCCCCC(=O)NCC(CC)OC 240690a_100000731041_100000210188 [0,2,0,0,0,0|2,0,0]=4 3709 B16R0.139 CCCCCCCCC(=O)NCC(CC)OC 527a_100000731041_100000210188 [0,2,0,0,0,0|2,0,0]=4 3710 B16R0.139 CCCCCCCNC(=O)NCC(CC)OC 2708a_100000229938_100000731041 [0,2,0,0,0,0|2,0,0]=4 3711 B16R0.139 CCCCCCCNC(=O)NCC(CC)OC 2708a_100000731041_100000229938 [0,2,0,0,0,0|2,0,0]=4 3712 B16R0.139 CCCCCCCNC(=O)NCC(CC)OC 273464a_100000229938_100000731041 [0,2,0,0,0,0|2,0,0]=4 3713 B16R0.139 CCCCCCCNC(=O)NCC(CC)OC 273464a_100000731041_100000229938 [0,2,0,0,0,0|2,0,0]=4 3714 B16R0.139 CCCCCCCNC(=O)NCC(CC)OC 512a_100000229938_100000731041 [0,2,0,0,0,0|2,0,0]=4 3715 B16R0.139 CCCCCCCNC(=O)NCC(CC)OC 512a_100000731041_100000229938 [0,2,0,0,0,0|2,0,0]=4 3716 B16R0.888 CCCCCCC(O)C(=O)NCC(CC)OC 240690a_100000731041_100011215828 [0,2,0,0,0,0|2,0,0]=4 3717 B16R0.6034 CCCCC(C)CCC(=O)NCC(CC)OC 11a_100000731041_100000033779 [0,2,0,0,0,0|2,0,0]=4 3718 B16R0.6034 CCCCC(C)CCC(=O)NCC(CC)OC 1626a_100000731041_100000033779 [0,2,0,0,0,0|2,0,0]=4 3719 B16R0.6034 CCCCC(C)CCC(=O)NCC(CC)OC 240690a_100000731041_100000033779 [0,2,0,0,0,0|2,0,0]=4 3720 B16R0.6034 CCCCC(C)CCC(=O)NCC(CC)OC 527a_100000731041_100000033779 [0,2,0,0,0,0|2,0,0]=4 3721 B16R0.6485 CCCCCCC(O)C(=O)NCC(C)(C)CO 240690a_100020635058_100011215828 [0,2,0,0,0,0|2,0,0]=4 3722 B16R0.6485 CCCCCCC(O)C(=O)NCC(F)(F)CO 240690a_100000703232_100011215828 [0,2,0,0,0,0|2,0,0]=4 3723 B16R0.8588 CCCCCCC(C)(C)C(=O)NCC(C)CO 240690a_100000744482_100011290782 [0,2,0,0,0,0|2,0,0]=4 3724 B16R0.8588 CCCCCCC(C)(C)C(=O)NCC(C)CO 527a_100000744482_100011290782 [0,2,0,0,0,0|2,0,0]=4 3725 B16R0.8588 CCCCCCC(C)(C)C(=O)NCC(O)CC 11a_100011218483_100011290782 [0,2,0,0,0,0|2,0,0]=4 3726 B16R0.8588 CCCCCCC(C)(C)C(=O)NCC(O)CC 240690a_100011218483_100011290782 [0,2,0,0,0,0|2,0,0]=4 3727 B16R0.8588 CCCCCCC(C)(C)C(=O)NCC(O)CC 527a_100011218483_100011290782 [0,2,0,0,0,0|2,0,0]=4 3728 B16R0.8588 CCCCCCC(C)(C)C(=O)NC[C@@H](F)CO 240690a_100015665980_100011290782 [0,2,0,0,0,0|2,0,0]=4 3729 B16R0.8588 CCCCCCC(C)(C)C(=O)NC[C@@H](F)CO 527a_100015665980_100011290782 [0,2,0,0,0,0|2,0,0]=4 3730 B16R0.8588 CCCCCCC(C)(C)C(=O)NC[C@H](O)CO 240690a_100020644852_100011290782 [0,2,0,0,0,0|1,0,0]=3 3731 B16R0.8588 CCCCCCC(C)(C)C(=O)NC[C@H](O)CO 527a_100020644852_100011290782 [0,2,0,0,0,0|1,0,0]=3 3732 B16R0.6404 CCCCCCCCC(CC)OCC(O)CO 34a_200011216270_100011219619 [0,2,0,0,0,0|1,0,1]=4 3733 B16R0.6404 CCCCCCCCC(CC)OCC(O)CO 7a_200011216270_100011219619 [0,2,0,0,0,0|1,0,1]=4 3734 B16R0.6404 CCCCCCCCC(CC)OC[C@@H](O)CO 34a_200011216270_100009815848 [0,2,0,0,0,0|1,0,1]=4 3735 B16R0.6404 CCCCCCCCC(CC)OC[C@@H](O)CO 7a_200011216270_100009815848 [0,2,0,0,0,0|1,0,1]=4 3736 B16R0.140 CC(C)(CO)CNC(=O)CCCCCCCO 240690a_100020635058_100011219782 [0,2,0,0,0,0|2,0,0]=4 3737 B16R0.140 CCCCCCCCC(=O)NCC(C)(C)CO 240690a_100020635058_100000210188 [0,2,0,0,0,0|2,0,0]=4 3738 B16R0.140 CCCCCCCCC(=O)NCC(C)(C)CO 527a_100020635058_100000210188 [0,2,0,0,0,0|2,0,0]=4 3739 B16R0.140 CCCCCCCCC(=O)NCC(F)(F)CO 240690a_100000703232_100000210188 [0,2,0,0,0,0|2,0,0]=4 3740 B16R0.140 CCCCCCCCC(=O)NCC(F)(F)CO 527a_100000703232_100000210188 [0,2,0,0,0,0|2,0,0]=4 3741 B16R0.140 CCCCCCCNC(=O)NCC(C)(C)CO 2708a_100000229938_100020635058 [0,2,0,0,0,0|2,0,0]=4 3742 B16R0.140 CCCCCCCNC(=O)NCC(C)(C)CO 273464a_100000229938_100020635058 [0,2,0,0,0,0|2,0,0]=4 3743 B16R0.140 CCCCCCCNC(=O)NCC(C)(C)CO 273464a_100020635058_100000229938 [0,2,0,0,0,0|2,0,0]=4 3744 B16R0.140 CCCCCCCNC(=O)NCC(C)(C)CO 512a_100000229938_100020635058 [0,2,0,0,0,0|2,0,0]=4 3745 B16R0.140 CCCCCCCNC(=O)NCC(C)(C)CO 512a_100020635058_100000229938 [0,2,0,0,0,0|2,0,0]=4 3746 B16R0.140 CCCCCCCNC(=O)NCC(F)(F)CO 2708a_100000229938_100000703232 [0,2,0,0,0,0|2,0,0]=4 3747 B16R0.140 CCCCCCCNC(=O)NCC(F)(F)CO 273464a_100000229938_100000703232 [0,2,0,0,0,0|2,0,0]=4 3748 B16R0.140 CCCCCCCNC(=O)NCC(F)(F)CO 273464a_100000703232_100000229938 [0,2,0,0,0,0|2,0,0]=4 3749 B16R0.140 CCCCCCCNC(=O)NCC(F)(F)CO 512a_100000229938_100000703232 [0,2,0,0,0,0|2,0,0]=4 3750 B16R0.140 CCCCCCCNC(=O)NCC(F)(F)CO 512a_100000703232_100000229938 [0,2,0,0,0,0|2,0,0]=4 3751 B16R0.140 O=C(CCCCCCCO)NCC(F)(F)CO 240690a_100000703232_100011219782 [0,2,0,0,0,0|2,0,0]=4 3752 B16R0.188 CCCCCCC(=O)CC(=O)NCC(O)CO 1458a_100102632555_200012027429 [0,2,0,0,0,0|1,0,0]=3 3753 B16R0.188 CCCCCCC(C)NC(=O)CCC(O)CC 1626a_100000210919_203496584001 [0,2,0,0,0,0|2,0,0]=4 3754 B16R0.188 CCCCCCC(C)NC(=O)CCC(O)CC 240690a_100000210919_203496584001 [0,2,0,0,0,0|2,0,0]=4 3755 B16R0.188 CCCCCCC(C)NC(=O)NCC(C)CO 2708a_100000210919_100000744482 [0,2,0,0,0,0|2,0,0]=4 3756 B16R0.188 CCCCCCC(C)NC(=O)NCC(C)CO 273464a_100000210919_100000744482 [0,2,0,0,0,0|2,0,0]=4 3757 B16R0.188 CCCCCCC(C)NC(=O)NCC(C)CO 273464a_100000744482_100000210919 [0,2,0,0,0,0|2,0,0]=4 3758 B16R0.188 CCCCCCC(C)NC(=O)NCC(C)CO 512a_100000210919_100000744482 [0,2,0,0,0,0|2,0,0]=4 3759 B16R0.188 CCCCCCC(C)NC(=O)NCC(C)CO 512a_100000744482_100000210919 [0,2,0,0,0,0|2,0,0]=4 3760 B16R0.188 CCCCCCC(C)NC(=O)NCC(O)CC 2708a_100000210919_100011218483 [0,2,0,0,0,0|2,0,0]=4 3761 B16R0.188 CCCCCCC(C)NC(=O)NCC(O)CC 273464a_100000210919_100011218483 [0,2,0,0,0,0|2,0,0]=4 3762 B16R0.188 CCCCCCC(C)NC(=O)NCC(O)CC 273464a_100011218483_100000210919 [0,2,0,0,0,0|2,0,0]=4 3763 B16R0.188 CCCCCCC(C)NC(=O)NCC(O)CC 512a_100011218483_100000210919 [0,2,0,0,0,0|2,0,0]=4 3764 B16R0.188 CCCCCCC(C)NC(=O)NC[C@@H](F)CO 2708a_100000210919_100015665980 [0,2,0,0,0,0|2,0,0]=4 3765 B16R0.188 CCCCCCC(C)NC(=O)NC[C@@H](F)CO 273464a_100000210919_100015665980 [0,2,0,0,0,0|2,0,0]=4 3766 B16R0.188 CCCCCCC(C)NC(=O)NC[C@@H](F)CO 273464a_100015665980_100000210919 [0,2,0,0,0,0|2,0,0]=4 3767 B16R0.188 CCCCCCC(C)NC(=O)NC[C@@H](F)CO 512a_100000210919_100015665980 [0,2,0,0,0,0|2,0,0]=4 3768 B16R0.188 CCCCCCC(C)NC(=O)NC[C@@H](F)CO 512a_100015665980_100000210919 [0,2,0,0,0,0|2,0,0]=4 3769 B16R0.188 CCCCCCC(C)NC(=O)NC[C@H](O)CO 2708a_100000210919_100020644852 [0,2,0,0,0,0|1,0,0]=3 3770 B16R0.188 CCCCCCC(C)NC(=O)NC[C@H](O)CO 273464a_100000210919_100020644852 [0,2,0,0,0,0|1,0,0]=3 3771 B16R0.188 CCCCCCC(C)NC(=O)NC[C@H](O)CO 273464a_100020644852_100000210919 [0,2,0,0,0,0|1,0,0]=3 3772 B16R0.188 CCCCCCN(C)CC(=O)NCC(O)CO 2230a_106256046315_200012027429 [0,2,0,0,0,0|1,0,0]=3 3773 B16R0.188 CCCCCCN(C)CC(=O)NCC(O)CO 269982a_106256046315_200012027429 [0,2,0,0,0,0|1,0,0]=3 3774 B16R0.188 CCCCOCC(=O)CC(=O)NCC(O)CO 1458a_100000757543_200012027429 [0,2,0,0,0,0|1,0,1]=4 3775 B16R0.188 CCCCSCC(=O)CC(=O)NCC(O)CO 1458a_100000191162_200012027429 [0,2,0,0,0,0|1,0,1]=4 3776 B16R0.188 CN(CCCCCO)CC(=O)NCC(O)CO 2230a_100000722520_200012027429 [0,2,0,0,0,0|2,0,0]=4 3777 B16R0.188 CN(CCCCCO)CC(=O)NCC(O)CO 269982a_100000722520_200012027429 [0,2,0,0,0,0|2,0,0]=4 3778 B16R0.188 O=C(CCCCCO)CC(=O)NCC(O)CO 1458a_100102619762_200012027429 [0,2,0,0,0,0|1,0,1]=4 3779 B16R0.1709 CCCCCCCCS(=O)(=O)NC[C@H](O)CO 270084a_100020644852_100011218563 [0,2,0,0,0,0|2,0,0]=4 3780 B16R0.3394 CC(=O)CCCCSCC(=O)NCC(O)CO 62a_100000735457_200012027429 [0,2,0,0,0,0|1,0,1]=4 3781 B16R0.3394 CC(=O)CCCCSCC(=O)NCC(O)CO 62a_200012027429_100000735457 [0,2,0,0,0,0|1,0,1]=4 3782 B16R0.3394 CC(=O)NCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000183861 [0,2,0,0,0,0|1,0,1]=4 3783 B16R0.3394 CC(C)/C=C/CCCCC(=O)NC[C@H](O)CO 240690a_100020644852_200016995844 [0,2,0,0,0,0|1,0,1]=4 3784 B16R0.3394 CC(C)/C=C/CCCCC(=O)NC[C@H](O)CO 527a_100020644852_200016995844 [0,2,0,0,0,0|1,0,1]=4 3785 B16R0.3394 CC(C)CCCCCCC(=O)NCC(C)CO 240690a_100000744482_100000040743 [0,2,0,0,0,0|2,0,0]=4 3786 B16R0.3394 CC(C)CCCCCCC(=O)NCC(C)CO 527a_100000744482_100000040743 [0,2,0,0,0,0|2,0,0]=4 3787 B16R0.3394 CC(C)CCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000040743 [0,2,0,0,0,0|2,0,0]=4 3788 B16R0.3394 CC(C)CCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100000040743 [0,2,0,0,0,0|2,0,0]=4 3789 B16R0.3394 CC(C)CCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000040743 [0,2,0,0,0,0|1,0,0]=3 3790 B16R0.3394 CC(C)CCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000040743 [0,2,0,0,0,0|1,0,0]=3 3791 B16R0.3394 CC(C)CCCCCNC(=O)NCC(C)CO 2708a_100011290863_100000744482 [0,2,0,0,0,0|2,0,0]=4 3792 B16R0.3394 CC(C)CCCCCNC(=O)NCC(C)CO 273464a_100000744482_100011290863 [0,2,0,0,0,0|2,0,0]=4 3793 B16R0.3394 CC(C)CCCCCNC(=O)NCC(C)CO 273464a_100011290863_100000744482 [0,2,0,0,0,0|2,0,0]=4 3794 B16R0.3394 CC(C)CCCCCNC(=O)NCC(C)CO 512a_100000744482_100011290863 [0,2,0,0,0,0|2,0,0]=4 3795 B16R0.3394 CC(C)CCCCCNC(=O)NCC(C)CO 512a_100011290863_100000744482 [0,2,0,0,0,0|2,0,0]=4 3796 B16R0.3394 CC(C)CCCCCNC(=O)NC[C@@H](F)CO 2708a_100011290863_100015665980 [0,2,0,0,0,0|2,0,0]=4 3797 B16R0.3394 CC(C)CCCCCNC(=O)NC[C@@H](F)CO 273464a_100011290863_100015665980 [0,2,0,0,0,0|2,0,0]=4 3798 B16R0.3394 CC(C)CCCCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_100011290863 [0,2,0,0,0,0|2,0,0]=4 3799 B16R0.3394 CC(C)CCCCCNC(=O)NC[C@@H](F)CO 512a_100011290863_100015665980 [0,2,0,0,0,0|2,0,0]=4 3800 B16R0.3394 CC(C)CCCCCNC(=O)NC[C@@H](F)CO 512a_100015665980_100011290863 [0,2,0,0,0,0|2,0,0]=4 3801 B16R0.3394 CC(C)CCCCCNC(=O)NC[C@H](O)CO 2708a_100011290863_100020644852 [0,2,0,0,0,0|1,0,0]=3 3802 B16R0.3394 CC(C)CCCCCNC(=O)NC[C@H](O)CO 273464a_100011290863_100020644852 [0,2,0,0,0,0|1,0,0]=3 3803 B16R0.3394 CC(C)CCCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100011290863 [0,2,0,0,0,0|1,0,0]=3 3804 B16R0.3394 CC(C)CCCCOCC(=O)NCC(O)CO 34a_100011214890_200012027429 [0,2,0,0,0,0|1,0,0]=3 3805 B16R0.3394 CC(C)CCCCOCC(=O)NCC(O)CO 7a_100011214890_200012027429 [0,2,0,0,0,0|1,0,0]=3 3806 B16R0.3394 CC(C)CCCCSCC(=O)NCC(O)CO 62a_100011216152_200012027429 [0,2,0,0,0,0|1,0,0]=3 3807 B16R0.3394 CC(C)CCCCSCC(=O)NCC(O)CO 62a_200012027429_100011216152 [0,2,0,0,0,0|1,0,0]=3 3808 B16R0.3394 CC(C)CNCCOCC(=O)NCC(O)CO 34a_100015185251_200012027429 [0,2,0,0,0,0|2,0,0]=4 3809 B16R0.3394 CC(C)COCCCNC(=O)NC[C@H](O)CO 2708a_100000205972_100020644852 [0,2,0,0,0,0|2,0,0]=4 3810 B16R0.3394 CC(C)COCCCNC(=O)NC[C@H](O)CO 273464a_100000205972_100020644852 [0,2,0,0,0,0|2,0,0]=4 3811 B16R0.3394 CC(C)COCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000205972 [0,2,0,0,0,0|2,0,0]=4 3812 B16R0.3394 CC(C)COCCOCC(=O)NCC(O)CO 34a_100000703358_200012027429 [0,2,0,0,0,0|2,0,0]=4 3813 B16R0.3394 CC(C)COCCOCC(=O)NCC(O)CO 7a_100000703358_200012027429 [0,2,0,0,0,0|2,0,0]=4 3814 B16R0.3394 CC(C)CSCCOCC(=O)NCC(O)CO 34a_200000230437_200012027429 [0,2,0,0,0,0|2,0,0]=4 3815 B16R0.3394 CC(C)CSCCOCC(=O)NCC(O)CO 7a_200000230437_200012027429 [0,2,0,0,0,0|2,0,0]=4 3816 B16R0.3394 CC(C)NCCCOCC(=O)NCC(O)CO 34a_100000182298_200012027429 [0,2,0,0,0,0|2,0,0]=4 3817 B16R0.3394 CC(C)OCCCNCC(=O)NCC(O)CO 2230a_100000737246_200012027429 [0,2,0,0,0,0|2,0,0]=4 3818 B16R0.3394 CC(C)OCCCNCC(=O)NCC(O)CO 34a_100000737246_200012027429 [0,2,0,0,0,0|2,0,0]=4 3819 B16R0.3394 CCC(O)CCC(=O)NCCCCCC(C)C 1626a_100011290863_203496584001 [0,2,0,0,0,0|2,0,0]=4 3820 B16R0.3394 CCC(O)CCC(=O)NCCCCCC(C)C 240690a_100011290863_203496584001 [0,2,0,0,0,0|2,0,0]=4 3821 B16R0.3394 CCC(O)CNC(=O)CCCCCCC(C)C 11a_100011218483_100000040743 [0,2,0,0,0,0|2,0,0]=4 3822 B16R0.3394 CCC(O)CNC(=O)CCCCCCC(C)C 240690a_100011218483_100000040743 [0,2,0,0,0,0|2,0,0]=4 3823 B16R0.3394 CCC(O)CNC(=O)CCCCCCC(C)C 527a_100011218483_100000040743 [0,2,0,0,0,0|2,0,0]=4 3824 B16R0.3394 CCC(O)CNC(=O)NCCCCCC(C)C 2708a_100011290863_100011218483 [0,2,0,0,0,0|2,0,0]=4 3825 B16R0.3394 CCC(O)CNC(=O)NCCCCCC(C)C 273464a_100011218483_100011290863 [0,2,0,0,0,0|2,0,0]=4 3826 B16R0.3394 CCC(O)CNC(=O)NCCCCCC(C)C 273464a_100011290863_100011218483 [0,2,0,0,0,0|2,0,0]=4 3827 B16R0.3394 CCC(O)CNC(=O)NCCCCCC(C)C 512a_100011218483_100011290863 [0,2,0,0,0,0|2,0,0]=4 3828 B16R0.3394 CN(C)CCCCCNC(=O)NC[C@H](O)CO 2708a_100020635752_100020644852 [0,2,0,0,0,0|2,0,0]=4 3829 B16R0.3394 CN(C)CCCCCNC(=O)NC[C@H](O)CO 273464a_100020635752_100020644852 [0,2,0,0,0,0|2,0,0]=4 3830 B16R0.3394 CN(C)CCCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100020635752 [0,2,0,0,0,0|2,0,0]=4 3831 B16R0.3394 CN(C)CCCCSCC(=O)NCC(O)CO 62a_200012027429_100000690147 [0,2,0,0,0,0|2,0,0]=4 3832 B16R0.6606 C#CCCCCCCCC(=O)NCC(C)CO 240690a_100000744482_100000087357 [0,2,0,0,0,0|2,0,0]=4 3833 B16R0.6606 C#CCCCCCCCC(=O)NCC(C)CO 527a_100000744482_100000087357 [0,2,0,0,0,0|2,0,0]=4 3834 B16R0.6606 C#CCCCCCCCC(=O)NCC(O)CC 11a_100011218483_100000087357 [0,2,0,0,0,0|2,0,0]=4 3835 B16R0.6606 C#CCCCCCCCC(=O)NCC(O)CC 240690a_100011218483_100000087357 [0,2,0,0,0,0|2,0,0]=4 3836 B16R0.6606 C#CCCCCCCCC(=O)NCC(O)CC 527a_100011218483_100000087357 [0,2,0,0,0,0|2,0,0]=4 3837 B16R0.6606 C#CCCCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000087357 [0,2,0,0,0,0|2,0,0]=4 3838 B16R0.6606 C#CCCCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100000087357 [0,2,0,0,0,0|2,0,0]=4 3839 B16R0.6606 C#CCCCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000087357 [0,2,0,0,0,0|1,0,0]=3 3840 B16R0.6606 C#CCCCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000087357 [0,2,0,0,0,0|1,0,0]=3 3841 B16R0.6606 C#CCCCCCOCC(=O)NCC(O)CO 34a_100000766912_200012027429 [0,2,0,0,0,0|1,0,1]=4 3842 B16R0.6606 C#CCCCCCOCC(=O)NCC(O)CO 7a_100000766912_200012027429 [0,2,0,0,0,0|1,0,1]=4 3843 B16R0.6606 C#CCCCCCSCC(=O)NCC(O)CO 62a_100012094781_200012027429 [0,2,0,0,0,0|1,0,1]=4 3844 B16R0.6606 C#CCCCCCSCC(=O)NCC(O)CO 62a_200012027429_100012094781 [0,2,0,0,0,0|1,0,1]=4 3845 B16R0.6606 C=CCCCCCCCC(=O)NCC(C)CO 240690a_100000744482_100011216160 [0,2,0,0,0,0|2,0,0]=4 3846 B16R0.6606 C=CCCCCCCCC(=O)NCC(C)CO 527a_100000744482_100011216160 [0,2,0,0,0,0|2,0,0]=4 3847 B16R0.6606 C=CCCCCCCCC(=O)NCC(O)CC 11a_100011218483_100011216160 [0,2,0,0,0,0|2,0,0]=4 3848 B16R0.6606 C=CCCCCCCCC(=O)NCC(O)CC 240690a_100011218483_100011216160 [0,2,0,0,0,0|2,0,0]=4 3849 B16R0.6606 C=CCCCCCCCC(=O)NCC(O)CC 527a_100011218483_100011216160 [0,2,0,0,0,0|2,0,0]=4 3850 B16R0.6606 C=CCCCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100011216160 [0,2,0,0,0,0|2,0,0]=4 3851 B16R0.6606 C=CCCCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100011216160 [0,2,0,0,0,0|2,0,0]=4 3852 B16R0.6606 C=CCCCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100011216160 [0,2,0,0,0,0|1,0,0]=3 3853 B16R0.6606 C=CCCCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100011216160 [0,2,0,0,0,0|1,0,0]=3 3854 B16R0.6606 C=CCCCCCOCC(=O)NCC(O)CO 34a_100011216702_200012027429 [0,2,0,0,0,0|1,0,1]=4 3855 B16R0.6606 C=CCCCCCOCC(=O)NCC(O)CO 7a_100011216702_200012027429 [0,2,0,0,0,0|1,0,1]=4 3856 B16R0.6606 C=CCCCCCSCC(=O)NCC(O)CO 62a_100000700193_200012027429 [0,2,0,0,0,0|1,0,1]=4 3857 B16R0.6606 C=CCCCCCSCC(=O)NCC(O)CO 62a_200012027429_100000700193 [0,2,0,0,0,0|1,0,1]=4 3858 B16R0.6606 CC(CO)CNC(=O)CCCCCCCCO 240690a_100000744482_100000015970 [0,2,0,0,0,0|2,0,0]=4 3859 B16R0.6606 CC(CO)CNC(=O)NCCCCCCCO 2708a_100011996573_100000744482 [0,2,0,0,0,0|2,0,0]=4 3860 B16R0.6606 CC(CO)CNC(=O)NCCCCCCCO 273464a_100000744482_100011996573 [0,2,0,0,0,0|2,0,0]=4 3861 B16R0.6606 CC(CO)CNC(=O)NCCCCCCCO 273464a_100011996573_100000744482 [0,2,0,0,0,0|2,0,0]=4 3862 B16R0.6606 CC(CO)CNC(=O)NCCCCCCCO 512a_100000744482_100011996573 [0,2,0,0,0,0|2,0,0]=4 3863 B16R0.6606 CC(CO)CNC(=O)NCCCCCCCO 512a_100011996573_100000744482 [0,2,0,0,0,0|2,0,0]=4 3864 B16R0.6606 CC/C=C/CCCOCC(=O)NCC(O)CO 34a_100016287902_200012027429 [0,2,0,0,0,0|1,0,1]=4 3865 B16R0.6606 CC/C=C/CCCOCC(=O)NCC(O)CO 7a_100016287902_200012027429 [0,2,0,0,0,0|1,0,1]=4 3866 B16R0.6606 CCC(O)CCC(=O)NCCCCCCCO 240690a_100011996573_203496584001 [0,2,0,0,0,0|2,0,0]=4 3867 B16R0.6606 CCC(O)CNC(=O)CCCCCCCCO 240690a_100011218483_100000015970 [0,2,0,0,0,0|2,0,0]=4 3868 B16R0.6606 CCC(O)CNC(=O)NCCCCCCCO 2708a_100011996573_100011218483 [0,2,0,0,0,0|2,0,0]=4 3869 B16R0.6606 CCC(O)CNC(=O)NCCCCCCCO 273464a_100011218483_100011996573 [0,2,0,0,0,0|2,0,0]=4 3870 B16R0.6606 CCC(O)CNC(=O)NCCCCCCCO 273464a_100011996573_100011218483 [0,2,0,0,0,0|2,0,0]=4 3871 B16R0.6606 CCC(O)CNC(=O)NCCCCCCCO 512a_100011218483_100011996573 [0,2,0,0,0,0|2,0,0]=4 3872 B16R0.6606 CCCC#CCCOCC(=O)NCC(O)CO 34a_100000042726_200012027429 [0,2,0,0,0,0|1,0,1]=4 3873 B16R0.6606 CCCC#CCCOCC(=O)NCC(O)CO 7a_100000042726_200012027429 [0,2,0,0,0,0|1,0,1]=4 3874 B16R0.6606 CCCC/C=C/COCC(=O)NCC(O)CO 34a_200016272032_200012027429 [0,2,0,0,0,0|1,0,1]=4 3875 B16R0.6606 CCCC/C=C/COCC(=O)NCC(O)CO 7a_200016272032_200012027429 [0,2,0,0,0,0|1,0,1]=4 3876 B16R0.6606 CCCCC#CCOCC(=O)NCC(O)CO 34a_200000034558_200012027429 [0,2,0,0,0,0|1,0,1]=4 3877 B16R0.6606 CCCCC#CCOCC(=O)NCC(O)CO 7a_200000034558_200012027429 [0,2,0,0,0,0|1,0,1]=4 3878 B16R0.6606 CCCCC/C=C/CCC(=O)NCC(C)CO 240690a_100000744482_200015255902 [0,2,0,0,0,0|2,0,0]=4 3879 B16R0.6606 CCCCC/C=C/CCC(=O)NCC(C)CO 527a_100000744482_200015255902 [0,2,0,0,0,0|2,0,0]=4 3880 B16R0.6606 CCCCC/C=C/CCC(=O)NCC(O)CC 11a_100011218483_200015255902 [0,2,0,0,0,0|2,0,0]=4 3881 B16R0.6606 CCCCC/C=C/CCC(=O)NCC(O)CC 240690a_100011218483_200015255902 [0,2,0,0,0,0|2,0,0]=4 3882 B16R0.6606 CCCCC/C=C/CCC(=O)NCC(O)CC 527a_100011218483_200015255902 [0,2,0,0,0,0|2,0,0]=4 3883 B16R0.6606 CCCCC/C=C/CCC(=O)NC[C@@H](F)CO 240690a_100015665980_200015255902 [0,2,0,0,0,0|2,0,0]=4 3884 B16R0.6606 CCCCC/C=C/CCC(=O)NC[C@@H](F)CO 527a_100015665980_200015255902 [0,2,0,0,0,0|2,0,0]=4 3885 B16R0.6606 CCCCC/C=C/CCC(=O)NC[C@H](O)CO 240690a_100020644852_200015255902 [0,2,0,0,0,0|1,0,0]=3 3886 B16R0.6606 CCCCC/C=C/CCC(=O)NC[C@H](O)CO 527a_100020644852_200015255902 [0,2,0,0,0,0|1,0,0]=3 3887 B16R0.6606 CCCCCC/C=C/CC(=O)NCC(C)CO 240690a_100000744482_100020681715 [0,2,0,0,0,0|2,0,0]=4 3888 B16R0.6606 CCCCCC/C=C/CC(=O)NCC(O)CC 11a_100011218483_100020681715 [0,2,0,0,0,0|2,0,0]=4 3889 B16R0.6606 CCCCCC/C=C/CC(=O)NCC(O)CC 240690a_100011218483_100020681715 [0,2,0,0,0,0|2,0,0]=4 3890 B16R0.6606 CCCCCC/C=C/CC(=O)NC[C@@H](F)CO 240690a_100015665980_100020681715 [0,2,0,0,0,0|2,0,0]=4 3891 B16R0.6606 CCCCCC/C=C/CC(=O)NC[C@H](O)CO 240690a_100020644852_100020681715 [0,2,0,0,0,0|1,0,0]=3 3892 B16R0.6606 CCCCCCCC=CC(=O)NCC(C)CO 240690a_100000744482_200015332781 [0,2,0,0,0,0|2,0,0]=4 3893 B16R0.6606 CCCCCCCC=CC(=O)NCC(O)CC 11a_100011218483_200015332781 [0,2,0,0,0,0|2,0,0]=4 3894 B16R0.6606 CCCCCCCC=CC(=O)NCC(O)CC 240690a_100011218483_200015332781 [0,2,0,0,0,0|2,0,0]=4 3895 B16R0.6606 CCCCCCCC=CC(=O)NC[C@@H](F)CO 240690a_100015665980_200015332781 [0,2,0,0,0,0|2,0,0]=4 3896 B16R0.6606 CCCCCCCC=CC(=O)NC[C@H](O)CO 240690a_100020644852_200015332781 [0,2,0,0,0,0|1,0,0]=3 3897 B16R0.6606 CCCCCCCCCC(=O)NCC(C)CO 240690a_100000744482_100000210558 [0,2,0,0,0,0|2,0,0]=4 3898 B16R0.6606 CCCCCCCCCC(=O)NCC(C)CO 527a_100000744482_100000210558 [0,2,0,0,0,0|2,0,0]=4 3899 B16R0.6606 CCCCCCCCCC(=O)NCC(O)CC 11a_100011218483_100000210558 [0,2,0,0,0,0|2,0,0]=4 3900 B16R0.6606 CCCCCCCCCC(=O)NCC(O)CC 240690a_100011218483_100000210558 [0,2,0,0,0,0|2,0,0]=4 3901 B16R0.6606 CCCCCCCCCC(=O)NCC(O)CC 527a_100011218483_100000210558 [0,2,0,0,0,0|2,0,0]=4 3902 B16R0.6606 CCCCCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000210558 [0,2,0,0,0,0|2,0,0]=4 3903 B16R0.6606 CCCCCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100000210558 [0,2,0,0,0,0|2,0,0]=4 3904 B16R0.6606 CCCCCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000210558 [0,2,0,0,0,0|1,0,0]=3 3905 B16R0.6606 CCCCCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000210558 [0,2,0,0,0,0|1,0,0]=3 3906 B16R0.6606 CCCCCCCCCC(=O)OCC(=O)CO 1458a_100000210174_200010990708 [0,2,0,0,0,0|0,0,2]=4 3907 B16R0.6606 CCCCCCCCCC(C)OCC(O)CO 34a_100011218016_100011219619 [0,2,0,0,0,0|1,0,1]=4 3908 B16R0.6606 CCCCCCCCCC(C)OCC(O)CO 7a_100011218016_100011219619 [0,2,0,0,0,0|1,0,1]=4 3909 B16R0.6606 CCCCCCCCCC(C)OC[C@@H](O)CO 34a_100011218016_100009815848 [0,2,0,0,0,0|1,0,1]=4 3910 B16R0.6606 CCCCCCCCCC(C)OC[C@@H](O)CO 7a_100011218016_100009815848 [0,2,0,0,0,0|1,0,1]=4 3911 B16R0.6606 CCCCCCCCNC(=O)CCC(O)CC 1626a_100000229939_203496584001 [0,2,0,0,0,0|2,0,0]=4 3912 B16R0.6606 CCCCCCCCNC(=O)CCC(O)CC 240690a_100000229939_203496584001 [0,2,0,0,0,0|2,0,0]=4 3913 B16R0.6606 CCCCCCCCNC(=O)NCC(C)CO 2708a_100000229939_100000744482 [0,2,0,0,0,0|2,0,0]=4 3914 B16R0.6606 CCCCCCCCNC(=O)NCC(C)CO 273464a_100000229939_100000744482 [0,2,0,0,0,0|2,0,0]=4 3915 B16R0.6606 CCCCCCCCNC(=O)NCC(C)CO 273464a_100000744482_100000229939 [0,2,0,0,0,0|2,0,0]=4 3916 B16R0.6606 CCCCCCCCNC(=O)NCC(C)CO 512a_100000229939_100000744482 [0,2,0,0,0,0|2,0,0]=4 3917 B16R0.6606 CCCCCCCCNC(=O)NCC(C)CO 512a_100000744482_100000229939 [0,2,0,0,0,0|2,0,0]=4 3918 B16R0.6606 CCCCCCCCNC(=O)NCC(O)CC 2708a_100000229939_100011218483 [0,2,0,0,0,0|2,0,0]=4 3919 B16R0.6606 CCCCCCCCNC(=O)NCC(O)CC 273464a_100000229939_100011218483 [0,2,0,0,0,0|2,0,0]=4 3920 B16R0.6606 CCCCCCCCNC(=O)NCC(O)CC 273464a_100011218483_100000229939 [0,2,0,0,0,0|2,0,0]=4 3921 B16R0.6606 CCCCCCCCNC(=O)NCC(O)CC 512a_100011218483_100000229939 [0,2,0,0,0,0|2,0,0]=4 3922 B16R0.6606 CCCCCCCCNC(=O)NC[C@@H](F)CO 2708a_100000229939_100015665980 [0,2,0,0,0,0|2,0,0]=4 3923 B16R0.6606 CCCCCCCCNC(=O)NC[C@@H](F)CO 273464a_100000229939_100015665980 [0,2,0,0,0,0|2,0,0]=4 3924 B16R0.6606 CCCCCCCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_100000229939 [0,2,0,0,0,0|2,0,0]=4 3925 B16R0.6606 CCCCCCCCNC(=O)NC[C@@H](F)CO 512a_100000229939_100015665980 [0,2,0,0,0,0|2,0,0]=4 3926 B16R0.6606 CCCCCCCCNC(=O)NC[C@@H](F)CO 512a_100015665980_100000229939 [0,2,0,0,0,0|2,0,0]=4 3927 B16R0.6606 CCCCCCCCNC(=O)NC[C@H](O)CO 2708a_100000229939_100020644852 [0,2,0,0,0,0|1,0,0]=3 3928 B16R0.6606 CCCCCCCCNC(=O)NC[C@H](O)CO 273464a_100000229939_100020644852 [0,2,0,0,0,0|1,0,0]=3 3929 B16R0.6606 CCCCCCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000229939 [0,2,0,0,0,0|1,0,0]=3 3930 B16R0.6606 CCCCCCCNCC(=O)NCC(O)CO 2230a_100000229938_200012027429 [0,2,0,0,0,0|1,0,0]=3 3931 B16R0.6606 CCCCCCCOCC(=O)NCC(O)CO 34a_100000210272_200012027429 [0,2,0,0,0,0|1,0,0]=3 3932 B16R0.6606 CCCCCCCOCC(=O)NCC(O)CO 7a_100000210272_200012027429 [0,2,0,0,0,0|1,0,0]=3 3933 B16R0.6606 CCCCCCCSCC(=O)NCC(O)CO 62a_100000210614_200012027429 [0,2,0,0,0,0|1,0,0]=3 3934 B16R0.6606 CCCCCCCSCC(=O)NCC(O)CO 62a_200012027429_100000210316 [0,2,0,0,0,0|1,0,0]=3 3935 B16R0.6606 CCCCOCCCNC(=O)CCC(O)CC 1626a_200000211371_203496584001 [0,2,0,0,0,0|2,0,0]=4 3936 B16R0.6606 CCCCOCCCNC(=O)CCC(O)CC 240690a_200000211371_203496584001 [0,2,0,0,0,0|2,0,0]=4 3937 B16R0.6606 CCCCOCCCNC(=O)NCC(C)CO 2708a_200000211371_100000744482 [0,2,0,0,0,0|2,0,0]=4 3938 B16R0.6606 CCCCOCCCNC(=O)NCC(C)CO 273464a_100000744482_200000211371 [0,2,0,0,0,0|2,0,0]=4 3939 B16R0.6606 CCCCOCCCNC(=O)NCC(C)CO 273464a_200000211371_100000744482 [0,2,0,0,0,0|2,0,0]=4 3940 B16R0.6606 CCCCOCCCNC(=O)NCC(C)CO 512a_100000744482_200000211371 [0,2,0,0,0,0|2,0,0]=4 3941 B16R0.6606 CCCCOCCCNC(=O)NCC(C)CO 512a_200000211371_100000744482 [0,2,0,0,0,0|2,0,0]=4 3942 B16R0.6606 CCCCOCCCNC(=O)NCC(O)CC 2708a_200000211371_100011218483 [0,2,0,0,0,0|2,0,0]=4 3943 B16R0.6606 CCCCOCCCNC(=O)NCC(O)CC 273464a_100011218483_200000211371 [0,2,0,0,0,0|2,0,0]=4 3944 B16R0.6606 CCCCOCCCNC(=O)NCC(O)CC 273464a_200000211371_100011218483 [0,2,0,0,0,0|2,0,0]=4 3945 B16R0.6606 CCCCOCCCNC(=O)NCC(O)CC 512a_100011218483_200000211371 [0,2,0,0,0,0|2,0,0]=4 3946 B16R0.6606 CCCCOCCCNC(=O)NC[C@@H](F)CO 2708a_200000211371_100015665980 [0,2,0,0,0,0|2,0,0]=4 3947 B16R0.6606 CCCCOCCCNC(=O)NC[C@@H](F)CO 273464a_100015665980_200000211371 [0,2,0,0,0,0|2,0,0]=4 3948 B16R0.6606 CCCCOCCCNC(=O)NC[C@@H](F)CO 273464a_200000211371_100015665980 [0,2,0,0,0,0|2,0,0]=4 3949 B16R0.6606 CCCCOCCCNC(=O)NC[C@@H](F)CO 512a_100015665980_200000211371 [0,2,0,0,0,0|2,0,0]=4 3950 B16R0.6606 CCCCOCCCNC(=O)NC[C@@H](F)CO 512a_200000211371_100015665980 [0,2,0,0,0,0|2,0,0]=4 3951 B16R0.6606 CCCCOCCCNC(=O)NC[C@H](O)CO 2708a_200000211371_100020644852 [0,2,0,0,0,0|1,0,0]=3 3952 B16R0.6606 CCCCOCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_200000211371 [0,2,0,0,0,0|1,0,0]=3 3953 B16R0.6606 CCCCOCCCNC(=O)NC[C@H](O)CO 273464a_200000211371_100020644852 [0,2,0,0,0,0|1,0,0]=3 3954 B16R0.6606 CCCCOCCOCC(=O)NCC(C)CO 240690a_100000744482_100011216887 [0,2,0,0,0,0|2,0,0]=4 3955 B16R0.6606 CCCCOCCOCC(=O)NCC(C)CO 527a_100000744482_100011216887 [0,2,0,0,0,0|2,0,0]=4 3956 B16R0.6606 CCCCOCCOCC(=O)NCC(O)CC 11a_100011218483_100011216887 [0,2,0,0,0,0|2,0,0]=4 3957 B16R0.6606 CCCCOCCOCC(=O)NCC(O)CC 240690a_100011218483_100011216887 [0,2,0,0,0,0|2,0,0]=4 3958 B16R0.6606 CCCCOCCOCC(=O)NCC(O)CC 527a_100011218483_100011216887 [0,2,0,0,0,0|2,0,0]=4 3959 B16R0.6606 CCCCOCCOCC(=O)NCC(O)CO 34a_100000210238_200012027429 [0,2,0,0,0,0|1,0,0]=3 3960 B16R0.6606 CCCCOCCOCC(=O)NCC(O)CO 7a_100000210238_200012027429 [0,2,0,0,0,0|1,0,0]=3 3961 B16R0.6606 CCCCOCCOCC(=O)NC[C@@H](F)CO 240690a_100015665980_100011216887 [0,2,0,0,0,0|2,0,0]=4 3962 B16R0.6606 CCCCOCCOCC(=O)NC[C@@H](F)CO 527a_100015665980_100011216887 [0,2,0,0,0,0|2,0,0]=4 3963 B16R0.6606 CCCCOCCOCC(=O)NC[C@H](O)CO 240690a_100020644852_100011216887 [0,2,0,0,0,0|1,0,0]=3 3964 B16R0.6606 CCCCOCCOCC(=O)NC[C@H](O)CO 527a_100020644852_100011216887 [0,2,0,0,0,0|1,0,0]=3 3965 B16R0.6606 CCCCOCCSCC(=O)NCC(O)CO 62a_100000743108_200012027429 [0,2,0,0,0,0|1,0,0]=3 3966 B16R0.6606 CCCCOCCSCC(=O)NCC(O)CO 62a_200012027429_100000743108 [0,2,0,0,0,0|1,0,0]=3 3967 B16R0.6606 CCCCSCCNCC(=O)NCC(O)CO 2230a_100025743550_200012027429 [0,2,0,0,0,0|1,0,0]=3 3968 B16R0.6606 CCCCSCCOCC(=O)NCC(O)CO 34a_200000230436_200012027429 [0,2,0,0,0,0|1,0,0]=3 3969 B16R0.6606 CCCCSCCOCC(=O)NCC(O)CO 7a_200000230436_200012027429 [0,2,0,0,0,0|1,0,0]=3 3970 B16R0.6606 CCCOCCCNCC(=O)NCC(O)CO 2230a_100011217757_200012027429 [0,2,0,0,0,0|1,0,0]=3 3971 B16R0.6606 CCCOCCCNCC(=O)NCC(O)CO 34a_100011217757_200012027429 [0,2,0,0,0,0|1,0,0]=3 3972 B16R0.6606 CCOCCOCCNC(=O)NC[C@H](O)CO 2708a_100102712874_100020644852 [0,2,0,0,0,0|2,0,0]=4 3973 B16R0.6606 CCOCCOCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100102712874 [0,2,0,0,0,0|2,0,0]=4 3974 B16R0.6606 CCOCCOCCNC(=O)NC[C@H](O)CO 273464a_100102712874_100020644852 [0,2,0,0,0,0|2,0,0]=4 3975 B16R0.6606 CNCCCCCOCC(=O)NCC(O)CO 34a_100000722520_200012027429 [0,2,0,0,0,0|1,0,0]=3 3976 B16R0.6606 CNCCOCCOCC(=O)NCC(O)CO 34a_100000228057_200012027429 [0,2,0,0,0,0|2,0,0]=4 3977 B16R0.6606 COCCCCCNCC(=O)NCC(O)CO 2230a_100000747528_200012027429 [0,2,0,0,0,0|1,0,0]=3 3978 B16R0.6606 COCCCCCNCC(=O)NCC(O)CO 34a_100000747528_200012027429 [0,2,0,0,0,0|1,0,0]=3 3979 B16R0.6606 COCCOCCCNC(=O)NC[C@H](O)CO 2708a_100000206027_100020644852 [0,2,0,0,0,0|2,0,0]=4 3980 B16R0.6606 COCCOCCCNC(=O)NC[C@H](O)CO 273464a_100000206027_100020644852 [0,2,0,0,0,0|2,0,0]=4 3981 B16R0.6606 COCCOCCCNC(=O)NC[C@H](O)CO 273464a_100020644852_100000206027 [0,2,0,0,0,0|2,0,0]=4 3982 B16R0.6606 COCCOCCNCC(=O)NCC(O)CO 2230a_100000745349_200012027429 [0,2,0,0,0,0|2,0,0]=4 3983 B16R0.6606 COCCOCCNCC(=O)NCC(O)CO 34a_100000745349_200012027429 [0,2,0,0,0,0|2,0,0]=4 3984 B16R0.6606 COCCOCCOCC(=O)NCC(O)CO 34a_100011215163_200012027429 [0,2,0,0,0,0|2,0,0]=4 3985 B16R0.6606 COCCOCCOCC(=O)NCC(O)CO 7a_100011215163_200012027429 [0,2,0,0,0,0|2,0,0]=4 3986 B16R0.6606 COCCOCCOCC(=O)NC[C@H](O)CO 240690a_100020644852_100011214951 [0,2,0,0,0,0|2,0,0]=4 3987 B16R0.6606 COCCOCCOCC(=O)NC[C@H](O)CO 527a_100020644852_100011214951 [0,2,0,0,0,0|2,0,0]=4 3988 B16R0.6606 COCCOCCSCC(=O)NCC(O)CO 62a_100000695917_200012027429 [0,2,0,0,0,0|2,0,0]=4 3989 B16R0.6606 COCCOCCSCC(=O)NCC(O)CO 62a_200012027429_100000695917 [0,2,0,0,0,0|2,0,0]=4 3990 B16R0.6606 N#CCCCCCSCC(=O)NCC(O)CO 62a_100009813376_200012027429 [0,2,0,0,0,0|1,0,1]=4 3991 B16R0.6606 N#CCCCCCSCC(=O)NCC(O)CO 62a_200012027429_100009813376 [0,2,0,0,0,0|1,0,1]=4 3992 B16R0.6606 NCCCCCCOCC(=O)NCC(O)CO 34a_100000686447_200012027429 [0,2,0,0,0,0|1,0,0]=3 3993 B16R0.6606 O=C(CCCCCCCCO)NC[C@@H](F)CO 240690a_100015665980_100000015970 [0,2,0,0,0,0|2,0,0]=4 3994 B16R0.6606 O=C(CCCCCCCCO)NC[C@H](O)CO 240690a_100020644852_100000015970 [0,2,0,0,0,0|1,0,0]=3 3995 B16R0.6606 O=C(CCOCCOCCO)NC[C@H](O)CO 240690a_100020644852_100009915118 [0,2,0,0,0,0|2,0,0]=4 3996 B16R0.6606 O=C(COCCCCCCBr)NCC(O)CO 34a_100011215345_200012027429 [0,2,0,0,0,0|1,0,0]=3 3997 B16R0.6606 O=C(COCCCCCCBr)NCC(O)CO 7a_100011215345_200012027429 [0,2,0,0,0,0|1,0,0]=3 3998 B16R0.6606 O=C(COCCCCCCCl)NCC(O)CO 34a_100000766143_200012027429 [0,2,0,0,0,0|1,0,0]=3 3999 B16R0.6606 O=C(COCCCCCCCl)NCC(O)CO 7a_100000766143_200012027429 [0,2,0,0,0,0|1,0,0]=3 4000 B16R0.6606 O=C(COCCCCCCF)NCC(O)CO 34a_100000732779_200012027429 [0,2,0,0,0,0|1,0,0]=3 4001 B16R0.6606 O=C(COCCCCCCF)NCC(O)CO 7a_100000732779_200012027429 [0,2,0,0,0,0|1,0,0]=3 4002 B16R0.6606 O=C(CSCCCCCCF)NCC(O)CO 62a_100015922095_200012027429 [0,2,0,0,0,0|1,0,0]=3 4003 B16R0.6606 O=C(CSCCCCCCF)NCC(O)CO 62a_200012027429_100015922095 [0,2,0,0,0,0|1,0,0]=3 4004 B16R0.6606 O=C(CSCCCCCCO)NCC(O)CO 62a_100000766143_200012027429 [0,2,0,0,0,0|1,0,0]=3 4005 B16R0.6606 O=C(CSCCCCCCO)NCC(O)CO 62a_200012027429_100000766143 [0,2,0,0,0,0|1,0,0]=3 4006 B16R0.6606 O=C(NCCCCCCCO)NC[C@@H](F)CO 2708a_100011996573_100015665980 [0,2,0,0,0,0|2,0,0]=4 4007 B16R0.6606 O=C(NCCCCCCCO)NC[C@@H](F)CO 273464a_100011996573_100015665980 [0,2,0,0,0,0|2,0,0]=4 4008 B16R0.6606 O=C(NCCCCCCCO)NC[C@@H](F)CO 273464a_100015665980_100011996573 [0,2,0,0,0,0|2,0,0]=4 4009 B16R0.6606 O=C(NCCCCCCCO)NC[C@@H](F)CO 512a_100011996573_100015665980 [0,2,0,0,0,0|2,0,0]=4 4010 B16R0.6606 O=C(NCCCCCCCO)NC[C@@H](F)CO 512a_100015665980_100011996573 [0,2,0,0,0,0|2,0,0]=4 4011 B16R0.6606 O=CCCCCCSCC(=O)NCC(O)CO 62a_100000139337_200012027429 [0,2,0,0,0,0|1,0,1]=4 4012 B16R0.6606 O=CCCCCCSCC(=O)NCC(O)CO 62a_200012027429_100000139337 [0,2,0,0,0,0|1,0,1]=4 4013 B16R0.6855 CCCCC(C)COCC(=O)NCC(O)CO 34a_100011995851_200012027429 [0,2,0,0,0,0|1,0,0]=3 4014 B16R0.6855 CCCCC(C)COCC(=O)NCC(O)CO 7a_100011995851_200012027429 [0,2,0,0,0,0|1,0,0]=3 4015 B16R0.6855 CCCCN(C)CCNC(=O)NC[C@H](O)CO 2708a_200000754967_100020644852 [0,2,0,0,0,0|2,0,0]=4 4016 B16R0.6855 CCCCN(C)CCNC(=O)NC[C@H](O)CO 273464a_100020644852_200000754967 [0,2,0,0,0,0|2,0,0]=4 4017 B16R0.6855 CCCCN(C)CCNC(=O)NC[C@H](O)CO 273464a_200000754967_100020644852 [0,2,0,0,0,0|2,0,0]=4 4018 B16R0.6855 CCCC[C@H](N)COCC(=O)NCC(O)CO 34a_100011934283_200012027429 [0,2,0,0,0,0|1,0,0]=3 4019 B16R0.6855 CCCNC(=O)CCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000199544 [0,2,0,0,0,0|1,0,1]=4 4020 B16R0.6855 CCCNC(=O)CCCC(=O)NC[C@H](O)CO 527a_100020644852_100000199544 [0,2,0,0,0,0|1,0,1]=4 4021 B16R0.6855 CCCOC(C)CNCC(=O)NCC(O)CO 2230a_100015185124_200012027429 [0,2,0,0,0,0|2,0,0]=4 4022 B16R0.6855 CCCOC(C)CNCC(=O)NCC(O)CO 34a_100015185124_200012027429 [0,2,0,0,0,0|2,0,0]=4 4023 B16R0.6855 CSCC[C@H](N)COCC(=O)NCC(O)CO 34a_100011827619_200012027429 [0,2,0,0,0,0|2,0,0]=4 4024 B16R0.7062 CCCCCC(C)CCC(=O)NCC(C)CO 240690a_100000744482_100000034243 [0,2,0,0,0,0|2,0,0]=4 4025 B16R0.7062 CCCCCC(C)CCC(=O)NCC(C)CO 527a_100000744482_100000034243 [0,2,0,0,0,0|2,0,0]=4 4026 B16R0.7062 CCCCCC(C)CCC(=O)NCC(O)CC 11a_100011218483_100000034243 [0,2,0,0,0,0|2,0,0]=4 4027 B16R0.7062 CCCCCC(C)CCC(=O)NCC(O)CC 240690a_100011218483_100000034243 [0,2,0,0,0,0|2,0,0]=4 4028 B16R0.7062 CCCCCC(C)CCC(=O)NCC(O)CC 527a_100011218483_100000034243 [0,2,0,0,0,0|2,0,0]=4 4029 B16R0.7062 CCCCCC(C)CCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000034243 [0,2,0,0,0,0|2,0,0]=4 4030 B16R0.7062 CCCCCC(C)CCC(=O)NC[C@@H](F)CO 527a_100015665980_100000034243 [0,2,0,0,0,0|2,0,0]=4 4031 B16R0.7062 CCCCCC(C)CCC(=O)NC[C@H](O)CO 240690a_100020644852_100000034243 [0,2,0,0,0,0|1,0,0]=3 4032 B16R0.7062 CCCCCC(C)CCC(=O)NC[C@H](O)CO 527a_100020644852_100000034243 [0,2,0,0,0,0|1,0,0]=3 4033 B16R0.7062 CCCCCC(C)NCC(=O)NCC(O)CO 2230a_100000211957_200012027429 [0,2,0,0,0,0|1,0,0]=3 4034 B16R0.7062 CCCCCC(C)OCC(=O)NCC(O)CO 34a_100011215632_200012027429 [0,2,0,0,0,0|1,0,0]=3 4035 B16R0.7062 CCCCCC(C)OCC(=O)NCC(O)CO 7a_100011215632_200012027429 [0,2,0,0,0,0|1,0,0]=3 4036 B16R0.7062 CCCCCC(C)SCC(=O)NCC(O)CO 62a_200011218191_200012027429 [0,2,0,0,0,0|1,0,0]=3 4037 B16R0.7062 CCCCCC(C)SCC(=O)NCC(O)CO 62a_200012027429_200011218191 [0,2,0,0,0,0|1,0,0]=3 4038 B16R0.7062 CCCCCN(C)CCC(=O)NCC(C)CO 240690a_100000744482_100016987678 [0,2,0,0,0,0|2,0,0]=4 4039 B16R0.7062 CCCCCN(C)CCC(=O)NCC(O)CC 240690a_100011218483_100016987678 [0,2,0,0,0,0|2,0,0]=4 4040 B16R0.7062 CCCCCN(C)CCC(=O)NC[C@@H](F)CO 240690a_100015665980_100016987678 [0,2,0,0,0,0|2,0,0]=4 4041 B16R0.7062 CCCCCN(C)CCC(=O)NC[C@H](O)CO 240690a_100020644852_100016987678 [0,2,0,0,0,0|1,0,0]=3 4042 B16R0.7062 COCCCC(C)OCC(=O)NCC(O)CO 34a_200011539412_200012027429 [0,2,0,0,0,0|2,0,0]=4 4043 B16R0.7062 COCCCC(C)OCC(=O)NCC(O)CO 7a_200011539412_200012027429 [0,2,0,0,0,0|2,0,0]=4 4044 B16R0.78 CCCC(C)CC(=O)CC(=O)NCC(O)CO 1458a_100000748435_200012027429 [0,2,0,0,0,0|1,0,1]=4 4045 B16R0.7707 CCCC(C)(C)COCC(=O)NCC(O)CO 7a_100011995695_200012027429 [0,2,0,0,0,0|2,0,0]=4 4046 B16R0.8378 CCCC(C)C(C)OCC(=O)NCC(O)CO 34a_100000708338_200012027429 [0,2,0,0,0,0|2,0,0]=4 4047 B16R0.8378 CCCC(C)C(C)OCC(=O)NCC(O)CO 7a_100000708338_200012027429 [0,2,0,0,0,0|2,0,0]=4 4048 B16R0.6144 CCCCC(C)CCC(=O)NCC(C)(C)CO 240690a_100020635058_100000033779 [0,2,0,0,0,0|2,0,0]=4 4049 B16R0.6144 CCCCC(C)CCC(=O)NCC(C)(C)CO 527a_100020635058_100000033779 [0,2,0,0,0,0|2,0,0]=4 4050 B16R0.6144 CCCCC(C)CCC(=O)NCC(F)(F)CO 240690a_100000703232_100000033779 [0,2,0,0,0,0|2,0,0]=4 4051 B16R0.6144 CCCCC(C)CCC(=O)NCC(F)(F)CO 527a_100000703232_100000033779 [0,2,0,0,0,0|2,0,0]=4 4052 B16R0.4064 CCCCC(C)C(=O)CC(=O)NCC(O)CO 1458a_100000725509_200012027429 [0,2,0,0,0,0|1,0,1]=4 4053 B16R0.4064 CCCCC(O)C(=O)CC(=O)NCC(O)CO 1458a_100000720857_200012027429 [0,2,0,0,0,0|1,0,1]=4 4054 B16R0.8962 C#CC(CCCC)OCC(=O)NCC(O)CO 34a_200011217967_200012027429 [0,2,0,0,0,0|2,0,0]=4 4055 B16R0.8962 C#CC(CCCC)OCC(=O)NCC(O)CO 7a_200011217967_200012027429 [0,2,0,0,0,0|2,0,0]=4 4056 B16R0.8962 C=CC(CCCC)OCC(=O)NCC(O)CO 34a_200011215037_200012027429 [0,2,0,0,0,0|2,0,0]=4 4057 B16R0.8962 C=CC(CCCC)OCC(=O)NCC(O)CO 7a_200011215037_200012027429 [0,2,0,0,0,0|2,0,0]=4 4058 B16R0.8962 CCCCC(CC)CCC(=O)NCC(C)CO 240690a_100000744482_100011216959 [0,2,0,0,0,0|2,0,0]=4 4059 B16R0.8962 CCCCC(CC)CCC(=O)NCC(C)CO 527a_100000744482_100011216959 [0,2,0,0,0,0|2,0,0]=4 4060 B16R0.8962 CCCCC(CC)CCC(=O)NCC(O)CC 11a_100011218483_100011216959 [0,2,0,0,0,0|2,0,0]=4 4061 B16R0.8962 CCCCC(CC)CCC(=O)NCC(O)CC 240690a_100011218483_100011216959 [0,2,0,0,0,0|2,0,0]=4 4062 B16R0.8962 CCCCC(CC)CCC(=O)NCC(O)CC 527a_100011218483_100011216959 [0,2,0,0,0,0|2,0,0]=4 4063 B16R0.8962 CCCCC(CC)CCC(=O)NC[C@@H](F)CO 240690a_100015665980_100011216959 [0,2,0,0,0,0|2,0,0]=4 4064 B16R0.8962 CCCCC(CC)CCC(=O)NC[C@@H](F)CO 527a_100015665980_100011216959 [0,2,0,0,0,0|2,0,0]=4 4065 B16R0.8962 CCCCC(CC)CCC(=O)NC[C@H](O)CO 240690a_100020644852_100011216959 [0,2,0,0,0,0|1,0,0]=3 4066 B16R0.8962 CCCCC(CC)CCC(=O)NC[C@H](O)CO 527a_100020644852_100011216959 [0,2,0,0,0,0|1,0,0]=3 4067 B16R0.8962 CCCCC(CC)CNC(=O)NC[C@H](O)CO 2708a_100000209976_100020644852 [0,2,0,0,0,0|2,0,0]=4 4068 B16R0.8962 CCCCC(CC)CNC(=O)NC[C@H](O)CO 273464a_100000209976_100020644852 [0,2,0,0,0,0|2,0,0]=4 4069 B16R0.8962 CCCCC(CC)CNC(=O)NC[C@H](O)CO 273464a_100020644852_100000209976 [0,2,0,0,0,0|2,0,0]=4 4070 B16R0.8962 CCCCC(CC)OCC(=O)NCC(O)CO 34a_100011215227_200012027429 [0,2,0,0,0,0|2,0,0]=4 4071 B16R0.8962 CCCCC(CC)OCC(=O)NCC(O)CO 7a_100011215227_200012027429 [0,2,0,0,0,0|2,0,0]=4 4072 B16R0.8962 CCCCC(CC)SCC(=O)NCC(O)CO 62a_200011216223_200012027429 [0,2,0,0,0,0|2,0,0]=4 4073 B16R0.8962 CCCCC(CC)SCC(=O)NCC(O)CO 62a_200012027429_200011216223 [0,2,0,0,0,0|2,0,0]=4 4074 B16R0.11921 CCCCC(C)(C)OCC(=O)NCC(O)CO 7a_100011219641_200012027429 [0,2,0,0,0,0|2,0,0]=4 4075 B14R1.109 CCN1CCC[C@@H]1COCC(O)CO 34a_100011739246_100011219619 [1,0,0,1,0,0|1,0,1]=4 4076 B14R1.109 CCN1CCC[C@@H]1COCC(O)CO 7a_100011739246_100011219619 [1,0,0,1,0,0|1,0,1]=4 4077 B14R1.109 CCN1CCC[C@@H]1COC[C@@H](O)CO 34a_100011739246_100009815848 [1,0,0,1,0,0|1,0,1]=4 4078 B14R1.109 CCN1CCC[C@@H]1COC[C@@H](O)CO 7a_100011739246_100009815848 [1,0,0,1,0,0|1,0,1]=4 4079 B14R1.272 CCCC1CCCC1NC[C@H](O)CO 269862a_100020644852_100000723119 [1,0,0,1,0,0|1,0,1]=4 4080 B14R1.483 CCCC1CCCCN1CC(O)CO 2230a_100000701414_100011219619 [1,0,0,1,0,0|1,0,1]=4 4081 B14R1.483 CCCC1CCCCN1CC(O)CO 34a_100000701414_100011219619 [1,0,0,1,0,0|1,0,1]=4 4082 B14R1.483 CCCC1CCCCN1C[C@@H](O)CO 2230a_100000701414_100009815848 [1,0,0,1,0,0|1,0,1]=4 4083 B14R1.483 CCCC1CCCCN1C[C@@H](O)CO 34a_100000701414_100009815848 [1,0,0,1,0,0|1,0,1]=4 4084 B14R1.716 CCC(O)COCCC1CCCCC1 34a_100011217863_100011218378 [1,0,0,1,0,0|1,0,1]=4 4085 B14R1.716 CCC(O)COCCC1CCCCC1 7a_100011217863_100011218378 [1,0,0,1,0,0|1,0,1]=4 4086 B14R1.716 C[C@@H](CO)COCCC1CCCCC1 34a_100011217863_100000059175 [1,0,0,1,0,0|1,0,1]=4 4087 B14R1.716 C[C@@H](CO)COCCC1CCCCC1 7a_100011217863_100000059175 [1,0,0,1,0,0|1,0,1]=4 4088 B14R1.716 OCC(O)CNCCC1CCCCC1 2230a_100000738074_100011219619 [1,0,0,1,0,0|1,0,1]=4 4089 B14R1.716 OCC(O)CNCCC1CCCCC1 34a_100000738074_100011219619 [1,0,0,1,0,0|1,0,1]=4 4090 B14R1.716 OCC(O)COCCC1CCCCC1 34a_100011217863_100011219619 [1,0,0,1,0,0|0,0,1]=3 4091 B14R1.716 OCC(O)COCCC1CCCCC1 7a_100011217863_100011219619 [1,0,0,1,0,0|0,0,1]=3 4092 B14R1.716 OCC(O)COCCC1CCCCN1 34a_100000211664_100011219619 [1,0,0,1,0,0|1,0,1]=4 4093 B14R1.716 OCC(O)COCCC1CCCNC1 34a_100000752241_100011219619 [1,0,0,1,0,0|1,0,1]=4 4094 B14R1.716 OCC(O)COCCC1CCNCC1 34a_100015190746_100011219619 [1,0,0,1,0,0|1,0,1]=4 4095 B14R1.716 OCC(O)COCCC1CCOCC1 34a_100011933979_100011219619 [1,0,0,1,0,0|1,0,1]=4 4096 B14R1.716 OCC(O)COCCC1CCOCC1 7a_100011933979_100011219619 [1,0,0,1,0,0|1,0,1]=4 4097 B14R1.716 OCC(O)CSCCC1CCCCC1 62a_100011219619_100012355289 [1,0,0,1,0,0|0,1,1]=4 4098 B14R1.716 OCC(O)CSCCC1CCCCC1 62a_100012355289_100011219619 [1,0,0,1,0,0|0,1,1]=4 4099 B14R1.716 OC[C@@H](O)CNCCC1CCCCC1 2230a_100020644852_100012355289 [1,0,0,1,0,0|1,0,1]=4 4100 B14R1.716 OC[C@H](O)CNCCC1CCCCC1 2230a_100000738074_100009815848 [1,0,0,1,0,0|1,0,1]=4 4101 B14R1.716 OC[C@H](O)CNCCC1CCCCC1 34a_100000738074_100009815848 [1,0,0,1,0,0|1,0,1]=4 4102 B14R1.716 OC[C@H](O)COCCC1CCCCC1 34a_100011217863_100009815848 [1,0,0,1,0,0|0,0,1]=3 4103 B14R1.716 OC[C@H](O)COCCC1CCCCC1 7a_100011217863_100009815848 [1,0,0,1,0,0|0,0,1]=3 4104 B14R1.716 OC[C@H](O)COCCC1CCCCN1 34a_100000211664_100009815848 [1,0,0,1,0,0|1,0,1]=4 4105 B14R1.716 OC[C@H](O)COCCC1CCCNC1 34a_100000752241_100009815848 [1,0,0,1,0,0|1,0,1]=4 4106 B14R1.716 OC[C@H](O)COCCC1CCNCC1 34a_100015190746_100009815848 [1,0,0,1,0,0|1,0,1]=4 4107 B14R1.716 OC[C@H](O)COCCC1CCOCC1 34a_100011933979_100009815848 [1,0,0,1,0,0|1,0,1]=4 4108 B14R1.716 OC[C@H](O)COCCC1CCOCC1 7a_100011933979_100009815848 [1,0,0,1,0,0|1,0,1]=4 4109 B14R1.716 OC[C@H](O)CSCCC1CCCCC1 62a_100009815848_100012355289 [1,0,0,1,0,0|0,1,1]=4 4110 B14R1.716 OC[C@H](O)CSCCC1CCCCC1 62a_100012355289_100009815848 [1,0,0,1,0,0|0,1,1]=4 4111 B14R1.716 O[C@@H](CF)COCCC1CCCCC1 34a_100011217863_100015614560 [1,0,0,1,0,0|1,0,1]=4 4112 B14R1.716 O[C@@H](CF)COCCC1CCCCC1 7a_100011217863_100015614560 [1,0,0,1,0,0|1,0,1]=4 4113 B14R1.730 CCC(O)COCCCC1CCCC1 34a_100011215328_100011218378 [1,0,0,1,0,0|1,0,1]=4 4114 B14R1.730 CCC(O)COCCCC1CCCC1 7a_100011215328_100011218378 [1,0,0,1,0,0|1,0,1]=4 4115 B14R1.730 C[C@@H](CO)COCCCC1CCCC1 34a_100011215328_100000059175 [1,0,0,1,0,0|1,0,1]=4 4116 B14R1.730 C[C@@H](CO)COCCCC1CCCC1 7a_100011215328_100000059175 [1,0,0,1,0,0|1,0,1]=4 4117 B14R1.730 OCC(O)CNCCCC1CCCC1 2230a_100000736752_100011219619 [1,0,0,1,0,0|1,0,1]=4 4118 B14R1.730 OCC(O)CNCCCC1CCCC1 34a_100000736752_100011219619 [1,0,0,1,0,0|1,0,1]=4 4119 B14R1.730 OCC(O)COCCCC1CCCC1 34a_100011215328_100011219619 [1,0,0,1,0,0|0,0,1]=3 4120 B14R1.730 OCC(O)COCCCC1CCCC1 7a_100011215328_100011219619 [1,0,0,1,0,0|0,0,1]=3 4121 B14R1.730 OCC(O)COCCNC1CCCC1 34a_200000200444_100011219619 [1,0,0,1,0,0|1,0,1]=4 4122 B14R1.730 OCC(O)COCCOC1CCCC1 34a_100000738311_100011219619 [1,0,0,1,0,0|1,0,1]=4 4123 B14R1.730 OCC(O)COCCOC1CCCC1 7a_100000738311_100011219619 [1,0,0,1,0,0|1,0,1]=4 4124 B14R1.730 OCC(O)CSCCCC1CCCC1 62a_100011219619_100011713738 [1,0,0,1,0,0|0,1,1]=4 4125 B14R1.730 OCC(O)CSCCCC1CCCC1 62a_100011713738_100011219619 [1,0,0,1,0,0|0,1,1]=4 4126 B14R1.730 OC[C@@H](O)CNCCCC1CCCC1 2230a_100020644852_100011713738 [1,0,0,1,0,0|1,0,1]=4 4127 B14R1.730 OC[C@H](O)CNCCCC1CCCC1 2230a_100000736752_100009815848 [1,0,0,1,0,0|1,0,1]=4 4128 B14R1.730 OC[C@H](O)CNCCCC1CCCC1 34a_100000736752_100009815848 [1,0,0,1,0,0|1,0,1]=4 4129 B14R1.730 OC[C@H](O)COCCCC1CCCC1 34a_100011215328_100009815848 [1,0,0,1,0,0|0,0,1]=3 4130 B14R1.730 OC[C@H](O)COCCCC1CCCC1 7a_100011215328_100009815848 [1,0,0,1,0,0|0,0,1]=3 4131 B14R1.730 OC[C@H](O)COCCNC1CCCC1 34a_200000200444_100009815848 [1,0,0,1,0,0|1,0,1]=4 4132 B14R1.730 OC[C@H](O)COCCOC1CCCC1 34a_100000738311_100009815848 [1,0,0,1,0,0|1,0,1]=4 4133 B14R1.730 OC[C@H](O)COCCOC1CCCC1 7a_100000738311_100009815848 [1,0,0,1,0,0|1,0,1]=4 4134 B14R1.730 OC[C@H](O)CSCCCC1CCCC1 62a_100009815848_100011713738 [1,0,0,1,0,0|0,1,1]=4 4135 B14R1.730 OC[C@H](O)CSCCCC1CCCC1 62a_100011713738_100009815848 [1,0,0,1,0,0|0,1,1]=4 4136 B14R1.730 O[C@@H](CF)COCCCC1CCCC1 34a_100011215328_100015614560 [1,0,0,1,0,0|1,0,1]=4 4137 B14R1.730 O[C@@H](CF)COCCCC1CCCC1 7a_100011215328_100015614560 [1,0,0,1,0,0|1,0,1]=4 4138 B14R1.819 CN1CCCC1CCOCC(O)CO 34a_100011215177_100011219619 [1,0,0,1,0,0|1,0,1]=4 4139 B14R1.819 CN1CCCC1CCOCC(O)CO 7a_100011215177_100011219619 [1,0,0,1,0,0|1,0,1]=4 4140 B14R1.819 CN1CCCC1CCOC[C@@H](O)CO 34a_100011215177_100009815848 [1,0,0,1,0,0|1,0,1]=4 4141 B14R1.819 CN1CCCC1CCOC[C@@H](O)CO 7a_100011215177_100009815848 [1,0,0,1,0,0|1,0,1]=4 4142 B14R1.837 CN1CCCCC1COCC(O)CO 34a_100000225079_100011219619 [1,0,0,1,0,0|1,0,1]=4 4143 B14R1.837 CN1CCCCC1COC[C@@H](O)CO 34a_100000225079_100009815848 [1,0,0,1,0,0|1,0,1]=4 4144 B14R1.863 CCC(O)COC1CCCCC1CC 34a_100000210738_100011218378 [1,0,0,1,0,0|1,0,1]=4 4145 B14R1.863 CCC(O)COC1CCCCC1CC 7a_100000210738_100011218378 [1,0,0,1,0,0|1,0,1]=4 4146 B14R1.863 CCC1CCCCC1NC[C@H](O)CO 269862a_100020644852_100000757040 [1,0,0,1,0,0|1,0,1]=4 4147 B14R1.863 CCC1CCCCC1OCC(O)CO 34a_100000210738_100011219619 [1,0,0,1,0,0|0,0,1]=3 4148 B14R1.863 CCC1CCCCC1OCC(O)CO 7a_100000210738_100011219619 [1,0,0,1,0,0|0,0,1]=3 4149 B14R1.863 CCC1CCCCC1OC[C@@H](C)CO 34a_100000210738_100000059175 [1,0,0,1,0,0|1,0,1]=4 4150 B14R1.863 CCC1CCCCC1OC[C@@H](C)CO 7a_100000210738_100000059175 [1,0,0,1,0,0|1,0,1]=4 4151 B14R1.863 CCC1CCCCC1OC[C@@H](O)CF 34a_100000210738_100015614560 [1,0,0,1,0,0|1,0,1]=4 4152 B14R1.863 CCC1CCCCC1OC[C@@H](O)CF 7a_100000210738_100015614560 [1,0,0,1,0,0|1,0,1]=4 4153 B14R1.863 CCC1CCCCC1OC[C@@H](O)CO 34a_100000210738_100009815848 [1,0,0,1,0,0|0,0,1]=3 4154 B14R1.863 CCC1CCCCC1OC[C@@H](O)CO 7a_100000210738_100009815848 [1,0,0,1,0,0|0,0,1]=3 4155 B14R1.863 CN[C@@H]1CCCC[C@H]1OCC(O)CO 34a_100000708425_100011219619 [1,0,0,1,0,0|1,0,1]=4 4156 B14R1.863 CN[C@@H]1CCCC[C@H]1OC[C@@H](O)CO 34a_100000708425_100009815848 [1,0,0,1,0,0|1,0,1]=4 4157 B14R1.863 CO[C@H]1CCCC[C@@H]1OCC(O)CO 34a_200009815850_100011219619 [1,0,0,1,0,0|1,0,1]=4 4158 B14R1.863 CO[C@H]1CCCC[C@@H]1OCC(O)CO 7a_200009815850_100011219619 [1,0,0,1,0,0|1,0,1]=4 4159 B14R1.863 CO[C@H]1CCCC[C@@H]1OC[C@@H](O)CO 34a_200009815850_100009815848 [1,0,0,1,0,0|1,0,1]=4 4160 B14R1.863 CO[C@H]1CCCC[C@@H]1OC[C@@H](O)CO 7a_200009815850_100009815848 [1,0,0,1,0,0|1,0,1]=4 4161 B14R1.863 NCC1CCCCC1OCC(O)CO 34a_100011216029_100011219619 [1,0,0,1,0,0|1,0,1]=4 4162 B14R1.863 NCC1CCCCC1OC[C@@H](O)CO 34a_100011216029_100009815848 [1,0,0,1,0,0|1,0,1]=4 4163 B14R1.891 CCCCCCCCOCC1CCO1 34a_100000039022_100000210759 [1,0,0,1,0,0|1,0,1]=4 4164 B14R1.891 CCCCCCCCOCC1CCO1 34a_100000210232_100000103362 [1,0,0,1,0,0|1,0,1]=4 4165 B14R1.891 CCCCCCCCOCC1CCO1 7a_100000210232_100000103362 [1,0,0,1,0,0|1,0,1]=4 4166 B14R1.891 CCCCCCCCOCC1COC1 34a_100000060846_100000210759 [1,0,0,1,0,0|1,0,1]=4 4167 B14R1.891 CCCCCCCCOCC1COC1 34a_100000210232_100010264016 [1,0,0,1,0,0|1,0,1]=4 4168 B14R1.891 CCCCCCCCOCC1COC1 7a_100000210232_100010264016 [1,0,0,1,0,0|1,0,1]=4 4169 B14R1.1224 OCC(O)CN1CCCCCCCC1 2230a_100000039187_100011219619 [1,0,0,1,0,0|1,0,1]=4 4170 B14R1.1224 OCC(O)CN1CCCCCCCC1 34a_100000039187_100011219619 [1,0,0,1,0,0|1,0,1]=4 4171 B14R1.1224 OC[C@H](O)CN1CCCCCCCC1 2230a_100000039187_100009815848 [1,0,0,1,0,0|1,0,1]=4 4172 B14R1.1224 OC[C@H](O)CN1CCCCCCCC1 34a_100000039187_100009815848 [1,0,0,1,0,0|1,0,1]=4 4173 B14R1.1586 CCC(O)COCC1CCCCCC1 34a_100000699130_100011218378 [1,0,0,1,0,0|1,0,1]=4 4174 B14R1.1586 CCC(O)COCC1CCCCCC1 7a_100000699130_100011218378 [1,0,0,1,0,0|1,0,1]=4 4175 B14R1.1586 C[C@@H](CO)COCC1CCCCCC1 34a_100000699130_100000059175 [1,0,0,1,0,0|1,0,1]=4 4176 B14R1.1586 C[C@@H](CO)COCC1CCCCCC1 7a_100000699130_100000059175 [1,0,0,1,0,0|1,0,1]=4 4177 B14R1.1586 OCC(O)CNCC1CCCCCC1 2230a_100015204231_100011219619 [1,0,0,1,0,0|1,0,1]=4 4178 B14R1.1586 OCC(O)CNCC1CCCCCC1 34a_100015204231_100011219619 [1,0,0,1,0,0|1,0,1]=4 4179 B14R1.1586 OCC(O)COCC1CCCCCC1 34a_100000699130_100011219619 [1,0,0,1,0,0|0,0,1]=3 4180 B14R1.1586 OCC(O)COCC1CCCCCC1 7a_100000699130_100011219619 [1,0,0,1,0,0|0,0,1]=3 4181 B14R1.1586 OCC(O)CSCC1CCCCCC1 62a_100011219619_200000696569 [1,0,0,1,0,0|0,1,1]=4 4182 B14R1.1586 OCC(O)CSCC1CCCCCC1 62a_200000696569_100011219619 [1,0,0,1,0,0|0,1,1]=4 4183 B14R1.1586 OC[C@@H](O)CNCC1CCCCCC1 2230a_100020644852_200000696569 [1,0,0,1,0,0|1,0,1]=4 4184 B14R1.1586 OC[C@@H](O)CNCC1CCCCCC1 269862a_100020644852_200000763224 [1,0,0,1,0,0|1,0,1]=4 4185 B14R1.1586 OC[C@H](O)CNCC1CCCCCC1 2230a_100015204231_100009815848 [1,0,0,1,0,0|1,0,1]=4 4186 B14R1.1586 OC[C@H](O)CNCC1CCCCCC1 34a_100015204231_100009815848 [1,0,0,1,0,0|1,0,1]=4 4187 B14R1.1586 OC[C@H](O)COCC1CCCCCC1 34a_100000699130_100009815848 [1,0,0,1,0,0|0,0,1]=3 4188 B14R1.1586 OC[C@H](O)COCC1CCCCCC1 7a_100000699130_100009815848 [1,0,0,1,0,0|0,0,1]=3 4189 B14R1.1586 OC[C@H](O)CSCC1CCCCCC1 62a_100009815848_200000696569 [1,0,0,1,0,0|0,1,1]=4 4190 B14R1.1586 OC[C@H](O)CSCC1CCCCCC1 62a_200000696569_100009815848 [1,0,0,1,0,0|0,1,1]=4 4191 B14R1.1586 O[C@@H](CF)COCC1CCCCCC1 34a_100000699130_100015614560 [1,0,0,1,0,0|1,0,1]=4 4192 B14R1.1586 O[C@@H](CF)COCC1CCCCCC1 7a_100000699130_100015614560 [1,0,0,1,0,0|1,0,1]=4 4193 B14R1.6522 CCCCCCCCOCC1(CO1)C 34a_100000210232_100000760498 [1,0,0,1,0,0|1,0,1]=4 4194 B14R1.7684 CCC(O)COC1CCCCCCC1 34a_100000210054_100011218378 [1,0,0,1,0,0|1,0,1]=4 4195 B14R1.7684 CCC(O)COC1CCCCCCC1 7a_100000210054_100011218378 [1,0,0,1,0,0|1,0,1]=4 4196 B14R1.7684 C[C@@H](CO)COC1CCCCCCC1 34a_100000210054_100000059175 [1,0,0,1,0,0|1,0,1]=4 4197 B14R1.7684 C[C@@H](CO)COC1CCCCCCC1 7a_100000210054_100000059175 [1,0,0,1,0,0|1,0,1]=4 4198 B14R1.7684 OCC(O)CNC1CCCCCCC1 2230a_100000211152_100011219619 [1,0,0,1,0,0|1,0,1]=4 4199 B14R1.7684 OCC(O)CNC1CCCCCCC1 34a_100000211152_100011219619 [1,0,0,1,0,0|1,0,1]=4 4200 B14R1.7684 OCC(O)COC1CCCCCCC1 34a_100000210054_100011219619 [1,0,0,1,0,0|0,0,1]=3 4201 B14R1.7684 OCC(O)COC1CCCCCCC1 7a_100000210054_100011219619 [1,0,0,1,0,0|0,0,1]=3 4202 B14R1.7684 OC[C@H](O)CNC1CCCCCCC1 2230a_100000211152_100009815848 [1,0,0,1,0,0|1,0,1]=4 4203 B14R1.7684 OC[C@H](O)CNC1CCCCCCC1 34a_100000211152_100009815848 [1,0,0,1,0,0|1,0,1]=4 4204 B14R1.7684 OC[C@H](O)COC1CCCCCCC1 34a_100000210054_100009815848 [1,0,0,1,0,0|0,0,1]=3 4205 B14R1.7684 OC[C@H](O)COC1CCCCCCC1 7a_100000210054_100009815848 [1,0,0,1,0,0|0,0,1]=3 4206 B14R1.7684 O[C@@H](CF)COC1CCCCCCC1 34a_100000210054_100015614560 [1,0,0,1,0,0|1,0,1]=4 4207 B14R1.7684 O[C@@H](CF)COC1CCCCCCC1 7a_100000210054_100015614560 [1,0,0,1,0,0|1,0,1]=4 4208 B14R1.110 CCC1CCCN1C(=O)CCC(C)O 1626a_100000754278_100000718519 [1,0,0,1,0,0|2,0,0]=4 4209 B14R1.110 CCC1CCCN1C(=O)NCC(C)O 273464a_100000210904_100000754278 [1,0,0,1,0,0|2,0,0]=4 4210 B14R1.110 CCN1CCCC1C(=O)CCC(C)O 1458a_106256033941_100012276601 [1,0,0,1,0,0|2,0,0]=4 4211 B14R1.110 CCN1CCCC1C(=O)NCC(C)O 240690a_100000210904_106256033941 [1,0,0,1,0,0|2,0,0]=4 4212 B14R1.110 CCN1CCCC1C(=O)NCC(C)O 527a_100000210904_106256033941 [1,0,0,1,0,0|2,0,0]=4 4213 B14R1.160 CC(C)CCC(=O)C1CCCCC1C 1458a_100011215568_100000210312 [1,0,0,1,0,0|2,0,0]=4 4214 B14R1.160 CC(C)CNC(=O)C1CCCCC1C 11a_100000210953_100011215568 [1,0,0,1,0,0|2,0,0]=4 4215 B14R1.160 CC(C)CNC(=O)C1CCCCC1C 1626a_100000210953_100011215568 [1,0,0,1,0,0|2,0,0]=4 4216 B14R1.160 CC(C)CNC(=O)C1CCCCC1C 240690a_100000210953_100011215568 [1,0,0,1,0,0|2,0,0]=4 4217 B14R1.160 CC(C)CNC(=O)C1CCCCC1C 527a_100000210953_100011215568 [1,0,0,1,0,0|2,0,0]=4 4218 B14R1.160 CC(O)CCC(=O)C1CCCCC1C 1458a_100011215568_100012276601 [1,0,0,1,0,0|1,0,0]=3 4219 B14R1.160 CC(O)CCC(=O)C1CCCCC1O 1458a_100011803323_100012276601 [1,0,0,1,0,0|2,0,0]=4 4220 B14R1.160 CC(O)CCC(=O)N1CCCCC1C 1626a_100000211376_100000718519 [1,0,0,1,0,0|2,0,0]=4 4221 B14R1.160 CC(O)CCC(=O)[C@H]1CCCCN1C 1458a_100000767060_100012276601 [1,0,0,1,0,0|2,0,0]=4 4222 B14R1.160 CC(O)CNC(=O)C1CCCCC1C 11a_100000210904_100011215568 [1,0,0,1,0,0|1,0,0]=3 4223 B14R1.160 CC(O)CNC(=O)C1CCCCC1C 240690a_100000210904_100011215568 [1,0,0,1,0,0|1,0,0]=3 4224 B14R1.160 CC(O)CNC(=O)C1CCCCC1C 527a_100000210904_100011215568 [1,0,0,1,0,0|1,0,0]=3 4225 B14R1.160 CC(O)CNC(=O)N1CCCCC1C 273464a_100000210904_100000211376 [1,0,0,1,0,0|2,0,0]=4 4226 B14R1.160 CC(O)CNC(=O)[C@H]1CCCCN1C 11a_100000210904_100000767060 [1,0,0,1,0,0|2,0,0]=4 4227 B14R1.160 CC(O)CNC(=O)[C@H]1CCCCN1C 240690a_100000210904_100000767060 [1,0,0,1,0,0|2,0,0]=4 4228 B14R1.160 CC(O)CNC(=O)[C@H]1CCCCN1C 527a_100000210904_100000767060 [1,0,0,1,0,0|2,0,0]=4 4229 B14R1.423 CC(C)CCC(=O)CC1CCCCC1 1458a_100000181311_100000211423 [1,0,0,1,0,0|2,0,0]=4 4230 B14R1.423 CC(C)CCC(=O)CC1CCCCC1 1458a_100000211666_100000210312 [1,0,0,1,0,0|2,0,0]=4 4231 B14R1.423 CC(C)CNC(=O)CC1CCCCC1 11a_100000210953_100000211666 [1,0,0,1,0,0|2,0,0]=4 4232 B14R1.423 CC(C)CNC(=O)CC1CCCCC1 1626a_100000210953_100000211666 [1,0,0,1,0,0|2,0,0]=4 4233 B14R1.423 CC(C)CNC(=O)CC1CCCCC1 240690a_100000210953_100000211666 [1,0,0,1,0,0|2,0,0]=4 4234 B14R1.423 CC(C)CNC(=O)CC1CCCCC1 527a_100000210953_100000211666 [1,0,0,1,0,0|2,0,0]=4 4235 B14R1.423 CC(O)CCC(=O)CC1CCCCC1 1458a_100000211666_100012276601 [1,0,0,1,0,0|1,0,0]=3 4236 B14R1.423 CC(O)CCC(=O)CC1CCCCO1 1458a_100000238585_100012276601 [1,0,0,1,0,0|2,0,0]=4 4237 B14R1.423 CC(O)CCC(=O)CC1CCCOC1 1458a_100000741523_100012276601 [1,0,0,1,0,0|2,0,0]=4 4238 B14R1.423 CC(O)CCC(=O)CC1CCOCC1 1458a_100000757261_100012276601 [1,0,0,1,0,0|2,0,0]=4 4239 B14R1.423 CC(O)CCC(=O)CN1CCCCC1 1458a_100000740322_100012276601 [1,0,0,1,0,0|2,0,0]=4 4240 B14R1.423 CC(O)CCC(=O)NC1CCCCC1 1626a_100000182618_100000718519 [1,0,0,1,0,0|2,0,0]=4 4241 B14R1.423 CC(O)CNC(=O)CC1CCCCC1 11a_100000210904_100000211666 [1,0,0,1,0,0|1,0,0]=3 4242 B14R1.423 CC(O)CNC(=O)CC1CCCCC1 240690a_100000210904_100000211666 [1,0,0,1,0,0|1,0,0]=3 4243 B14R1.423 CC(O)CNC(=O)CC1CCCCC1 527a_100000210904_100000211666 [1,0,0,1,0,0|1,0,0]=3 4244 B14R1.423 CC(O)CNC(=O)CC1CCCCO1 11a_100000210904_100000238585 [1,0,0,1,0,0|2,0,0]=4 4245 B14R1.423 CC(O)CNC(=O)CC1CCCCO1 240690a_100000210904_100000238585 [1,0,0,1,0,0|2,0,0]=4 4246 B14R1.423 CC(O)CNC(=O)CC1CCCCO1 527a_100000210904_100000238585 [1,0,0,1,0,0|2,0,0]=4 4247 B14R1.423 CC(O)CNC(=O)CC1CCCOC1 11a_100000210904_100000741523 [1,0,0,1,0,0|2,0,0]=4 4248 B14R1.423 CC(O)CNC(=O)CC1CCCOC1 240690a_100000210904_100000741523 [1,0,0,1,0,0|2,0,0]=4 4249 B14R1.423 CC(O)CNC(=O)CC1CCCOC1 527a_100000210904_100000741523 [1,0,0,1,0,0|2,0,0]=4 4250 B14R1.423 CC(O)CNC(=O)CC1CCOCC1 11a_100000210904_100000757261 [1,0,0,1,0,0|2,0,0]=4 4251 B14R1.423 CC(O)CNC(=O)CC1CCOCC1 240690a_100000210904_100000757261 [1,0,0,1,0,0|2,0,0]=4 4252 B14R1.423 CC(O)CNC(=O)CC1CCOCC1 527a_100000210904_100000757261 [1,0,0,1,0,0|2,0,0]=4 4253 B14R1.423 CC(O)CNC(=O)CN1CCCCC1 11a_100000210904_100000740322 [1,0,0,1,0,0|2,0,0]=4 4254 B14R1.423 CC(O)CNC(=O)CN1CCCCC1 240690a_100000210904_100000740322 [1,0,0,1,0,0|2,0,0]=4 4255 B14R1.423 CC(O)CNC(=O)CN1CCCCC1 527a_100000210904_100000740322 [1,0,0,1,0,0|2,0,0]=4 4256 B14R1.423 CC(O)CNC(=O)NC1CCCCC1 2708a_100000182618_100000210904 [1,0,0,1,0,0|2,0,0]=4 4257 B14R1.423 CC(O)CNC(=O)NC1CCCCC1 273464a_100000182618_100000210904 [1,0,0,1,0,0|2,0,0]=4 4258 B14R1.423 CC(O)CNC(=O)NC1CCCCC1 273464a_100000210904_100000182618 [1,0,0,1,0,0|2,0,0]=4 4259 B14R1.4516 CCCCCCCC(=O)N[C@@H]1C[C@@H]1F 240690a_100015190264_100000211969 [1,0,0,1,0,0|2,0,0]=4 4260 B14R1.4516 CCCCCCCC(=O)N[C@@H]1C[C@@H]1F 527a_100015190264_100000211969 [1,0,0,1,0,0|2,0,0]=4 4261 B14R1.4516 CCCCCCCC(=O)N[C@@H]1C[C@H]1F 11a_100025746932_100000211969 [1,0,0,1,0,0|2,0,0]=4 4262 B14R1.4516 CCCCCCCC(=O)N[C@@H]1C[C@H]1F 1626a_100025746932_100000211969 [1,0,0,1,0,0|2,0,0]=4 4263 B14R1.4516 CCCCCCCC(=O)N[C@@H]1C[C@H]1F 240690a_100025746932_100000211969 [1,0,0,1,0,0|2,0,0]=4 4264 B14R1.4516 CCCCCCCC(=O)N[C@@H]1C[C@H]1F 527a_100025746932_100000211969 [1,0,0,1,0,0|2,0,0]=4 4265 B14R1.4518 CCCCCCCC(=O)CCC1CC1 1458a_100000211969_100000694398 [1,0,0,1,0,0|2,0,0]=4 4266 B14R1.4518 CCCCCCCC(=O)CCC1CC1 1458a_100000756386_100000210614 [1,0,0,1,0,0|2,0,0]=4 4267 B14R1.4518 CCCCCCCC(=O)CCC1CO1 1458a_100000211969_100000732470 [1,0,0,1,0,0|1,0,0]=3 4268 B14R1.4518 CCCCCCCC(=O)NCC1CC1 11a_100000735609_100000211969 [1,0,0,1,0,0|2,0,0]=4 4269 B14R1.4518 CCCCCCCC(=O)NCC1CC1 1626a_100000735609_100000211969 [1,0,0,1,0,0|2,0,0]=4 4270 B14R1.4518 CCCCCCCC(=O)NCC1CC1 240690a_100000735609_100000211969 [1,0,0,1,0,0|2,0,0]=4 4271 B14R1.4518 CCCCCCCC(=O)NCC1CC1 527a_100000735609_100000211969 [1,0,0,1,0,0|2,0,0]=4 4272 B14R1.4518 CCCCCCCC(C)OCC1CO1 34a_200011215852_102125554688 [1,0,0,1,0,0|1,0,1]=4 4273 B14R1.4518 CCCCCCCC(C)OCC1CO1 7a_200011215852_102125554688 [1,0,0,1,0,0|1,0,1]=4 4274 B14R1.4518 CCCCCCCC(C)OC[C@@H]1CO1 34a_100000757423_200011218727 [1,0,0,1,0,0|1,0,1]=4 4275 B14R1.4518 CCCCCCCC(C)OC[C@@H]1CO1 7a_200011215852_100000745022 [1,0,0,1,0,0|1,0,1]=4 4276 B14R1.4518 COCCCCCC(=O)CCC1CO1 1458a_100011935119_100000732470 [1,0,0,1,0,0|2,0,0]=4 4277 B14R1.4518 O=C(CCCCCCO)CCC1CO1 1458a_100011996774_100000732470 [1,0,0,1,0,0|2,0,0]=4 4278 B14R1.4520 CCCCCCCC(=O)C1CC(C1)C 1458a_100000686124_100000210614 [1,0,0,1,0,0|2,0,0]=4 4279 B14R1.4520 CCCCCCCC(=O)C1CC(C1)F 1458a_100000062598_100000210614 [1,0,0,1,0,0|2,0,0]=4 4280 B14R1.4520 CCCCCCCC(=O)N1CC(C1)C 11a_100000702820_100000211969 [1,0,0,1,0,0|2,0,0]=4 4281 B14R1.4520 CCCCCCCC(=O)N1CC(C1)C 240690a_100000702820_100000211969 [1,0,0,1,0,0|2,0,0]=4 4282 B14R1.4520 CCCCCCCC(=O)N1CC(C1)C 527a_100000702820_100000211969 [1,0,0,1,0,0|2,0,0]=4 4283 B14R1.4520 CCCCCCCC(=O)N1CC(C1)F 11a_100000690557_100000211969 [1,0,0,1,0,0|2,0,0]=4 4284 B14R1.4520 CCCCCCCC(=O)N1CC(C1)F 240690a_100000690557_100000211969 [1,0,0,1,0,0|2,0,0]=4 4285 B14R1.4520 CCCCCCCC(=O)N1CC(C1)F 527a_100000690557_100000211969 [1,0,0,1,0,0|2,0,0]=4 4286 B14R1.4520 CCCCCCCC(=O)N1CC(C1)O 11a_100000749847_100000211969 [1,0,0,1,0,0|1,0,0]=3 4287 B14R1.4520 CCCCCCCC(=O)N1CC(C1)O 240690a_100000749847_100000211969 [1,0,0,1,0,0|1,0,0]=3 4288 B14R1.4520 CCCCCCCC(=O)N1CC(C1)O 527a_100000749847_100000211969 [1,0,0,1,0,0|1,0,0]=3 4289 B14R1.4520 CCCCCCCC(=O)[C@H]1C[C@H](C1)O 1458a_100015266633_100000210614 [1,0,0,1,0,0|1,0,0]=3 4290 B14R1.4520 CCCCCCNC(=O)N1CC(C1)O 2708a_100000210581_100000749847 [1,0,0,1,0,0|2,0,0]=4 4291 B14R1.4520 CCCCCCNC(=O)N1CC(C1)O 273464a_100000210581_100000749847 [1,0,0,1,0,0|2,0,0]=4 4292 B14R1.4520 CCCCCCNC(=O)[C@H]1C[C@H](C1)O 240690a_100000210581_100015266633 [1,0,0,1,0,0|2,0,0]=4 4293 B14R1.4520 CCCCCCNC(=O)[C@H]1C[C@H](C1)O 527a_100000210581_100015266633 [1,0,0,1,0,0|2,0,0]=4 4294 B14R1.4520 CCCCCNCC(=O)N1CC(C1)O 2230a_100000209983_100013143841 [1,0,0,1,0,0|2,0,0]=4 4295 B14R1.4520 CCCCCOCC(=O)N1CC(C1)O 34a_100000210253_100013143841 [1,0,0,1,0,0|2,0,0]=4 4296 B14R1.4520 CCCCCOCC(=O)N1CC(C1)O 7a_100000210253_100013143841 [1,0,0,1,0,0|2,0,0]=4 4297 B14R1.4520 CCCCCSCC(=O)N1CC(C1)O 62a_100013143841_100000210326 [1,0,0,1,0,0|2,0,0]=4 4298 B14R1.4520 CCCCOCCC(=O)[C@H]1C[C@H](C1)O 1458a_100015266633_100000743108 [1,0,0,1,0,0|2,0,0]=4 4299 B14R1.4520 COCCCCCC(=O)N1CC(C1)O 11a_100000749847_100011935119 [1,0,0,1,0,0|2,0,0]=4 4300 B14R1.4520 COCCCCCC(=O)N1CC(C1)O 240690a_100000749847_100011935119 [1,0,0,1,0,0|2,0,0]=4 4301 B14R1.4520 COCCCCCC(=O)N1CC(C1)O 527a_100000749847_100011935119 [1,0,0,1,0,0|2,0,0]=4 4302 B14R1.4520 O=C(CCCCCCF)[C@H]1C[C@H](C1)O 1458a_100015266633_100015922095 [1,0,0,1,0,0|2,0,0]=4 4303 B14R1.4520 O=C(CCCCCCO)N1CC(C1)O 240690a_100000749847_100011996774 [1,0,0,1,0,0|2,0,0]=4 4304 B14R1.4520 O=C(CCCCCCO)[C@H]1C[C@H](C1)O 1458a_100015266633_100000766143 [1,0,0,1,0,0|2,0,0]=4 4305 B14R1.4526 CC(C)CCC(=O)CCC1CCCC1 1458a_100000181311_100000760354 [1,0,0,1,0,0|2,0,0]=4 4306 B14R1.4526 CC(C)CCC(=O)CCC1CCCC1 1458a_100000211120_100000210312 [1,0,0,1,0,0|2,0,0]=4 4307 B14R1.4526 CC(C)CNC(=O)CCC1CCCC1 11a_100000210953_100000211120 [1,0,0,1,0,0|2,0,0]=4 4308 B14R1.4526 CC(C)CNC(=O)CCC1CCCC1 1626a_100000210953_100000211120 [1,0,0,1,0,0|2,0,0]=4 4309 B14R1.4526 CC(C)CNC(=O)CCC1CCCC1 240690a_100000210953_100000211120 [1,0,0,1,0,0|2,0,0]=4 4310 B14R1.4526 CC(C)CNC(=O)CCC1CCCC1 527a_100000210953_100000211120 [1,0,0,1,0,0|2,0,0]=4 4311 B14R1.4526 CC(O)CCC(=O)CCC1CCCC1 1458a_100000211120_100012276601 [1,0,0,1,0,0|1,0,0]=3 4312 B14R1.4526 CC(O)CCC(=O)CCC1CCCO1 1458a_100011247709_100012276601 [1,0,0,1,0,0|2,0,0]=4 4313 B14R1.4526 CC(O)CCC(=O)CCN1CCCC1 1458a_100000738983_100012276601 [1,0,0,1,0,0|2,0,0]=4 4314 B14R1.4526 CC(O)CCC(=O)COC1CCCC1 1458a_100000741352_100012276601 [1,0,0,1,0,0|2,0,0]=4 4315 B14R1.4526 CC(O)CCC(=O)NCC1CCCC1 1626a_100000737975_100000718519 [1,0,0,1,0,0|2,0,0]=4 4316 B14R1.4526 CC(O)CNC(=O)CCC1CCCC1 11a_100000210904_100000211120 [1,0,0,1,0,0|1,0,0]=3 4317 B14R1.4526 CC(O)CNC(=O)CCC1CCCC1 240690a_100000210904_100000211120 [1,0,0,1,0,0|1,0,0]=3 4318 B14R1.4526 CC(O)CNC(=O)CCC1CCCC1 527a_100000210904_100000211120 [1,0,0,1,0,0|1,0,0]=3 4319 B14R1.4526 CC(O)CNC(=O)CCC1CCCO1 11a_100000210904_100011247709 [1,0,0,1,0,0|2,0,0]=4 4320 B14R1.4526 CC(O)CNC(=O)CCC1CCCO1 240690a_100000210904_100011247709 [1,0,0,1,0,0|2,0,0]=4 4321 B14R1.4526 CC(O)CNC(=O)CCC1CCCO1 527a_100000210904_100011247709 [1,0,0,1,0,0|2,0,0]=4 4322 B14R1.4526 CC(O)CNC(=O)CCN1CCCC1 240690a_100000210904_100000738983 [1,0,0,1,0,0|2,0,0]=4 4323 B14R1.4526 CC(O)CNC(=O)COC1CCCC1 11a_100000210904_100000741352 [1,0,0,1,0,0|2,0,0]=4 4324 B14R1.4526 CC(O)CNC(=O)COC1CCCC1 240690a_100000210904_100000741352 [1,0,0,1,0,0|2,0,0]=4 4325 B14R1.4526 CC(O)CNC(=O)COC1CCCC1 527a_100000210904_100000741352 [1,0,0,1,0,0|2,0,0]=4 4326 B14R1.4526 CC(O)CNC(=O)NCC1CCCC1 2708a_100000737975_100000210904 [1,0,0,1,0,0|2,0,0]=4 4327 B14R1.4526 CC(O)CNC(=O)NCC1CCCC1 273464a_100000210904_100000737975 [1,0,0,1,0,0|2,0,0]=4 4328 B14R1.4526 CC(O)CNC(=O)NCC1CCCC1 273464a_100000737975_100000210904 [1,0,0,1,0,0|2,0,0]=4 4329 B14R1.4526 CC(O)CNC(=O)NCC1CCCC1 512a_100000210904_100000737975 [1,0,0,1,0,0|2,0,0]=4 4330 B14R1.4526 CC(O)CNC(=O)NCC1CCCC1 512a_100000737975_100000210904 [1,0,0,1,0,0|2,0,0]=4 4331 B14R1.6508 CCCCCO[C@H]1C(=O)OCC1(C)C 34a_100009815050_100000718602 [1,0,0,1,0,0|2,0,0]=4 4332 B14R1.6508 CCCCCO[C@H]1C(=O)OCC1(C)C 7a_100009815050_100000210326 [1,0,0,1,0,0|2,0,0]=4 4333 B14R1.10371 CC(C)CCC(=O)C1CCCCCC1 1458a_100000181311_100011217769 [1,0,0,1,0,0|2,0,0]=4 4334 B14R1.10371 CC(C)CCC(=O)C1CCCCCC1 1458a_100000749507_100000210312 [1,0,0,1,0,0|2,0,0]=4 4335 B14R1.10371 CC(C)CNC(=O)C1CCCCCC1 11a_100000210953_100000749507 [1,0,0,1,0,0|2,0,0]=4 4336 B14R1.10371 CC(C)CNC(=O)C1CCCCCC1 1626a_100000210953_100000749507 [1,0,0,1,0,0|2,0,0]=4 4337 B14R1.10371 CC(C)CNC(=O)C1CCCCCC1 240690a_100000210953_100000749507 [1,0,0,1,0,0|2,0,0]=4 4338 B14R1.10371 CC(C)CNC(=O)C1CCCCCC1 527a_100000210953_100000749507 [1,0,0,1,0,0|2,0,0]=4 4339 B14R1.10371 CC(O)CCC(=O)C1CCCCCC1 1458a_100000749507_100012276601 [1,0,0,1,0,0|1,0,0]=3 4340 B14R1.10371 CC(O)CCC(=O)N1CCCCCC1 1626a_100000185865_100000718519 [1,0,0,1,0,0|2,0,0]=4 4341 B14R1.10371 CC(O)CNC(=O)C1CCCCCC1 11a_100000210904_100000749507 [1,0,0,1,0,0|1,0,0]=3 4342 B14R1.10371 CC(O)CNC(=O)C1CCCCCC1 240690a_100000210904_100000749507 [1,0,0,1,0,0|1,0,0]=3 4343 B14R1.10371 CC(O)CNC(=O)C1CCCCCC1 527a_100000210904_100000749507 [1,0,0,1,0,0|1,0,0]=3 4344 B14R1.10371 CC(O)CNC(=O)N1CCCCCC1 273464a_100000210904_100000185865 [1,0,0,1,0,0|2,0,0]=4 4345 B14R1.13674 CCCCCCCC(=O)[C@H]1CC1(C)C 1458a_100000692687_100000210614 [1,0,0,1,0,0|2,0,0]=4 4346 B14R1.86 CCCCCC(=O)CCC1CCCC1 1458a_100000211120_100000210326 [1,0,0,1,0,0|2,0,0]=4 4347 B14R1.86 CCCCCC(=O)CCC1CCCC1 1458a_100000212188_100000760354 [1,0,0,1,0,0|2,0,0]=4 4348 B14R1.86 CCCCNC(=O)CCC1CCCC1 11a_100000102301_100000211120 [1,0,0,1,0,0|2,0,0]=4 4349 B14R1.86 CCCCNC(=O)CCC1CCCC1 1626a_100000102301_100000211120 [1,0,0,1,0,0|2,0,0]=4 4350 B14R1.86 CCCCNC(=O)CCC1CCCC1 240690a_100000102301_100000211120 [1,0,0,1,0,0|2,0,0]=4 4351 B14R1.86 CCCCNC(=O)CCC1CCCC1 527a_100000102301_100000211120 [1,0,0,1,0,0|2,0,0]=4 4352 B14R1.86 CCCCOC(=O)CNC1CCCC1 2230a_100000211070_100000211628 [1,0,0,1,0,0|2,0,0]=4 4353 B14R1.86 CCCCOC(=O)CNC1CCCC1 34a_100000211070_100000211628 [1,0,0,1,0,0|2,0,0]=4 4354 B14R1.86 CCCCOC(=O)COC1CCCC1 34a_100000210269_100000211628 [1,0,0,1,0,0|2,0,0]=4 4355 B14R1.86 CCCCOC(=O)COC1CCCC1 7a_100000210269_100000211628 [1,0,0,1,0,0|2,0,0]=4 4356 B14R1.86 CCCCOC(=O)CSC1CCCC1 62a_100000211628_100000179811 [1,0,0,1,0,0|2,0,0]=4 4357 B14R1.86 CCCCOC(=O)CSC1CCCC1 62a_100011217020_100000211628 [1,0,0,1,0,0|2,0,0]=4 4358 B14R1.86 O=C(CCC1CCCC1)COCCO 1458a_100000708028_100000760354 [1,0,0,1,0,0|2,0,0]=4 4359 B14R1.86 O=C(CCC1CCCC1)NCCCF 11a_100015189416_100000211120 [1,0,0,1,0,0|2,0,0]=4 4360 B14R1.86 O=C(CCC1CCCC1)NCCCF 1626a_100015189416_100000211120 [1,0,0,1,0,0|2,0,0]=4 4361 B14R1.86 O=C(CCC1CCCC1)NCCCF 240690a_100015189416_100000211120 [1,0,0,1,0,0|2,0,0]=4 4362 B14R1.86 O=C(CCC1CCCC1)NCCCF 527a_100015189416_100000211120 [1,0,0,1,0,0|2,0,0]=4 4363 B14R1.86 O=C(CCC1CCCC1)NCCCO 240690a_100000182051_100000211120 [1,0,0,1,0,0|1,0,0]=3 4364 B14R1.86 O=C(CCC1CCCC1)NCCCO 527a_100000182051_100000211120 [1,0,0,1,0,0|1,0,0]=3 4365 B14R1.86 O=C(CCC1CCCC1)NNCCO 22a_100000210001_100000211120 [1,0,0,1,0,0|2,0,0]=4 4366 B14R1.86 O=C(CCC1CCCO1)NCCCO 240690a_100000182051_100011247709 [1,0,0,1,0,0|2,0,0]=4 4367 B14R1.86 O=C(CCC1CCCO1)NCCCO 527a_100000182051_100011247709 [1,0,0,1,0,0|2,0,0]=4 4368 B14R1.86 O=C(CCCCF)CCC1CCCC1 1458a_100000211120_100000729493 [1,0,0,1,0,0|2,0,0]=4 4369 B14R1.86 O=C(CCCCO)CCC1CCCC1 1458a_100000211120_100000210776 [1,0,0,1,0,0|1,0,0]=3 4370 B14R1.86 O=C(CCCCO)CCC1CCCC1 1458a_100000695505_100000760354 [1,0,0,1,0,0|1,0,0]=3 4371 B14R1.86 O=C(CCCCO)CCC1CCCO1 1458a_100011247709_100000210776 [1,0,0,1,0,0|2,0,0]=4 4372 B14R1.86 O=C(CCCCO)CCN1CCCC1 1458a_100000695505_100000004467 [1,0,0,1,0,0|2,0,0]=4 4373 B14R1.86 O=C(CCCCO)CCN1CCCC1 1458a_100000738983_100000210776 [1,0,0,1,0,0|2,0,0]=4 4374 B14R1.86 O=C(CCCCO)COC1CCCC1 1458a_100000741352_100000210776 [1,0,0,1,0,0|2,0,0]=4 4375 B14R1.86 O=C(CCCCO)NCC1CCCC1 1626a_100000737975_100000695505 [1,0,0,1,0,0|2,0,0]=4 4376 B14R1.86 O=C(CCN1CCCC1)NCCCO 240690a_100000182051_100000738983 [1,0,0,1,0,0|2,0,0]=4 4377 B14R1.86 O=C(COC1CCCC1)NCCCO 240690a_100000182051_100000741352 [1,0,0,1,0,0|2,0,0]=4 4378 B14R1.86 O=C(COC1CCCC1)NCCCO 527a_100000182051_100000741352 [1,0,0,1,0,0|2,0,0]=4 4379 B14R1.86 O=C(NCCCO)NCC1CCCC1 2708a_100000737975_100000182051 [1,0,0,1,0,0|2,0,0]=4 4380 B14R1.86 O=C(NCCCO)NCC1CCCC1 273464a_100000182051_100000737975 [1,0,0,1,0,0|2,0,0]=4 4381 B14R1.86 O=C(NCCCO)NCC1CCCC1 273464a_100000737975_100000182051 [1,0,0,1,0,0|2,0,0]=4 4382 B14R1.86 O=C(NCCCO)NCC1CCCC1 512a_100000737975_100000182051 [1,0,0,1,0,0|2,0,0]=4 4383 B14R1.158 CCCCCC(=O)CC1CCCCC1 1458a_100000211666_100000210326 [1,0,0,1,0,0|2,0,0]=4 4384 B14R1.158 CCCCCC(=O)CC1CCCCC1 1458a_100000212188_100000211423 [1,0,0,1,0,0|2,0,0]=4 4385 B14R1.158 CCCCNC(=O)CC1CCCCC1 11a_100000102301_100000211666 [1,0,0,1,0,0|2,0,0]=4 4386 B14R1.158 CCCCNC(=O)CC1CCCCC1 1626a_100000102301_100000211666 [1,0,0,1,0,0|2,0,0]=4 4387 B14R1.158 CCCCNC(=O)CC1CCCCC1 240690a_100000102301_100000211666 [1,0,0,1,0,0|2,0,0]=4 4388 B14R1.158 CCCCNC(=O)CC1CCCCC1 527a_100000102301_100000211666 [1,0,0,1,0,0|2,0,0]=4 4389 B14R1.158 O=C(CC1CCCCC1)NCCCF 11a_100015189416_100000211666 [1,0,0,1,0,0|2,0,0]=4 4390 B14R1.158 O=C(CC1CCCCC1)NCCCF 1626a_100015189416_100000211666 [1,0,0,1,0,0|2,0,0]=4 4391 B14R1.158 O=C(CC1CCCCC1)NCCCF 240690a_100015189416_100000211666 [1,0,0,1,0,0|2,0,0]=4 4392 B14R1.158 O=C(CC1CCCCC1)NCCCF 527a_100015189416_100000211666 [1,0,0,1,0,0|2,0,0]=4 4393 B14R1.158 O=C(CC1CCCCC1)NCCCO 240690a_100000182051_100000211666 [1,0,0,1,0,0|1,0,0]=3 4394 B14R1.158 O=C(CC1CCCCC1)NCCCO 527a_100000182051_100000211666 [1,0,0,1,0,0|1,0,0]=3 4395 B14R1.158 O=C(CC1CCCCC1)NNCCO 22a_100000210001_100000211666 [1,0,0,1,0,0|2,0,0]=4 4396 B14R1.158 O=C(CC1CCCCO1)NCCCO 240690a_100000182051_100000238585 [1,0,0,1,0,0|2,0,0]=4 4397 B14R1.158 O=C(CC1CCCCO1)NCCCO 527a_100000182051_100000238585 [1,0,0,1,0,0|2,0,0]=4 4398 B14R1.158 O=C(CC1CCCOC1)NCCCO 240690a_100000182051_100000741523 [1,0,0,1,0,0|2,0,0]=4 4399 B14R1.158 O=C(CC1CCCOC1)NCCCO 527a_100000182051_100000741523 [1,0,0,1,0,0|2,0,0]=4 4400 B14R1.158 O=C(CC1CCOCC1)NCCCO 240690a_100000182051_100000757261 [1,0,0,1,0,0|2,0,0]=4 4401 B14R1.158 O=C(CC1CCOCC1)NCCCO 527a_100000182051_100000757261 [1,0,0,1,0,0|2,0,0]=4 4402 B14R1.158 O=C(CCCCF)CC1CCCCC1 1458a_100000211666_100000729493 [1,0,0,1,0,0|2,0,0]=4 4403 B14R1.158 O=C(CCCCO)CC1CCCCC1 1458a_100000211666_100000210776 [1,0,0,1,0,0|1,0,0]=3 4404 B14R1.158 O=C(CCCCO)CC1CCCCC1 1458a_100000695505_100000211423 [1,0,0,1,0,0|1,0,0]=3 4405 B14R1.158 O=C(CCCCO)CC1CCCCO1 1458a_100000238585_100000210776 [1,0,0,1,0,0|2,0,0]=4 4406 B14R1.158 O=C(CCCCO)CC1CCCCO1 1458a_100000695505_100000211543 [1,0,0,1,0,0|2,0,0]=4 4407 B14R1.158 O=C(CCCCO)CC1CCCOC1 1458a_100000695505_100000741521 [1,0,0,1,0,0|2,0,0]=4 4408 B14R1.158 O=C(CCCCO)CC1CCCOC1 1458a_100000741523_100000210776 [1,0,0,1,0,0|2,0,0]=4 4409 B14R1.158 O=C(CCCCO)CC1CCOCC1 1458a_100000695505_100000754603 [1,0,0,1,0,0|2,0,0]=4 4410 B14R1.158 O=C(CCCCO)CC1CCOCC1 1458a_100000757261_100000210776 [1,0,0,1,0,0|2,0,0]=4 4411 B14R1.158 O=C(CCCCO)CN1CCCCC1 1458a_100000740322_100000210776 [1,0,0,1,0,0|2,0,0]=4 4412 B14R1.158 O=C(CCCCO)NC1CCCCC1 1626a_100000182618_100000695505 [1,0,0,1,0,0|2,0,0]=4 4413 B14R1.158 O=C(CN1CCCCC1)NCCCO 240690a_100000182051_100000740322 [1,0,0,1,0,0|2,0,0]=4 4414 B14R1.158 O=C(CN1CCCCC1)NCCCO 527a_100000182051_100000740322 [1,0,0,1,0,0|2,0,0]=4 4415 B14R1.158 O=C(COCCO)CC1CCCCC1 1458a_100000708028_100000211423 [1,0,0,1,0,0|2,0,0]=4 4416 B14R1.158 O=C(NCCCO)NC1CCCCC1 2708a_100000182618_100000182051 [1,0,0,1,0,0|2,0,0]=4 4417 B14R1.158 O=C(NCCCO)NC1CCCCC1 273464a_100000182051_100000182618 [1,0,0,1,0,0|2,0,0]=4 4418 B14R1.158 O=C(NCCCO)NC1CCCCC1 273464a_100000182618_100000182051 [1,0,0,1,0,0|2,0,0]=4 4419 B14R1.169 CCCCCCCC(=O)C1=CCCC1 1458a_100000038896_100000210614 [1,0,0,1,0,0|2,0,0]=4 4420 B14R1.169 CCCCCCCC(=O)C1CCCC1 1458a_100000210718_100000210614 [1,0,0,1,0,0|2,0,0]=4 4421 B14R1.169 CCCCCCCC(=O)C1CCCC1 1458a_100000211969_100000179811 [1,0,0,1,0,0|2,0,0]=4 4422 B14R1.169 CCCCCCCC(=O)C1CCCS1 1458a_100012002731_100000210614 [1,0,0,1,0,0|1,1,0]=4 4423 B14R1.169 CCCCCCCC(=O)N1CCCC1 240690a_100000188435_100000211969 [1,0,0,1,0,0|2,0,0]=4 4424 B14R1.169 CCCCCCCC(=O)N1CCCC1 527a_100000188435_100000211969 [1,0,0,1,0,0|2,0,0]=4 4425 B14R1.169 CCCCCCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210614 [1,0,0,1,0,0|1,0,0]=3 4426 B14R1.169 CCCCCCNC(=O)[C@@H]1CCCO1 11a_100000210581_100000686382 [1,0,0,1,0,0|2,0,0]=4 4427 B14R1.169 CCCCCCNC(=O)[C@@H]1CCCO1 1626a_100000210581_100000686382 [1,0,0,1,0,0|2,0,0]=4 4428 B14R1.169 CCCCCCNC(=O)[C@@H]1CCCO1 240690a_100000210581_100000686382 [1,0,0,1,0,0|2,0,0]=4 4429 B14R1.169 CCCCCCNC(=O)[C@@H]1CCCO1 527a_100000210581_100000686382 [1,0,0,1,0,0|2,0,0]=4 4430 B14R1.169 CCCCOCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000743108 [1,0,0,1,0,0|2,0,0]=4 4431 B14R1.169 O=C(CCCCCCF)[C@@H]1CCCO1 1458a_100000686382_100015922095 [1,0,0,1,0,0|2,0,0]=4 4432 B14R1.169 O=C(CCCCCCO)[C@@H]1CCCO1 1458a_100000686382_100000766143 [1,0,0,1,0,0|2,0,0]=4 4433 B14R1.1035 CC1CCCCC1C(=O)CCCCF 1458a_100011215568_100000729493 [1,0,0,1,0,0|2,0,0]=4 4434 B14R1.1035 CC1CCCCC1C(=O)CCCCO 1458a_100011215568_100000210776 [1,0,0,1,0,0|1,0,0]=3 4435 B14R1.1035 CC1CCCCC1C(=O)NCCCF 11a_100015189416_100011215568 [1,0,0,1,0,0|2,0,0]=4 4436 B14R1.1035 CC1CCCCC1C(=O)NCCCF 1626a_100015189416_100011215568 [1,0,0,1,0,0|2,0,0]=4 4437 B14R1.1035 CC1CCCCC1C(=O)NCCCF 240690a_100015189416_100011215568 [1,0,0,1,0,0|2,0,0]=4 4438 B14R1.1035 CC1CCCCC1C(=O)NCCCF 527a_100015189416_100011215568 [1,0,0,1,0,0|2,0,0]=4 4439 B14R1.1035 CC1CCCCC1C(=O)NCCCO 240690a_100000182051_100011215568 [1,0,0,1,0,0|1,0,0]=3 4440 B14R1.1035 CC1CCCCC1C(=O)NCCCO 527a_100000182051_100011215568 [1,0,0,1,0,0|1,0,0]=3 4441 B14R1.1035 CC1CCCCC1C(=O)NNCCO 22a_100000210001_100011215568 [1,0,0,1,0,0|2,0,0]=4 4442 B14R1.1035 CC1CCCCN1C(=O)CCCCO 1626a_100000211376_100000695505 [1,0,0,1,0,0|2,0,0]=4 4443 B14R1.1035 CC1CCCCN1C(=O)NCCCO 273464a_100000182051_100000211376 [1,0,0,1,0,0|2,0,0]=4 4444 B14R1.1035 CCCCCC(=O)C1CCCCC1C 1458a_100011215568_100000210326 [1,0,0,1,0,0|2,0,0]=4 4445 B14R1.1035 CCCCNC(=O)C1CCCCC1C 11a_100000102301_100011215568 [1,0,0,1,0,0|2,0,0]=4 4446 B14R1.1035 CCCCNC(=O)C1CCCCC1C 1626a_100000102301_100011215568 [1,0,0,1,0,0|2,0,0]=4 4447 B14R1.1035 CCCCNC(=O)C1CCCCC1C 240690a_100000102301_100011215568 [1,0,0,1,0,0|2,0,0]=4 4448 B14R1.1035 CCCCNC(=O)C1CCCCC1C 527a_100000102301_100011215568 [1,0,0,1,0,0|2,0,0]=4 4449 B14R1.1035 CN1CCCC[C@@H]1C(=O)CCCCO 1458a_100000767060_100000210776 [1,0,0,1,0,0|2,0,0]=4 4450 B14R1.1035 CN1CCCC[C@@H]1C(=O)NCCCO 240690a_100000182051_100000767060 [1,0,0,1,0,0|2,0,0]=4 4451 B14R1.1035 CN1CCCC[C@@H]1C(=O)NCCCO 527a_100000182051_100000767060 [1,0,0,1,0,0|2,0,0]=4 4452 B14R1.1035 O=C(CCCCO)C1CCCCC1O 1458a_100011803323_100000210776 [1,0,0,1,0,0|2,0,0]=4 4453 B14R1.1037 CCCCOC(=O)CNCCC1CC1 34a_100000764129_100000211628 [1,0,0,1,0,0|2,0,0]=4 4454 B14R1.1037 CCCCOC(=O)COCCC1CC1 34a_100000754188_100000211628 [1,0,0,1,0,0|2,0,0]=4 4455 B14R1.1037 CCCCOC(=O)COCCC1CC1 7a_100000754188_100000211628 [1,0,0,1,0,0|2,0,0]=4 4456 B14R1.1037 CCCCOC(=O)CSCCC1CC1 62a_100000211628_100000764125 [1,0,0,1,0,0|2,0,0]=4 4457 B14R1.1037 CCCCOC(=O)CSCCC1CC1 62a_100000764125_100000211628 [1,0,0,1,0,0|2,0,0]=4 4458 B14R1.1044 CCCCOC(=O)CNCC1CCC1 2230a_100000738700_100000211628 [1,0,0,1,0,0|2,0,0]=4 4459 B14R1.1044 CCCCOC(=O)CNCC1CCC1 34a_100000738700_100000211628 [1,0,0,1,0,0|2,0,0]=4 4460 B14R1.1044 CCCCOC(=O)COCC1CCC1 34a_100000760304_100000211628 [1,0,0,1,0,0|2,0,0]=4 4461 B14R1.1044 CCCCOC(=O)CSCC1CCC1 62a_100000211628_100000763275 [1,0,0,1,0,0|2,0,0]=4 4462 B14R1.1044 CCCCOC(=O)CSCC1CCC1 62a_100000763275_100000211628 [1,0,0,1,0,0|2,0,0]=4 4463 B14R1.1045 CCC1CCCN1C(=O)CCCCO 1626a_100000754278_100000695505 [1,0,0,1,0,0|2,0,0]=4 4464 B14R1.1045 CCC1CCCN1C(=O)NCCCO 273464a_100000182051_100000754278 [1,0,0,1,0,0|2,0,0]=4 4465 B14R1.1045 CCN1CCCC1C(=O)CCCCO 1458a_106256033941_100000210776 [1,0,0,1,0,0|2,0,0]=4 4466 B14R1.1045 CCN1CCCC1C(=O)NCCCO 240690a_100000182051_106256033941 [1,0,0,1,0,0|2,0,0]=4 4467 B14R1.1045 CCN1CCCC1C(=O)NCCCO 527a_100000182051_106256033941 [1,0,0,1,0,0|2,0,0]=4 4468 B14R1.1047 CCCCOC(=O)CN1CCC[C@@H]1C 2230a_100020605311_100000211628 [1,0,0,1,0,0|2,0,0]=4 4469 B14R1.1047 CCCCOC(=O)CN1CCC[C@@H]1C 269982a_100020605311_100000211628 [1,0,0,1,0,0|2,0,0]=4 4470 B14R1.1047 CCCCOC(=O)CN1CCC[C@H]1C 2230a_100015189458_100000211628 [1,0,0,1,0,0|2,0,0]=4 4471 B14R1.1047 CCCCOC(=O)CN1CCC[C@H]1C 269982a_100015189458_100000211628 [1,0,0,1,0,0|2,0,0]=4 4472 B14R1.1047 CCCCOC(=O)CN1CCC[C@H]1C 34a_100015189458_100000211628 [1,0,0,1,0,0|2,0,0]=4 4473 B14R1.3001 CCCCCC(=O)C1CCCCCC1 1458a_100000212188_100011217769 [1,0,0,1,0,0|2,0,0]=4 4474 B14R1.3001 CCCCCC(=O)C1CCCCCC1 1458a_100000749507_100000210326 [1,0,0,1,0,0|2,0,0]=4 4475 B14R1.3001 CCCCNC(=O)C1CCCCCC1 11a_100000102301_100000749507 [1,0,0,1,0,0|2,0,0]=4 4476 B14R1.3001 CCCCNC(=O)C1CCCCCC1 1626a_100000102301_100000749507 [1,0,0,1,0,0|2,0,0]=4 4477 B14R1.3001 CCCCNC(=O)C1CCCCCC1 240690a_100000102301_100000749507 [1,0,0,1,0,0|2,0,0]=4 4478 B14R1.3001 CCCCNC(=O)C1CCCCCC1 527a_100000102301_100000749507 [1,0,0,1,0,0|2,0,0]=4 4479 B14R1.3001 O=C(CCCCF)C1CCCCCC1 1458a_100000749507_100000729493 [1,0,0,1,0,0|2,0,0]=4 4480 B14R1.3001 O=C(CCCCO)C1CCCCCC1 1458a_100000695505_100011217769 [1,0,0,1,0,0|1,0,0]=3 4481 B14R1.3001 O=C(CCCCO)C1CCCCCC1 1458a_100000749507_100000210776 [1,0,0,1,0,0|1,0,0]=3 4482 B14R1.3001 O=C(CCCCO)N1CCCCCC1 1626a_100000185865_100000695505 [1,0,0,1,0,0|2,0,0]=4 4483 B14R1.3001 O=C(COCCO)C1CCCCCC1 1458a_100000708028_100011217769 [1,0,0,1,0,0|2,0,0]=4 4484 B14R1.3001 O=C(NCCCF)C1CCCCCC1 11a_100015189416_100000749507 [1,0,0,1,0,0|2,0,0]=4 4485 B14R1.3001 O=C(NCCCF)C1CCCCCC1 1626a_100015189416_100000749507 [1,0,0,1,0,0|2,0,0]=4 4486 B14R1.3001 O=C(NCCCF)C1CCCCCC1 240690a_100015189416_100000749507 [1,0,0,1,0,0|2,0,0]=4 4487 B14R1.3001 O=C(NCCCF)C1CCCCCC1 527a_100015189416_100000749507 [1,0,0,1,0,0|2,0,0]=4 4488 B14R1.3001 O=C(NCCCO)C1CCCCCC1 240690a_100000182051_100000749507 [1,0,0,1,0,0|1,0,0]=3 4489 B14R1.3001 O=C(NCCCO)C1CCCCCC1 527a_100000182051_100000749507 [1,0,0,1,0,0|1,0,0]=3 4490 B14R1.3001 O=C(NCCCO)N1CCCCCC1 273464a_100000182051_100000185865 [1,0,0,1,0,0|2,0,0]=4 4491 B14R1.3001 O=C(NNCCO)C1CCCCCC1 22a_100000210001_100000749507 [1,0,0,1,0,0|2,0,0]=4 4492 B14R1.3606 CCCCOC(=O)COCC1CC1C 34a_100000744939_100000211628 [1,0,0,1,0,0|2,0,0]=4 4493 B14R1.3606 CCCCOC(=O)COCC1CC1C 7a_100000744939_100000211628 [1,0,0,1,0,0|2,0,0]=4 4494 B14R1.4515 CCCCCCCC(=O)C1CC1CC 1458a_200011661523_100000210614 [1,0,0,1,0,0|2,0,0]=4 4495 B14R1.4517 CCCCCCCC(=O)CC1CCC1 1458a_100000211969_100000763275 [1,0,0,1,0,0|2,0,0]=4 4496 B14R1.4517 CCCCCCCC(=O)CC1CCC1 1458a_100000763092_100000210614 [1,0,0,1,0,0|2,0,0]=4 4497 B14R1.4517 CCCCCCCC(=O)CC1CCO1 1458a_100000211969_100000103362 [1,0,0,1,0,0|1,0,0]=3 4498 B14R1.4517 CCCCCCCC(=O)NC1CCC1 11a_100000749019_100000211969 [1,0,0,1,0,0|2,0,0]=4 4499 B14R1.4517 CCCCCCCC(=O)NC1CCC1 1626a_100000749019_100000211969 [1,0,0,1,0,0|2,0,0]=4 4500 B14R1.4517 CCCCCCCC(=O)NC1CCC1 240690a_100000749019_100000211969 [1,0,0,1,0,0|2,0,0]=4 4501 B14R1.4517 CCCCCCCC(=O)NC1CCC1 527a_100000749019_100000211969 [1,0,0,1,0,0|2,0,0]=4 4502 B14R1.4517 COCCCCCC(=O)CC1CCO1 1458a_100011935119_100000103362 [1,0,0,1,0,0|2,0,0]=4 4503 B14R1.4517 O=C(CCCCCCO)CC1CCO1 1458a_100011996774_100000103362 [1,0,0,1,0,0|2,0,0]=4 4504 B14R1.4519 CCCCCCCC(=O)N1CCC1C 11a_100000755817_100000211969 [1,0,0,1,0,0|2,0,0]=4 4505 B14R1.4519 CCCCCCCC(=O)N1CCC1C 240690a_100000755817_100000211969 [1,0,0,1,0,0|2,0,0]=4 4506 B14R1.4519 CCCCCCCC(=O)N1CCC1C 527a_100000755817_100000211969 [1,0,0,1,0,0|2,0,0]=4 4507 B14R1.37 CCCCCCC(=O)C1CCC(C1)O 1458a_100000688591_100000210757 [1,0,0,1,0,0|2,0,0]=4 4508 B14R1.37 CCCCCCC(=O)N1CCC(C1)O 240690a_100011215560_100102632555 [1,0,0,1,0,0|2,0,0]=4 4509 B14R1.37 CCCCCCC(=O)N1CCC(C1)O 527a_100011215560_100102632555 [1,0,0,1,0,0|2,0,0]=4 4510 B14R1.77 CCC1CCCC(C1)OCC(O)CO 7a_100011985506_100011219619 [1,0,0,1,0,0|1,0,1]=4 4511 B14R1.77 CCC1CCCC(C1)OC[C@@H](O)CO 7a_100011985506_100009815848 [1,0,0,1,0,0|1,0,1]=4 4512 B14R1.163 CC(CO)CNC(=O)C1CCCCC1 240690a_100000744482_100000210647 [1,0,0,1,0,0|2,0,0]=4 4513 B14R1.163 CC(CO)CNC(=O)C1CCCCC1 527a_100000744482_100000210647 [1,0,0,1,0,0|2,0,0]=4 4514 B14R1.163 CC(OCC(O)CO)C1CCCCC1 34a_100011216961_100011219619 [1,0,0,1,0,0|1,0,1]=4 4515 B14R1.163 CC(OCC(O)CO)C1CCCCC1 7a_100011216961_100011219619 [1,0,0,1,0,0|1,0,1]=4 4516 B14R1.163 CC(OC[C@@H](O)CO)C1CCCCC1 34a_100011216961_100009815848 [1,0,0,1,0,0|1,0,1]=4 4517 B14R1.163 CC(OC[C@@H](O)CO)C1CCCCC1 7a_100011216961_100009815848 [1,0,0,1,0,0|1,0,1]=4 4518 B14R1.163 CCC(O)CNC(=O)C1CCCCC1 11a_100011218483_100000210647 [1,0,0,1,0,0|2,0,0]=4 4519 B14R1.163 CCC(O)CNC(=O)C1CCCCC1 240690a_100011218483_100000210647 [1,0,0,1,0,0|2,0,0]=4 4520 B14R1.163 CCC(O)CNC(=O)C1CCCCC1 527a_100011218483_100000210647 [1,0,0,1,0,0|2,0,0]=4 4521 B14R1.163 O=C(CO)COC(=O)C1CCCCC1 1458a_100000210174_100009893799 [1,0,0,1,0,0|0,0,2]=4 4522 B14R1.163 O=C(NC[C@@H](F)CO)C1CCCCC1 240690a_100015665980_100000210647 [1,0,0,1,0,0|2,0,0]=4 4523 B14R1.163 O=C(NC[C@@H](F)CO)C1CCCCC1 527a_100015665980_100000210647 [1,0,0,1,0,0|2,0,0]=4 4524 B14R1.163 O=C(NC[C@H](O)CO)C1CCCCC1 240690a_100020644852_100000210647 [1,0,0,1,0,0|1,0,0]=3 4525 B14R1.163 O=C(NC[C@H](O)CO)C1CCCCC1 527a_100020644852_100000210647 [1,0,0,1,0,0|1,0,0]=3 4526 B14R1.163 O=C(NC[C@H](O)CO)C1CCCCO1 240690a_100020644852_100000748299 [1,0,0,1,0,0|2,0,0]=4 4527 B14R1.163 O=C(NC[C@H](O)CO)C1CCCCO1 527a_100020644852_100000748299 [1,0,0,1,0,0|2,0,0]=4 4528 B14R1.163 O=C(NC[C@H](O)CO)C1CCCOC1 240690a_100020644852_100000741522 [1,0,0,1,0,0|2,0,0]=4 4529 B14R1.163 O=C(NC[C@H](O)CO)C1CCCOC1 527a_100020644852_100000741522 [1,0,0,1,0,0|2,0,0]=4 4530 B14R1.163 O=C(NC[C@H](O)CO)C1CCOCC1 240690a_100020644852_100000195482 [1,0,0,1,0,0|2,0,0]=4 4531 B14R1.163 O=C(NC[C@H](O)CO)C1CCOCC1 527a_100020644852_100000195482 [1,0,0,1,0,0|2,0,0]=4 4532 B14R1.163 O=C(NC[C@H](O)CO)C1CCSCC1 240690a_100020644852_100000755232 [1,0,0,1,0,0|2,0,0]=4 4533 B14R1.163 O=C(NC[C@H](O)CO)C1CCSCC1 527a_100020644852_100000755232 [1,0,0,1,0,0|2,0,0]=4 4534 B14R1.731 CC(CO)CNC(=O)CC1CCCC1 240690a_100000744482_100000210891 [1,0,0,1,0,0|2,0,0]=4 4535 B14R1.731 CC(CO)CNC(=O)CC1CCCC1 527a_100000744482_100000210891 [1,0,0,1,0,0|2,0,0]=4 4536 B14R1.731 CCC(O)CNC(=O)CC1CCCC1 11a_100011218483_100000210891 [1,0,0,1,0,0|2,0,0]=4 4537 B14R1.731 CCC(O)CNC(=O)CC1CCCC1 240690a_100011218483_100000210891 [1,0,0,1,0,0|2,0,0]=4 4538 B14R1.731 CCC(O)CNC(=O)CC1CCCC1 527a_100011218483_100000210891 [1,0,0,1,0,0|2,0,0]=4 4539 B14R1.731 O=C(CC1CCCC1)NC[C@@H](F)CO 240690a_100015665980_100000210891 [1,0,0,1,0,0|2,0,0]=4 4540 B14R1.731 O=C(CC1CCCC1)NC[C@@H](F)CO 527a_100015665980_100000210891 [1,0,0,1,0,0|2,0,0]=4 4541 B14R1.731 O=C(CC1CCCC1)NC[C@H](O)CO 240690a_100020644852_100000210891 [1,0,0,1,0,0|1,0,0]=3 4542 B14R1.731 O=C(CC1CCCC1)NC[C@H](O)CO 527a_100020644852_100000210891 [1,0,0,1,0,0|1,0,0]=3 4543 B14R1.731 O=C(CC1CCOC1)NC[C@H](O)CO 240690a_100020644852_100011218419 [1,0,0,1,0,0|2,0,0]=4 4544 B14R1.731 O=C(CC1CCOC1)NC[C@H](O)CO 527a_100020644852_100011218419 [1,0,0,1,0,0|2,0,0]=4 4545 B14R1.731 O=C(CN1CCCC1)NCC(O)CO 2230a_100000188435_200012027429 [1,0,0,1,0,0|2,0,0]=4 4546 B14R1.731 O=C(CN1CCCC1)NCC(O)CO 269982a_100000188435_200012027429 [1,0,0,1,0,0|2,0,0]=4 4547 B14R1.731 O=C(CN1CCCC1)NC[C@H](O)CO 240690a_100020644852_100000740243 [1,0,0,1,0,0|2,0,0]=4 4548 B14R1.731 O=C(CN1CCCC1)NC[C@H](O)CO 527a_100020644852_100000740243 [1,0,0,1,0,0|2,0,0]=4 4549 B14R1.731 O=C(NC[C@H](O)CO)NC1CCCC1 2708a_100000211070_100020644852 [1,0,0,1,0,0|2,0,0]=4 4550 B14R1.731 O=C(NC[C@H](O)CO)NC1CCCC1 273464a_100000211070_100020644852 [1,0,0,1,0,0|2,0,0]=4 4551 B14R1.731 O=C(NC[C@H](O)CO)NC1CCCC1 273464a_100020644852_100000211070 [1,0,0,1,0,0|2,0,0]=4 4552 B14R1.1569 CC1(CCCCCC1)OCC(O)CO 34a_100000708895_100011219619 [1,0,0,1,0,0|1,0,1]=4 4553 B14R1.1569 CC1(CCCCCC1)OCC(O)CO 7a_100000708895_100011219619 [1,0,0,1,0,0|1,0,1]=4 4554 B14R1.1569 CC1(CCCCCC1)OC[C@@H](O)CO 34a_100000708895_100009815848 [1,0,0,1,0,0|1,0,1]=4 4555 B14R1.1569 CC1(CCCCCC1)OC[C@@H](O)CO 7a_100000708895_100009815848 [1,0,0,1,0,0|1,0,1]=4 4556 B14R1.3684 CCCCCCC(=O)NCC1COC1 11a_100015281925_100102632555 [1,0,0,1,0,0|2,0,0]=4 4557 B14R1.3684 CCCCCCC(=O)NCC1COC1 1626a_100015281925_100102632555 [1,0,0,1,0,0|2,0,0]=4 4558 B14R1.3684 CCCCCCC(=O)NCC1COC1 240690a_100015281925_100102632555 [1,0,0,1,0,0|2,0,0]=4 4559 B14R1.3684 CCCCCCC(=O)NCC1COC1 527a_100015281925_100102632555 [1,0,0,1,0,0|2,0,0]=4 4560 B14R1.3684 CCCCCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100102632555 [1,0,0,1,0,0|2,0,0]=4 4561 B14R1.3684 CCCCCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100102632555 [1,0,0,1,0,0|2,0,0]=4 4562 B14R1.3684 CCCCCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100102632555 [1,0,0,1,0,0|2,0,0]=4 4563 B14R1.3684 CCCCCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100102632555 [1,0,0,1,0,0|2,0,0]=4 4564 B14R1.4461 CC(CO)CNC(=O)C1CCCC1C 240690a_100000744482_100000690547 [1,0,0,1,0,0|2,0,0]=4 4565 B14R1.4461 CC(CO)CNC(=O)C1CCCC1C 527a_100000744482_100000690547 [1,0,0,1,0,0|2,0,0]=4 4566 B14R1.4461 CC1CCCC1C(=O)NC[C@@H](F)CO 240690a_100015665980_100000690547 [1,0,0,1,0,0|2,0,0]=4 4567 B14R1.4461 CC1CCCC1C(=O)NC[C@@H](F)CO 527a_100015665980_100000690547 [1,0,0,1,0,0|2,0,0]=4 4568 B14R1.4461 CC1CCCC1C(=O)NC[C@H](O)CO 240690a_100020644852_100000690547 [1,0,0,1,0,0|1,0,0]=3 4569 B14R1.4461 CC1CCCC1C(=O)NC[C@H](O)CO 527a_100020644852_100000690547 [1,0,0,1,0,0|1,0,0]=3 4570 B14R1.4461 CCC(O)CNC(=O)C1CCCC1C 11a_100011218483_100000690547 [1,0,0,1,0,0|2,0,0]=4 4571 B14R1.4461 CCC(O)CNC(=O)C1CCCC1C 240690a_100011218483_100000690547 [1,0,0,1,0,0|2,0,0]=4 4572 B14R1.4461 CCC(O)CNC(=O)C1CCCC1C 527a_100011218483_100000690547 [1,0,0,1,0,0|2,0,0]=4 4573 B14R1.4461 CN1CCC[C@H]1C(=O)NC[C@H](O)CO 240690a_100020644852_100009816429 [1,0,0,1,0,0|2,0,0]=4 4574 B14R1.4461 CN1CCC[C@H]1C(=O)NC[C@H](O)CO 527a_100020644852_100009816429 [1,0,0,1,0,0|2,0,0]=4 4575 B14R1.4461 C[C@@H]1CCCN1C(=O)NC[C@H](O)CO 273464a_100020644852_100015189458 [1,0,0,1,0,0|2,0,0]=4 4576 B14R1.4461 C[C@H]1CCCN1C(=O)NC[C@H](O)CO 273464a_100020644852_100020605311 [1,0,0,1,0,0|2,0,0]=4 4577 B14R1.6688 CCCCCCC(=O)NCC1(CC1)O 11a_100011936951_100102632555 [1,0,0,1,0,0|2,0,0]=4 4578 B14R1.6688 CCCCCCC(=O)NCC1(CC1)O 240690a_100011936951_100102632555 [1,0,0,1,0,0|2,0,0]=4 4579 B14R1.6688 CCCCCCC(=O)NCC1(CC1)O 527a_100011936951_100102632555 [1,0,0,1,0,0|2,0,0]=4 4580 B14R1.7758 O=C(CNC1CCC1)NCC(O)CO 2230a_100000749019_200012027429 [1,0,0,1,0,0|2,0,0]=4 4581 B14R1.7758 O=C(CNC1CCC1)NCC(O)CO 34a_100000749019_200012027429 [1,0,0,1,0,0|2,0,0]=4 4582 B14R1.7758 O=C(COC1CCC1)NCC(O)CO 34a_100000748187_200012027429 [1,0,0,1,0,0|2,0,0]=4 4583 B14R1.7758 O=C(CSC1CCC1)NCC(O)CO 62a_200012027429_100000749161 [1,0,0,1,0,0|2,0,0]=4 4584 B14R1.7758 O=C(NCC1CCC1)NC[C@H](O)CO 2708a_100000738700_100020644852 [1,0,0,1,0,0|2,0,0]=4 4585 B14R1.7758 O=C(NCC1CCC1)NC[C@H](O)CO 273464a_100000738700_100020644852 [1,0,0,1,0,0|2,0,0]=4 4586 B14R1.7758 O=C(NCC1CCC1)NC[C@H](O)CO 273464a_100020644852_100000738700 [1,0,0,1,0,0|2,0,0]=4 4587 B14R1.7759 O=C(CNCC1CC1)NCC(O)CO 2230a_100000735609_200012027429 [1,0,0,1,0,0|2,0,0]=4 4588 B14R1.7759 O=C(CNCC1CC1)NCC(O)CO 34a_100000735609_200012027429 [1,0,0,1,0,0|2,0,0]=4 4589 B14R1.7759 O=C(COCC1CC1)NCC(O)CO 34a_100000211283_200012027429 [1,0,0,1,0,0|2,0,0]=4 4590 B14R1.7759 O=C(CSCC1CC1)NCC(O)CO 62a_100000756562_200012027429 [1,0,0,1,0,0|2,0,0]=4 4591 B14R1.7759 O=C(CSCC1CC1)NCC(O)CO 62a_200012027429_100000742324 [1,0,0,1,0,0|2,0,0]=4 4592 B14R1.7759 O=C(CSCC1CC1)NC[C@H](O)CO 240690a_100020644852_200011316215 [1,0,0,1,0,0|2,0,0]=4 4593 B14R1.7759 O=C(CSCC1CC1)NC[C@H](O)CO 527a_100020644852_200011316215 [1,0,0,1,0,0|2,0,0]=4 4594 B14R1.7759 O=C(NCCC1CC1)NC[C@H](O)CO 2708a_100000764129_100020644852 [1,0,0,1,0,0|2,0,0]=4 4595 B14R1.7759 O=C(NCCC1CC1)NC[C@H](O)CO 273464a_100000764129_100020644852 [1,0,0,1,0,0|2,0,0]=4 4596 B14R1.7759 O=C(NCCC1CC1)NC[C@H](O)CO 273464a_100020644852_100000764129 [1,0,0,1,0,0|2,0,0]=4 4597 B14R1.7760 CC1CCN1CC(=O)NCC(O)CO 269982a_100000755817_200012027429 [1,0,0,1,0,0|2,0,0]=4 4598 B14R1.7760 CC1CCN1CC(=O)NCC(O)CO 34a_100000755817_200012027429 [1,0,0,1,0,0|2,0,0]=4 4599 B14R1.10503 CCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 11a_206633788156_100102632555 [1,0,0,1,0,0|2,0,0]=4 4600 B14R1.10503 CCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 240690a_206633788156_100102632555 [1,0,0,1,0,0|2,0,0]=4 4601 B14R1.10503 CCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 527a_206633788156_100102632555 [1,0,0,1,0,0|2,0,0]=4 4602 B14R1.10505 CCCCCCC(=O)C1CC(C1)CO 1458a_206645079618_100000210757 [1,0,0,1,0,0|2,0,0]=4 4603 B14R1.10505 CCCCCCC(=O)N1CC(C1)CO 240690a_100016987283_100102632555 [1,0,0,1,0,0|2,0,0]=4 4604 B14R1.10505 CCCCCCC(=O)N1CC(C1)CO 527a_100016987283_100102632555 [1,0,0,1,0,0|2,0,0]=4 4605 B14R1.587 CC1CCCCC1C(=O)C[C@@H](C)CO 1458a_100011215568_100000059175 [0,0,0,1,1,0|1,0,0]=3 4606 B14R1.587 CC1CCCCC1C(=O)N[C@H](C)CO 240690a_100000737577_100011215568 [0,0,0,1,1,0|2,0,0]=4 4607 B14R1.587 CC1CCCCC1C(=O)N[C@H](C)CO 527a_100000737577_100011215568 [0,0,0,1,1,0|2,0,0]=4 4608 B14R1.587 CC1CCCCC1N(C)CC(O)CO 270004a_100011216503_100000210921 [0,0,0,1,1,0|2,0,0]=4 4609 B14R1.587 CCC(C)CC(=O)C1CCCCC1C 1458a_100011215568_100000748023 [0,0,0,1,1,0|2,0,0]=4 4610 B14R1.587 CCC(O)CC(=O)C1CCCCC1C 1458a_100011215568_100011218378 [0,0,0,1,1,0|1,0,0]=3 4611 B14R1.587 CCC(O)CC(=O)C1CCCCC1O 1458a_100011803323_100011218378 [0,0,0,1,1,0|2,0,0]=4 4612 B14R1.587 CCC(O)CC(=O)N1CCCCC1C 1626a_100000211376_100011667805 [0,0,0,1,1,0|2,0,0]=4 4613 B14R1.587 CCC(O)CC(=O)N1CCCCC1C 240690a_100000211376_100011667805 [0,0,0,1,1,0|2,0,0]=4 4614 B14R1.587 CCC(O)CC(=O)[C@H]1CCCCN1C 1458a_100000767060_100011218378 [0,0,0,1,1,0|2,0,0]=4 4615 B14R1.587 CC[C@H](C)CC(=O)C1CCCCC1C 1458a_100011215568_100009816398 [0,0,0,1,1,0|2,0,0]=4 4616 B14R1.587 C[C@@H](CO)CC(=O)C1CCCCC1O 1458a_100011803323_100000059175 [0,0,0,1,1,0|2,0,0]=4 4617 B14R1.587 C[C@@H](CO)CC(=O)[C@H]1CCCCN1C 1458a_100000767060_100000059175 [0,0,0,1,1,0|2,0,0]=4 4618 B14R1.588 CCC(C)CC(=O)CCC1CCCC1 1458a_100000211120_100000748023 [0,0,0,1,1,0|2,0,0]=4 4619 B14R1.588 CCC(C)CC(=O)CCC1CCCC1 1458a_100000708755_100000760354 [0,0,0,1,1,0|2,0,0]=4 4620 B14R1.588 CCC(O)CC(=O)CCC1CCCC1 1458a_100000211120_100011218378 [0,0,0,1,1,0|1,0,0]=3 4621 B14R1.588 CCC(O)CC(=O)CCC1CCCC1 1458a_100011667805_100000760354 [0,0,0,1,1,0|1,0,0]=3 4622 B14R1.588 CCC(O)CC(=O)CCC1CCCO1 1458a_100011247709_100011218378 [0,0,0,1,1,0|2,0,0]=4 4623 B14R1.588 CCC(O)CC(=O)CCN1CCCC1 1458a_100000738983_100011218378 [0,0,0,1,1,0|2,0,0]=4 4624 B14R1.588 CCC(O)CC(=O)CCN1CCCC1 1458a_100011667805_100000004467 [0,0,0,1,1,0|2,0,0]=4 4625 B14R1.588 CCC(O)CC(=O)COC1CCCC1 1458a_100000741352_100011218378 [0,0,0,1,1,0|2,0,0]=4 4626 B14R1.588 CCC(O)CC(=O)NCC1CCCC1 1626a_100000737975_100011667805 [0,0,0,1,1,0|2,0,0]=4 4627 B14R1.588 CCC(O)CC(=O)NCC1CCCC1 240690a_100000737975_100011667805 [0,0,0,1,1,0|2,0,0]=4 4628 B14R1.588 CC[C@H](C)CC(=O)CCC1CCCC1 1458a_100000211120_100009816398 [0,0,0,1,1,0|2,0,0]=4 4629 B14R1.588 CN(CCC1CCCC1)CC(O)CO 2230a_100011216503_100000760354 [0,0,0,1,1,0|2,0,0]=4 4630 B14R1.588 CN(CCC1CCCC1)CC(O)CO 269982a_100011216503_100000760354 [0,0,0,1,1,0|2,0,0]=4 4631 B14R1.588 C[C@@H](CO)CC(=O)CCC1CCCC1 1458a_100000211120_100000059175 [0,0,0,1,1,0|1,0,0]=3 4632 B14R1.588 C[C@@H](CO)CC(=O)CCC1CCCO1 1458a_100011247709_100000059175 [0,0,0,1,1,0|2,0,0]=4 4633 B14R1.588 C[C@@H](CO)CC(=O)CCN1CCCC1 1458a_100000738983_100000059175 [0,0,0,1,1,0|2,0,0]=4 4634 B14R1.588 C[C@@H](CO)CC(=O)COC1CCCC1 1458a_100000741352_100000059175 [0,0,0,1,1,0|2,0,0]=4 4635 B14R1.588 C[C@H](CO)NC(=O)CCC1CCCC1 240690a_100000737577_100000211120 [0,0,0,1,1,0|2,0,0]=4 4636 B14R1.588 C[C@H](CO)NC(=O)CCC1CCCC1 527a_100000737577_100000211120 [0,0,0,1,1,0|2,0,0]=4 4637 B14R1.743 CCC(C)CC(=O)CC1CCCCC1 1458a_100000211666_100000748023 [0,0,0,1,1,0|2,0,0]=4 4638 B14R1.743 CCC(C)CC(=O)CC1CCCCC1 1458a_100000708755_100000211423 [0,0,0,1,1,0|2,0,0]=4 4639 B14R1.743 CCC(O)CC(=O)CC1CCCCC1 1458a_100000211666_100011218378 [0,0,0,1,1,0|1,0,0]=3 4640 B14R1.743 CCC(O)CC(=O)CC1CCCCC1 1458a_100011667805_100000211423 [0,0,0,1,1,0|1,0,0]=3 4641 B14R1.743 CCC(O)CC(=O)CC1CCCCO1 1458a_100000238585_100011218378 [0,0,0,1,1,0|2,0,0]=4 4642 B14R1.743 CCC(O)CC(=O)CC1CCCCO1 1458a_100011667805_100000211543 [0,0,0,1,1,0|2,0,0]=4 4643 B14R1.743 CCC(O)CC(=O)CC1CCCOC1 1458a_100000741523_100011218378 [0,0,0,1,1,0|2,0,0]=4 4644 B14R1.743 CCC(O)CC(=O)CC1CCCOC1 1458a_100011667805_100000741521 [0,0,0,1,1,0|2,0,0]=4 4645 B14R1.743 CCC(O)CC(=O)CC1CCOCC1 1458a_100000757261_100011218378 [0,0,0,1,1,0|2,0,0]=4 4646 B14R1.743 CCC(O)CC(=O)CC1CCOCC1 1458a_100011667805_100000754603 [0,0,0,1,1,0|2,0,0]=4 4647 B14R1.743 CCC(O)CC(=O)CN1CCCCC1 1458a_100000740322_100011218378 [0,0,0,1,1,0|2,0,0]=4 4648 B14R1.743 CCC(O)CC(=O)NC1CCCCC1 1626a_100000182618_100011667805 [0,0,0,1,1,0|2,0,0]=4 4649 B14R1.743 CCC(O)CC(=O)NC1CCCCC1 240690a_100000182618_100011667805 [0,0,0,1,1,0|2,0,0]=4 4650 B14R1.743 CC[C@H](C)CC(=O)CC1CCCCC1 1458a_100000211666_100009816398 [0,0,0,1,1,0|2,0,0]=4 4651 B14R1.743 CN(CC(O)CO)CC1CCCCC1 2230a_100000736448_100011219619 [0,0,0,1,1,0|2,0,0]=4 4652 B14R1.743 CN(CC(O)CO)CC1CCCCC1 2230a_100011216503_100000211423 [0,0,0,1,1,0|2,0,0]=4 4653 B14R1.743 CN(CC(O)CO)CC1CCCCC1 269982a_100011216503_100000211423 [0,0,0,1,1,0|2,0,0]=4 4654 B14R1.743 CN(CC(O)CO)CC1CCCCC1 34a_100000736448_100011219619 [0,0,0,1,1,0|2,0,0]=4 4655 B14R1.743 CN(CC1CCCCC1)C[C@@H](O)CO 2230a_100000736448_100009815848 [0,0,0,1,1,0|2,0,0]=4 4656 B14R1.743 CN(CC1CCCCC1)C[C@@H](O)CO 34a_100000736448_100009815848 [0,0,0,1,1,0|2,0,0]=4 4657 B14R1.743 C[C@@H](CO)CC(=O)CC1CCCCC1 1458a_100000211666_100000059175 [0,0,0,1,1,0|1,0,0]=3 4658 B14R1.743 C[C@@H](CO)CC(=O)CC1CCCCO1 1458a_100000238585_100000059175 [0,0,0,1,1,0|2,0,0]=4 4659 B14R1.743 C[C@@H](CO)CC(=O)CC1CCCOC1 1458a_100000741523_100000059175 [0,0,0,1,1,0|2,0,0]=4 4660 B14R1.743 C[C@@H](CO)CC(=O)CC1CCOCC1 1458a_100000757261_100000059175 [0,0,0,1,1,0|2,0,0]=4 4661 B14R1.743 C[C@@H](CO)CC(=O)CN1CCCCC1 1458a_100000740322_100000059175 [0,0,0,1,1,0|2,0,0]=4 4662 B14R1.743 C[C@H](CO)NC(=O)CC1CCCCC1 240690a_100000737577_100000211666 [0,0,0,1,1,0|2,0,0]=4 4663 B14R1.743 C[C@H](CO)NC(=O)CC1CCCCC1 527a_100000737577_100000211666 [0,0,0,1,1,0|2,0,0]=4 4664 B14R1.3127 CCCCCCCN1C[C@H]([C@H](C1)O)O 2230a_100015207562_100000210681 [0,0,0,1,1,0|2,0,0]=4 4665 B14R1.3127 CCCCCCCN1C[C@H]([C@H](C1)O)O 269982a_100015207562_100000210681 [0,0,0,1,1,0|2,0,0]=4 4666 B14R1.3737 CCC(O)CC(=O)C1CCCN1CC 1458a_106256033941_100011218378 [0,0,0,1,1,0|2,0,0]=4 4667 B14R1.3737 CCC(O)CC(=O)N1CCCC1CC 1626a_100000754278_100011667805 [0,0,0,1,1,0|2,0,0]=4 4668 B14R1.3737 CCC(O)CC(=O)N1CCCC1CC 240690a_100000754278_100011667805 [0,0,0,1,1,0|2,0,0]=4 4669 B14R1.3737 CCC1CCCC1N(C)CC(O)CO 270004a_100011216503_100000749056 [0,0,0,1,1,0|2,0,0]=4 4670 B14R1.3737 CCN1CCCC1C(=O)C[C@@H](C)CO 1458a_106256033941_100000059175 [0,0,0,1,1,0|2,0,0]=4 4671 B14R1.6748 CC1(CO1)CC(=O)CCCCCCO 1458a_100011996774_100000760498 [0,0,0,1,1,0|2,0,0]=4 4672 B14R1.6748 CCCCCCCC(=O)CC1(CC1)C 1458a_100000112800_100000210614 [0,0,0,1,1,0|2,0,0]=4 4673 B14R1.6748 CCCCCCCC(=O)CC1(CO1)C 1458a_100000211969_100000760498 [0,0,0,1,1,0|1,0,0]=3 4674 B14R1.6748 COCCCCCC(=O)CC1(CO1)C 1458a_100011935119_100000760498 [0,0,0,1,1,0|2,0,0]=4 4675 B14R1.7055 CCC(C)CC(=O)C1CCCCCC1 1458a_100000708755_100011217769 [0,0,0,1,1,0|2,0,0]=4 4676 B14R1.7055 CCC(C)CC(=O)C1CCCCCC1 1458a_100000749507_100000748023 [0,0,0,1,1,0|2,0,0]=4 4677 B14R1.7055 CCC(O)CC(=O)C1CCCCCC1 1458a_100000749507_100011218378 [0,0,0,1,1,0|1,0,0]=3 4678 B14R1.7055 CCC(O)CC(=O)C1CCCCCC1 1458a_100011667805_100011217769 [0,0,0,1,1,0|1,0,0]=3 4679 B14R1.7055 CCC(O)CC(=O)N1CCCCCC1 1626a_100000185865_100011667805 [0,0,0,1,1,0|2,0,0]=4 4680 B14R1.7055 CCC(O)CC(=O)N1CCCCCC1 240690a_100000185865_100011667805 [0,0,0,1,1,0|2,0,0]=4 4681 B14R1.7055 CC[C@H](C)CC(=O)C1CCCCCC1 1458a_100000749507_100009816398 [0,0,0,1,1,0|2,0,0]=4 4682 B14R1.7055 CN(CC(O)CO)C1CCCCCC1 2230a_100015185097_100011219619 [0,0,0,1,1,0|2,0,0]=4 4683 B14R1.7055 CN(CC(O)CO)C1CCCCCC1 269982a_100011216503_100011217769 [0,0,0,1,1,0|2,0,0]=4 4684 B14R1.7055 CN(CC(O)CO)C1CCCCCC1 270004a_100011216503_100000210131 [0,0,0,1,1,0|2,0,0]=4 4685 B14R1.7055 CN(CC(O)CO)C1CCCCCC1 34a_100015185097_100011219619 [0,0,0,1,1,0|2,0,0]=4 4686 B14R1.7055 CN(C[C@@H](O)CO)C1CCCCCC1 2230a_100015185097_100009815848 [0,0,0,1,1,0|2,0,0]=4 4687 B14R1.7055 CN(C[C@@H](O)CO)C1CCCCCC1 34a_100015185097_100009815848 [0,0,0,1,1,0|2,0,0]=4 4688 B14R1.7055 C[C@@H](CO)CC(=O)C1CCCCCC1 1458a_100000749507_100000059175 [0,0,0,1,1,0|1,0,0]=3 4689 B14R1.7055 C[C@H](CO)NC(=O)C1CCCCCC1 240690a_100000737577_100000749507 [0,0,0,1,1,0|2,0,0]=4 4690 B14R1.7055 C[C@H](CO)NC(=O)C1CCCCCC1 527a_100000737577_100000749507 [0,0,0,1,1,0|2,0,0]=4 4691 B16R1.91 CCCCCCCC(=O)C1CCC(CC1)O 1458a_100000743365_100000210614 [0,0,0,1,0,1|2,0,0]=4 4692 B16R1.91 CCCCCCCC(=O)N1CCC(CC1)O 240690a_100025773856_100000211969 [0,0,0,1,0,1|2,0,0]=4 4693 B16R1.91 CCCCCCCC(=O)N1CCC(CC1)O 527a_100025773856_100000211969 [0,0,0,1,0,1|2,0,0]=4 4694 B16R1.692 CCCCCCCC(=O)N[C@H]1CC[C@H](C1)O 1626a_100015195300_100000211969 [0,0,0,1,0,1|2,0,0]=4 4695 B16R1.692 CCCCCCCC(=O)N[C@H]1CC[C@H](C1)O 240690a_100015195300_100000211969 [0,0,0,1,0,1|2,0,0]=4 4696 B16R1.1163 CC(CO)CCNC(=O)CCC1CCCC1 240690a_106354213184_100000211120 [0,0,0,1,0,1|2,0,0]=4 4697 B16R1.1163 CC(CO)CCNC(=O)CCC1CCCC1 527a_106354213184_100000211120 [0,0,0,1,0,1|2,0,0]=4 4698 B16R1.1163 CCC(O)CNNC(=O)CCC1CCCC1 22a_100015206393_100000211120 [0,0,0,1,0,1|2,0,0]=4 4699 B16R1.1329 CC(CO)CCNC(=O)CC1CCCCC1 240690a_106354213184_100000211666 [0,0,0,1,0,1|2,0,0]=4 4700 B16R1.1329 CC(CO)CCNC(=O)CC1CCCCC1 527a_106354213184_100000211666 [0,0,0,1,0,1|2,0,0]=4 4701 B16R1.1329 CCC(O)CNNC(=O)CC1CCCCC1 22a_100015206393_100000211666 [0,0,0,1,0,1|2,0,0]=4 4702 B16R1.1329 N[C@H](COCC(O)CO)CC1CCCCC1 34a_100015184289_100011219619 [0,0,0,1,0,1|1,0,1]=4 4703 B16R1.1329 N[C@H](COC[C@@H](O)CO)CC1CCCCC1 34a_100015184289_100009815848 [0,0,0,1,0,1|1,0,1]=4 4704 B16R1.1329 O=C(CC1CCCCC1)NN=CC(O)CO 4a_100000189929_100000033539 [0,0,0,1,0,1|1,0,1]=4 4705 B16R1.1329 O=C(CNCC(O)CO)NC1CCCCC1 2230a_100015207117_100011219619 [0,0,0,1,0,1|2,0,0]=4 4706 B16R1.1329 O=C(CNC[C@@H](O)CO)NC1CCCCC1 2230a_100015207117_100009815848 [0,0,0,1,0,1|2,0,0]=4 4707 B16R1.1329 O=C(CNC[C@H](O)CO)NC1CCCCC1 2230a_100020644852_100000183541 [0,0,0,1,0,1|2,0,0]=4 4708 B16R1.1329 O=C(CNC[C@H](O)CO)OC1CCCCC1 2230a_100020644852_100000041653 [0,0,0,1,0,1|2,0,0]=4 4709 B16R1.1329 O=C(CSCC(O)CO)NC1CCCCC1 62a_100000183541_100011219619 [0,0,0,1,0,1|1,1,0]=4 4710 B16R1.1329 O=C(CSCC(O)CO)NC1CCCCC1 62a_100011219619_100000183541 [0,0,0,1,0,1|1,1,0]=4 4711 B16R1.1329 O=C(CSCC(O)CO)OC1CCCCC1 62a_100000041653_100011219619 [0,0,0,1,0,1|1,1,0]=4 4712 B16R1.1329 O=C(CSCC(O)CO)OC1CCCCC1 62a_100011219619_100000041653 [0,0,0,1,0,1|1,1,0]=4 4713 B16R1.1329 O=C(CSC[C@@H](O)CO)NC1CCCCC1 62a_100000183541_100009815848 [0,0,0,1,0,1|1,1,0]=4 4714 B16R1.1329 O=C(CSC[C@@H](O)CO)NC1CCCCC1 62a_100009815848_100000183541 [0,0,0,1,0,1|1,1,0]=4 4715 B16R1.1329 O=C(CSC[C@@H](O)CO)OC1CCCCC1 62a_100000041653_100009815848 [0,0,0,1,0,1|1,1,0]=4 4716 B16R1.1329 O=C(CSC[C@@H](O)CO)OC1CCCCC1 62a_100009815848_100000041653 [0,0,0,1,0,1|1,1,0]=4 4717 B16R1.7598 CCCCCCCC(=O)OCN1CCC1C 269982a_100000755817_100009852258 [0,0,0,1,0,1|2,0,0]=4 4718 B16R1.7598 CCCCCCCC(=O)OCN1CCC1C 34a_100000755817_100009852258 [0,0,0,1,0,1|2,0,0]=4 4719 B16R1.7599 CCCCCCCC(=O)N1CCC(C1)CO 240690a_100000748654_100000211969 [0,0,0,1,0,1|2,0,0]=4 4720 B16R1.7599 CCCCCCCC(=O)N1CCC(C1)CO 527a_100000748654_100000211969 [0,0,0,1,0,1|2,0,0]=4 4721 B16R1.16971 CC(CO)CCNC(=O)C1CCCCC1C 240690a_106354213184_100011215568 [0,0,0,1,0,1|2,0,0]=4 4722 B16R1.16971 CC(CO)CCNC(=O)C1CCCCC1C 527a_106354213184_100011215568 [0,0,0,1,0,1|2,0,0]=4 4723 B16R1.16971 CC1CCCCN1C(=O)CNC[C@H](O)CO 2230a_100020644852_100000182743 [0,0,0,1,0,1|2,0,0]=4 4724 B16R1.16971 CC1CCCCN1C(=O)CSCC(O)CO 62a_100000182743_100011219619 [0,0,0,1,0,1|1,1,0]=4 4725 B16R1.16971 CC1CCCCN1C(=O)CSCC(O)CO 62a_100011219619_100000182743 [0,0,0,1,0,1|1,1,0]=4 4726 B16R1.16971 CC1CCCCN1C(=O)CSC[C@@H](O)CO 62a_100000182743_100009815848 [0,0,0,1,0,1|1,1,0]=4 4727 B16R1.16971 CC1CCCCN1C(=O)CSC[C@@H](O)CO 62a_100009815848_100000182743 [0,0,0,1,0,1|1,1,0]=4 4728 B16R1.16971 CCC(O)CNNC(=O)C1CCCCC1C 22a_100015206393_100011215568 [0,0,0,1,0,1|2,0,0]=4 4729 B16R1.17777 CCCCCCCC(=O)OCN[C@@H]1C[C@@H]1F 2230a_100015190264_100009852258 [0,0,0,1,0,1|2,0,0]=4 4730 B16R1.17777 CCCCCCCC(=O)OCN[C@@H]1C[C@H]1F 2230a_100025746932_100009852258 [0,0,0,1,0,1|2,0,0]=4 4731 B16R1.17777 CCCCCCCC(=O)OCN[C@@H]1C[C@H]1F 34a_100025746932_100009852258 [0,0,0,1,0,1|2,0,0]=4 4732 B16R1.17778 CCCCCCCC(=O)OCNC1CCC1 2230a_100000749019_100009852258 [0,0,0,1,0,1|2,0,0]=4 4733 B16R1.17778 CCCCCCCC(=O)OCNC1CCC1 34a_100000749019_100009852258 [0,0,0,1,0,1|2,0,0]=4 4734 B16R1.17778 CCCCCCCC(=O)OCNC1COC1 2230a_100016991112_100009852258 [0,0,0,1,0,1|1,0,0]=3 4735 B16R1.17778 CCCCCCCC(=O)OCOC1CCC1 34a_100000748187_100009852258 [0,0,0,1,0,1|2,0,0]=4 4736 B16R1.17778 CCCCCCCC(=O)OCOC1CSC1 7a_100000072292_100009852258 [0,0,0,1,0,1|1,1,0]=4 4737 B16R1.17778 CCCCCCNC(=O)COCC1CCO1 34a_100000039022_100000230325 [0,0,0,1,0,1|2,0,0]=4 4738 B16R1.17778 CCCCCCNC(=O)COCC1COC1 34a_100000060846_100000230325 [0,0,0,1,0,1|2,0,0]=4 4739 B16R1.27123 CCCCCCCC(=O)OCNC1(CC1)C 2230a_100000757604_100009852258 [0,0,0,1,0,1|2,0,0]=4 4740 B16R1.27123 CCCCCCCC(=O)OCOC1(CC1)C 7a_100011725673_100009852258 [0,0,0,1,0,1|2,0,0]=4 4741 B16R1.40752 CCCCCCCC(=O)NC1CC(C1)CO 240690a_100000095622_100000211969 [0,0,0,1,0,1|2,0,0]=4 4742 B16R1.40752 CCCCCCCC(=O)NC1CC(C1)CO 527a_100000095622_100000211969 [0,0,0,1,0,1|2,0,0]=4 4743 B16R1.75429 CC(CO)CCNC(=O)C1CCCCCC1 240690a_106354213184_100000749507 [0,0,0,1,0,1|2,0,0]=4 4744 B16R1.75429 CC(CO)CCNC(=O)C1CCCCCC1 527a_106354213184_100000749507 [0,0,0,1,0,1|2,0,0]=4 4745 B16R1.75429 CCC(O)CNNC(=O)C1CCCCCC1 22a_100015206393_100000749507 [0,0,0,1,0,1|2,0,0]=4 4746 B16R1.75429 O=C(CNC[C@H](O)CO)N1CCCCCC1 2230a_100020644852_100000182869 [0,0,0,1,0,1|2,0,0]=4 4747 B16R1.75429 O=C(CSCC(O)CO)N1CCCCCC1 62a_100000182869_100011219619 [0,0,0,1,0,1|1,1,0]=4 4748 B16R1.75429 O=C(CSCC(O)CO)N1CCCCCC1 62a_100011219619_100000182869 [0,0,0,1,0,1|1,1,0]=4 4749 B16R1.75429 O=C(CSC[C@@H](O)CO)N1CCCCCC1 62a_100000182869_100009815848 [0,0,0,1,0,1|1,1,0]=4 4750 B16R1.75429 O=C(CSC[C@@H](O)CO)N1CCCCCC1 62a_100009815848_100000182869 [0,0,0,1,0,1|1,1,0]=4 4751 B16R1.92 CCCCCCCC(=O)C1CCCC(C1)O 1458a_100000707227_100000210614 [0,1,0,1,0,0|2,0,0]=4 4752 B16R1.92 CCCCCCCC(=O)N1CCCC(C1)O 240690a_100000211013_100000211969 [0,1,0,1,0,0|2,0,0]=4 4753 B16R1.92 CCCCCCCC(=O)N1CCCC(C1)O 527a_100000211013_100000211969 [0,1,0,1,0,0|2,0,0]=4 4754 B16R1.92 CCCCCCCC(=O)N1CCOC(C1)O 11a_100000688207_100000211969 [0,1,0,1,0,0|2,0,0]=4 4755 B16R1.92 CCCCCCCC(=O)N1CCOC(C1)O 240690a_100000688207_100000211969 [0,1,0,1,0,0|2,0,0]=4 4756 B16R1.92 CCCCCCCC(=O)N1CCOC(C1)O 527a_100000688207_100000211969 [0,1,0,1,0,0|2,0,0]=4 4757 B16R1.881 CN(CC(O)CO)C(=O)CCC1CCCC1 240690a_100011216503_100000211120 [0,1,0,1,0,0|1,0,0]=3 4758 B16R1.881 CN(CC(O)CO)C(=O)CCC1CCCC1 527a_100011216503_100000211120 [0,1,0,1,0,0|1,0,0]=3 4759 B16R1.881 CN(CC(O)CO)C(=O)CCC1CCCO1 240690a_100011216503_100011247709 [0,1,0,1,0,0|2,0,0]=4 4760 B16R1.881 CN(CC(O)CO)C(=O)CCC1CCCO1 527a_100011216503_100011247709 [0,1,0,1,0,0|2,0,0]=4 4761 B16R1.881 CN(CC(O)CO)C(=O)CCN1CCCC1 240690a_100011216503_100000738983 [0,1,0,1,0,0|2,0,0]=4 4762 B16R1.881 CN(CC(O)CO)C(=O)COC1CCCC1 240690a_100011216503_100000741352 [0,1,0,1,0,0|2,0,0]=4 4763 B16R1.881 CN(CC(O)CO)C(=O)COC1CCCC1 527a_100011216503_100000741352 [0,1,0,1,0,0|2,0,0]=4 4764 B16R1.881 CN(CC(O)CO)C(=O)NCC1CCCC1 2708a_100000737975_100011216503 [0,1,0,1,0,0|2,0,0]=4 4765 B16R1.1127 CN(CC(O)CO)C(=O)CC1CCCCC1 240690a_100011216503_100000211666 [0,1,0,1,0,0|1,0,0]=3 4766 B16R1.1127 CN(CC(O)CO)C(=O)CC1CCCCC1 527a_100011216503_100000211666 [0,1,0,1,0,0|1,0,0]=3 4767 B16R1.1127 CN(CC(O)CO)C(=O)CC1CCCCO1 240690a_100011216503_100000238585 [0,1,0,1,0,0|2,0,0]=4 4768 B16R1.1127 CN(CC(O)CO)C(=O)CC1CCCCO1 527a_100011216503_100000238585 [0,1,0,1,0,0|2,0,0]=4 4769 B16R1.1127 CN(CC(O)CO)C(=O)CC1CCCOC1 240690a_100011216503_100000741523 [0,1,0,1,0,0|2,0,0]=4 4770 B16R1.1127 CN(CC(O)CO)C(=O)CC1CCCOC1 527a_100011216503_100000741523 [0,1,0,1,0,0|2,0,0]=4 4771 B16R1.1127 CN(CC(O)CO)C(=O)CC1CCOCC1 240690a_100011216503_100000757261 [0,1,0,1,0,0|2,0,0]=4 4772 B16R1.1127 CN(CC(O)CO)C(=O)CC1CCOCC1 527a_100011216503_100000757261 [0,1,0,1,0,0|2,0,0]=4 4773 B16R1.1127 CN(CC(O)CO)C(=O)CN1CCCCC1 240690a_100011216503_100000740322 [0,1,0,1,0,0|2,0,0]=4 4774 B16R1.1127 CN(CC(O)CO)C(=O)CN1CCCCC1 527a_100011216503_100000740322 [0,1,0,1,0,0|2,0,0]=4 4775 B16R1.1127 CN(CC(O)CO)C(=O)NC1CCCCC1 2708a_100000182618_100011216503 [0,1,0,1,0,0|2,0,0]=4 4776 B16R1.5762 CCN1CCCC1C(=O)N(C)CC(O)CO 240690a_100011216503_106256033941 [0,1,0,1,0,0|2,0,0]=4 4777 B16R1.5762 CCN1CCCC1C(=O)N(C)CC(O)CO 527a_100011216503_106256033941 [0,1,0,1,0,0|2,0,0]=4 4778 B16R1.7601 CCCCCCCC(=O)N1C[C@@H]([C@H](C1)F)O 11a_100020590056_100000211969 [0,1,0,1,0,0|2,0,0]=4 4779 B16R1.7601 CCCCCCCC(=O)N1C[C@@H]([C@H](C1)F)O 240690a_100020590056_100000211969 [0,1,0,1,0,0|2,0,0]=4 4780 B16R1.7601 CCCCCCCC(=O)N1C[C@@H]([C@H](C1)F)O 527a_100020590056_100000211969 [0,1,0,1,0,0|2,0,0]=4 4781 B16R1.7601 CCCCCCCC(=O)N1C[C@H]([C@H](C1)O)C 11a_200015306588_100000211969 [0,1,0,1,0,0|2,0,0]=4 4782 B16R1.7601 CCCCCCCC(=O)N1C[C@H]([C@H](C1)O)C 240690a_200015306588_100000211969 [0,1,0,1,0,0|2,0,0]=4 4783 B16R1.7601 CCCCCCCC(=O)N1C[C@H]([C@H](C1)O)C 527a_200015306588_100000211969 [0,1,0,1,0,0|2,0,0]=4 4784 B16R1.7601 CCCCCCCC(=O)N1C[C@H]([C@H](C1)O)O 11a_100015207562_100000211969 [0,1,0,1,0,0|1,0,0]=3 4785 B16R1.7601 CCCCCCCC(=O)N1C[C@H]([C@H](C1)O)O 240690a_100015207562_100000211969 [0,1,0,1,0,0|1,0,0]=3 4786 B16R1.7601 CCCCCCCC(=O)N1C[C@H]([C@H](C1)O)O 527a_100015207562_100000211969 [0,1,0,1,0,0|1,0,0]=3 4787 B16R1.7601 CCCCCCNC(=O)N1C[C@H]([C@H](C1)O)O 2708a_100000210581_100015207562 [0,1,0,1,0,0|2,0,0]=4 4788 B16R1.7601 COCCCCCC(=O)N1C[C@H]([C@H](C1)O)O 11a_100015207562_100011935119 [0,1,0,1,0,0|2,0,0]=4 4789 B16R1.7601 COCCCCCC(=O)N1C[C@H]([C@H](C1)O)O 240690a_100015207562_100011935119 [0,1,0,1,0,0|2,0,0]=4 4790 B16R1.7601 COCCCCCC(=O)N1C[C@H]([C@H](C1)O)O 527a_100015207562_100011935119 [0,1,0,1,0,0|2,0,0]=4 4791 B16R1.7601 O=C(CCCCCCO)N1C[C@H]([C@H](C1)O)O 240690a_100015207562_100011996774 [0,1,0,1,0,0|2,0,0]=4 4792 B16R1.16913 CC1CCCCC1C(=O)N(C)CC(O)CO 240690a_100011216503_100011215568 [0,1,0,1,0,0|1,0,0]=3 4793 B16R1.16913 CC1CCCCC1C(=O)N(C)CC(O)CO 527a_100011216503_100011215568 [0,1,0,1,0,0|1,0,0]=3 4794 B16R1.16913 CN(CC(O)CO)C(=O)[C@H]1CCCCN1C 240690a_100011216503_100000767060 [0,1,0,1,0,0|2,0,0]=4 4795 B16R1.16913 CN(CC(O)CO)C(=O)[C@H]1CCCCN1C 527a_100011216503_100000767060 [0,1,0,1,0,0|2,0,0]=4 4796 B16R1.75334 CN(CC(O)CO)C(=O)C1CCCCCC1 240690a_100011216503_100000749507 [0,1,0,1,0,0|1,0,0]=3 4797 B16R1.75334 CN(CC(O)CO)C(=O)C1CCCCCC1 527a_100011216503_100000749507 [0,1,0,1,0,0|1,0,0]=3 4798 B16R1.131556 CCCCCCCC(=O)N1CC(C1)(C)CO 240690a_100015203900_100000211969 [0,1,0,1,0,0|2,0,0]=4 4799 B16R1.131556 CCCCCCCC(=O)N1CC(C1)(C)CO 527a_100015203900_100000211969 [0,1,0,1,0,0|2,0,0]=4 4800 B16R1.131556 CCCCCCCC(=O)N1CC(C1)(O)CC 11a_100015191684_100000211969 [0,1,0,1,0,0|2,0,0]=4 4801 B16R1.131556 CCCCCCCC(=O)N1CC(C1)(O)CC 1626a_100015191684_100000211969 [0,1,0,1,0,0|2,0,0]=4 4802 B16R1.131556 CCCCCCCC(=O)N1CC(C1)(O)CC 240690a_100015191684_100000211969 [0,1,0,1,0,0|2,0,0]=4 4803 B16R1.131556 CCCCCCCC(=O)N1CC(C1)(O)CC 527a_100015191684_100000211969 [0,1,0,1,0,0|2,0,0]=4 4804 B16R1.934 COCC(O)CNC(=O)CC1CCCCC1 240690a_100000756049_100000211666 [0,1,0,1,0,0|1,0,0]=3 4805 B16R1.934 COCC(O)CNC(=O)CC1CCCCC1 527a_100000756049_100000211666 [0,1,0,1,0,0|1,0,0]=3 4806 B16R1.934 COCC(O)CNC(=O)CC1CCCCO1 240690a_100000756049_100000238585 [0,1,0,1,0,0|2,0,0]=4 4807 B16R1.934 COCC(O)CNC(=O)CC1CCCCO1 527a_100000756049_100000238585 [0,1,0,1,0,0|2,0,0]=4 4808 B16R1.934 COCC(O)CNC(=O)CC1CCCOC1 240690a_100000756049_100000741523 [0,1,0,1,0,0|2,0,0]=4 4809 B16R1.934 COCC(O)CNC(=O)CC1CCCOC1 527a_100000756049_100000741523 [0,1,0,1,0,0|2,0,0]=4 4810 B16R1.934 COCC(O)CNC(=O)CC1CCOCC1 240690a_100000756049_100000757261 [0,1,0,1,0,0|2,0,0]=4 4811 B16R1.934 COCC(O)CNC(=O)CC1CCOCC1 527a_100000756049_100000757261 [0,1,0,1,0,0|2,0,0]=4 4812 B16R1.934 COCC(O)CNC(=O)CN1CCCCC1 240690a_100000756049_100000740322 [0,1,0,1,0,0|2,0,0]=4 4813 B16R1.934 COCC(O)CNC(=O)CN1CCCCC1 527a_100000756049_100000740322 [0,1,0,1,0,0|2,0,0]=4 4814 B16R1.934 COCC(O)CNC(=O)NC1CCCCC1 2708a_100000182618_100000756049 [0,1,0,1,0,0|2,0,0]=4 4815 B16R1.934 COCC(O)CNC(=O)NC1CCCCC1 273464a_100000182618_100000756049 [0,1,0,1,0,0|2,0,0]=4 4816 B16R1.934 COCC(O)CNC(=O)NC1CCCCC1 273464a_100000756049_100000182618 [0,1,0,1,0,0|2,0,0]=4 4817 B16R1.1245 CCCCCCCC(=O)CCC1CCCO1 1458a_100011247709_100000210614 [0,1,0,1,0,0|2,0,0]=4 4818 B16R1.1245 CCCCCCCC(=O)CCC1OCCO1 1458a_100000082924_100000210614 [0,1,0,1,0,0|2,0,0]=4 4819 B16R1.1245 CCCCCCCC(=O)CCC1OCCO1 1458a_100000211969_100000740749 [0,1,0,1,0,0|2,0,0]=4 4820 B16R1.1245 CCCCCCCC(=O)NCC1CCOC1 11a_100000737293_100000211969 [0,1,0,1,0,0|2,0,0]=4 4821 B16R1.1245 CCCCCCCC(=O)NCC1CCOC1 1626a_100000737293_100000211969 [0,1,0,1,0,0|2,0,0]=4 4822 B16R1.1245 CCCCCCCC(=O)NCC1CCOC1 240690a_100000737293_100000211969 [0,1,0,1,0,0|2,0,0]=4 4823 B16R1.1245 CCCCCCCC(=O)NCC1CCOC1 527a_100000737293_100000211969 [0,1,0,1,0,0|2,0,0]=4 4824 B16R1.1245 CCCCCCCC(=O)NCC1OCCO1 11a_100000036311_100000211969 [0,1,0,1,0,0|2,0,0]=4 4825 B16R1.1245 CCCCCCCC(=O)NCC1OCCO1 1626a_100000036311_100000211969 [0,1,0,1,0,0|2,0,0]=4 4826 B16R1.1245 CCCCCCCC(=O)NCC1OCCO1 527a_100000036311_100000211969 [0,1,0,1,0,0|2,0,0]=4 4827 B16R1.1245 CCCCCCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000211969 [0,1,0,1,0,0|2,0,0]=4 4828 B16R1.1245 CCCCCCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000211969 [0,1,0,1,0,0|2,0,0]=4 4829 B16R1.1245 CCCCCCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000211969 [0,1,0,1,0,0|2,0,0]=4 4830 B16R1.1245 CCCCCCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000211969 [0,1,0,1,0,0|2,0,0]=4 4831 B16R1.1245 CCCCCCCC(C)OCC1COCO1 34a_100011216627_200011218727 [0,1,0,1,0,0|1,0,1]=4 4832 B16R1.5624 COCC(O)CNC(=O)C1CCCCC1C 240690a_100000756049_100011215568 [0,1,0,1,0,0|1,0,0]=3 4833 B16R1.5624 COCC(O)CNC(=O)C1CCCCC1C 527a_100000756049_100011215568 [0,1,0,1,0,0|1,0,0]=3 4834 B16R1.5624 COCC(O)CNC(=O)N1CCCCC1C 273464a_100000756049_100000211376 [0,1,0,1,0,0|2,0,0]=4 4835 B16R1.5624 COCC(O)CNC(=O)[C@H]1CCCCN1C 240690a_100000756049_100000767060 [0,1,0,1,0,0|2,0,0]=4 4836 B16R1.5624 COCC(O)CNC(=O)[C@H]1CCCCN1C 527a_100000756049_100000767060 [0,1,0,1,0,0|2,0,0]=4 4837 B16R1.5632 CCC1CCCN1C(=O)NCC(O)COC 273464a_100000756049_100000754278 [0,1,0,1,0,0|2,0,0]=4 4838 B16R1.5632 CCN1CCCC1C(=O)NCC(O)COC 240690a_100000756049_106256033941 [0,1,0,1,0,0|2,0,0]=4 4839 B16R1.5632 CCN1CCCC1C(=O)NCC(O)COC 527a_100000756049_106256033941 [0,1,0,1,0,0|2,0,0]=4 4840 B16R1.7600 CCCCCCCC(=O)[C@@H]1C[C@H](CN1C)O 1458a_100015191551_100000210614 [0,1,0,1,0,0|2,0,0]=4 4841 B16R1.7605 CCCCCCCC(=O)N[C@H]1CCC[C@@H]1O 11a_100000748460_100000211969 [0,1,0,1,0,0|2,0,0]=4 4842 B16R1.7605 CCCCCCCC(=O)N[C@H]1CCC[C@@H]1O 240690a_100000748460_100000211969 [0,1,0,1,0,0|2,0,0]=4 4843 B16R1.7605 CCCCCCCC(=O)N[C@H]1COC[C@@H]1O 11a_100015191717_100000211969 [0,1,0,1,0,0|1,0,0]=3 4844 B16R1.7605 CCCCCCCC(=O)N[C@H]1COC[C@@H]1O 240690a_100015191717_100000211969 [0,1,0,1,0,0|1,0,0]=3 4845 B16R1.7605 CCCCCCCC(=O)N[C@H]1COC[C@@H]1O 527a_100015191717_100000211969 [0,1,0,1,0,0|1,0,0]=3 4846 B16R1.7605 CCCCCCCC(C)OC1COCC1O 34a_200011215852_200000725654 [0,1,0,1,0,0|1,0,1]=4 4847 B16R1.7605 CCCCCCCC(C)OC1COCC1O 7a_200011215852_200000725654 [0,1,0,1,0,0|1,0,1]=4 4848 B16R1.7605 CCCCCCNC(=O)N[C@H]1COC[C@@H]1O 2708a_100000210581_100015191717 [0,1,0,1,0,0|2,0,0]=4 4849 B16R1.7605 CCCCCCNC(=O)N[C@H]1COC[C@@H]1O 273464a_100000210581_100015191717 [0,1,0,1,0,0|2,0,0]=4 4850 B16R1.7605 CCCCCCNC(=O)N[C@H]1COC[C@@H]1O 273464a_100015191717_100000210581 [0,1,0,1,0,0|2,0,0]=4 4851 B16R1.7605 CCCCCCNC(=O)N[C@H]1COC[C@@H]1O 512a_100000210581_100015191717 [0,1,0,1,0,0|2,0,0]=4 4852 B16R1.7605 COCCCCCC(=O)N[C@H]1COC[C@@H]1O 11a_100015191717_100011935119 [0,1,0,1,0,0|2,0,0]=4 4853 B16R1.7605 COCCCCCC(=O)N[C@H]1COC[C@@H]1O 240690a_100015191717_100011935119 [0,1,0,1,0,0|2,0,0]=4 4854 B16R1.7605 COCCCCCC(=O)N[C@H]1COC[C@@H]1O 527a_100015191717_100011935119 [0,1,0,1,0,0|2,0,0]=4 4855 B16R1.7605 O=C(CCCCCCO)N[C@H]1COC[C@@H]1O 240690a_100015191717_100011996774 [0,1,0,1,0,0|2,0,0]=4 4856 B16R1.8578 CCCCCCCC(=O)NCC(O)C1CC1 11a_100000751198_100000211969 [0,1,0,1,0,0|2,0,0]=4 4857 B16R1.8578 CCCCCCCC(=O)NCC(O)C1CC1 240690a_100000751198_100000211969 [0,1,0,1,0,0|2,0,0]=4 4858 B16R1.8578 CCCCCCCC(=O)NCC(O)C1CC1 527a_100000751198_100000211969 [0,1,0,1,0,0|2,0,0]=4 4859 B16R1.8578 CCCCCCCC(=O)OCC(=O)C1CO1 1458a_100000701028_100009852258 [0,1,0,1,0,0|0,0,2]=4 4860 B16R1.13408 CCCCCCCC(=O)NCC1CC(C1)O 11a_100016992100_100000211969 [0,1,0,1,0,0|2,0,0]=4 4861 B16R1.13408 CCCCCCCC(=O)NCC1CC(C1)O 240690a_100016992100_100000211969 [0,1,0,1,0,0|2,0,0]=4 4862 B16R1.13408 CCCCCCCC(=O)OCN1CC(C1)O 269982a_100000749847_100009852258 [0,1,0,1,0,0|2,0,0]=4 4863 B16R1.13680 COCC(O)CNC(=O)CCC1CCCC1 240690a_100000756049_100000211120 [0,1,0,1,0,0|1,0,0]=3 4864 B16R1.13680 COCC(O)CNC(=O)CCC1CCCC1 527a_100000756049_100000211120 [0,1,0,1,0,0|1,0,0]=3 4865 B16R1.13680 COCC(O)CNC(=O)CCC1CCCO1 240690a_100000756049_100011247709 [0,1,0,1,0,0|2,0,0]=4 4866 B16R1.13680 COCC(O)CNC(=O)CCC1CCCO1 527a_100000756049_100011247709 [0,1,0,1,0,0|2,0,0]=4 4867 B16R1.13680 COCC(O)CNC(=O)CCN1CCCC1 240690a_100000756049_100000738983 [0,1,0,1,0,0|2,0,0]=4 4868 B16R1.13680 COCC(O)CNC(=O)COC1CCCC1 240690a_100000756049_100000741352 [0,1,0,1,0,0|2,0,0]=4 4869 B16R1.13680 COCC(O)CNC(=O)COC1CCCC1 527a_100000756049_100000741352 [0,1,0,1,0,0|2,0,0]=4 4870 B16R1.13680 COCC(O)CNC(=O)NCC1CCCC1 2708a_100000737975_100000756049 [0,1,0,1,0,0|2,0,0]=4 4871 B16R1.13680 COCC(O)CNC(=O)NCC1CCCC1 273464a_100000737975_100000756049 [0,1,0,1,0,0|2,0,0]=4 4872 B16R1.13680 COCC(O)CNC(=O)NCC1CCCC1 273464a_100000756049_100000737975 [0,1,0,1,0,0|2,0,0]=4 4873 B16R1.13680 COCC(O)CNC(=O)NCC1CCCC1 512a_100000737975_100000756049 [0,1,0,1,0,0|2,0,0]=4 4874 B16R1.13680 COCC(O)CNC(=O)NCC1CCCC1 512a_100000756049_100000737975 [0,1,0,1,0,0|2,0,0]=4 4875 B16R1.31952 COCC(O)CNC(=O)C1CCCCCC1 240690a_100000756049_100000749507 [0,1,0,1,0,0|1,0,0]=3 4876 B16R1.31952 COCC(O)CNC(=O)C1CCCCCC1 527a_100000756049_100000749507 [0,1,0,1,0,0|1,0,0]=3 4877 B16R1.31952 COCC(O)CNC(=O)N1CCCCCC1 273464a_100000756049_100000185865 [0,1,0,1,0,0|2,0,0]=4 4878 B16R1.40696 CCCCCCCC(=O)C1CC(C1)COC 1458a_100000138301_100000210614 [0,1,0,1,0,0|2,0,0]=4 4879 B16R1.40696 CCCCCCCC(=O)N1CC(C1)COC 11a_100016993750_100000211969 [0,1,0,1,0,0|2,0,0]=4 4880 B16R1.40696 CCCCCCCC(=O)N1CC(C1)COC 240690a_100016993750_100000211969 [0,1,0,1,0,0|2,0,0]=4 4881 B16R1.40696 CCCCCCCC(=O)N1CC(C1)COC 527a_100016993750_100000211969 [0,1,0,1,0,0|2,0,0]=4 4882 B16R1.40701 CCCCCCCC(=O)NCC1(CCC1)O 11a_100000752638_100000211969 [0,1,0,1,0,0|2,0,0]=4 4883 B16R1.40701 CCCCCCCC(=O)NCC1(CCC1)O 1626a_100000752638_100000211969 [0,1,0,1,0,0|2,0,0]=4 4884 B16R1.40701 CCCCCCCC(=O)NCC1(CCC1)O 240690a_100000752638_100000211969 [0,1,0,1,0,0|2,0,0]=4 4885 B16R1.40701 CCCCCCCC(=O)NCC1(CCC1)O 527a_100000752638_100000211969 [0,1,0,1,0,0|2,0,0]=4 4886 B16R1.40701 CCCCCCCC(=O)NCC1(COC1)C 1626a_100020631278_100000211969 [0,1,0,1,0,0|2,0,0]=4 4887 B16R1.40701 CCCCCCCC(=O)NCC1(COC1)C 527a_100020631278_100000211969 [0,1,0,1,0,0|2,0,0]=4 4888 B16R1.40701 CCCCCCCC(=O)NCC1(COC1)O 11a_100010264505_100000211969 [0,1,0,1,0,0|1,0,0]=3 4889 B16R1.40701 CCCCCCCC(=O)NCC1(COC1)O 240690a_100010264505_100000211969 [0,1,0,1,0,0|1,0,0]=3 4890 B16R1.40701 CCCCCCCC(=O)NCC1(COC1)O 527a_100010264505_100000211969 [0,1,0,1,0,0|1,0,0]=3 4891 B16R1.40701 CCCCCCNC(=O)NCC1(COC1)O 2708a_100000210581_100010264505 [0,1,0,1,0,0|2,0,0]=4 4892 B16R1.40701 CCCCCCNC(=O)NCC1(COC1)O 2708a_100010264505_100000210581 [0,1,0,1,0,0|2,0,0]=4 4893 B16R1.40701 CCCCCCNC(=O)NCC1(COC1)O 273464a_100000210581_100010264505 [0,1,0,1,0,0|2,0,0]=4 4894 B16R1.40701 CCCCCCNC(=O)NCC1(COC1)O 273464a_100010264505_100000210581 [0,1,0,1,0,0|2,0,0]=4 4895 B16R1.40701 CCCCCCNC(=O)NCC1(COC1)O 512a_100000210581_100010264505 [0,1,0,1,0,0|2,0,0]=4 4896 B16R1.40701 CCCCCCNC(=O)NCC1(COC1)O 512a_100010264505_100000210581 [0,1,0,1,0,0|2,0,0]=4 4897 B16R1.40701 COCCCCCC(=O)NCC1(COC1)O 11a_100010264505_100011935119 [0,1,0,1,0,0|2,0,0]=4 4898 B16R1.40701 COCCCCCC(=O)NCC1(COC1)O 240690a_100010264505_100011935119 [0,1,0,1,0,0|2,0,0]=4 4899 B16R1.40701 COCCCCCC(=O)NCC1(COC1)O 527a_100010264505_100011935119 [0,1,0,1,0,0|2,0,0]=4 4900 B16R1.40701 O=C(CCCCCCO)NCC1(COC1)O 240690a_100010264505_100011996774 [0,1,0,1,0,0|2,0,0]=4 4901 B16R1.4132 CC(C)C(O)CNC(=O)CC1CCCCC1 11a_100000759067_100000211666 [0,1,0,1,0,0|2,0,0]=4 4902 B16R1.4132 CC(C)C(O)CNC(=O)CC1CCCCC1 240690a_100000759067_100000211666 [0,1,0,1,0,0|2,0,0]=4 4903 B16R1.4132 CC(C)C(O)CNC(=O)CC1CCCCC1 527a_100000759067_100000211666 [0,1,0,1,0,0|2,0,0]=4 4904 B16R1.10819 CC(C)C(O)CNC(=O)C1CCCCC1C 11a_100000759067_100011215568 [0,1,0,1,0,0|2,0,0]=4 4905 B16R1.10819 CC(C)C(O)CNC(=O)C1CCCCC1C 240690a_100000759067_100011215568 [0,1,0,1,0,0|2,0,0]=4 4906 B16R1.10819 CC(C)C(O)CNC(=O)C1CCCCC1C 527a_100000759067_100011215568 [0,1,0,1,0,0|2,0,0]=4 4907 B16R1.12543 CC(C)C(O)CNC(=O)CCC1CCCC1 11a_100000759067_100000211120 [0,1,0,1,0,0|2,0,0]=4 4908 B16R1.12543 CC(C)C(O)CNC(=O)CCC1CCCC1 240690a_100000759067_100000211120 [0,1,0,1,0,0|2,0,0]=4 4909 B16R1.12543 CC(C)C(O)CNC(=O)CCC1CCCC1 527a_100000759067_100000211120 [0,1,0,1,0,0|2,0,0]=4 4910 B16R1.58012 CC(C)C(O)CNC(=O)C1CCCCCC1 11a_100000759067_100000749507 [0,1,0,1,0,0|2,0,0]=4 4911 B16R1.58012 CC(C)C(O)CNC(=O)C1CCCCCC1 240690a_100000759067_100000749507 [0,1,0,1,0,0|2,0,0]=4 4912 B16R1.58012 CC(C)C(O)CNC(=O)C1CCCCCC1 527a_100000759067_100000749507 [0,1,0,1,0,0|2,0,0]=4 4913 B16R1.1148 CC(CO)CNC(=O)CC1CCCC(C1)C 240690a_100000744482_100000748788 [0,1,0,1,0,0|2,0,0]=4 4914 B16R1.1148 CC(CO)CNC(=O)CC1CCCC(C1)C 527a_100000744482_100000748788 [0,1,0,1,0,0|2,0,0]=4 4915 B16R1.1148 CC1CCCC(C1)CC(=O)NC[C@@H](F)CO 240690a_100015665980_100000748788 [0,1,0,1,0,0|2,0,0]=4 4916 B16R1.1148 CC1CCCC(C1)CC(=O)NC[C@@H](F)CO 527a_100015665980_100000748788 [0,1,0,1,0,0|2,0,0]=4 4917 B16R1.1148 CC1CCCC(C1)CC(=O)NC[C@H](O)CO 240690a_100020644852_100000748788 [0,1,0,1,0,0|1,0,0]=3 4918 B16R1.1148 CC1CCCC(C1)CC(=O)NC[C@H](O)CO 527a_100020644852_100000748788 [0,1,0,1,0,0|1,0,0]=3 4919 B16R1.1148 CC1CCCC(C1)NC(=O)NC[C@H](O)CO 2708a_100011194320_100020644852 [0,1,0,1,0,0|2,0,0]=4 4920 B16R1.1148 CC1CCCC(C1)NC(=O)NC[C@H](O)CO 273464a_100011194320_100020644852 [0,1,0,1,0,0|2,0,0]=4 4921 B16R1.1148 CC1CCCC(C1)NC(=O)NC[C@H](O)CO 273464a_100020644852_100011194320 [0,1,0,1,0,0|2,0,0]=4 4922 B16R1.1148 CCC(O)CNC(=O)CC1CCCC(C1)C 11a_100011218483_100000748788 [0,1,0,1,0,0|2,0,0]=4 4923 B16R1.1148 CCC(O)CNC(=O)CC1CCCC(C1)C 240690a_100011218483_100000748788 [0,1,0,1,0,0|2,0,0]=4 4924 B16R1.1148 CCC(O)CNC(=O)CC1CCCC(C1)C 527a_100011218483_100000748788 [0,1,0,1,0,0|2,0,0]=4 4925 B16R1.1148 C[C@H]1CCCN(C1)CC(=O)NCC(O)CO 2230a_100000717927_200012027429 [0,1,0,1,0,0|2,0,0]=4 4926 B16R1.1148 C[C@H]1CCCN(C1)CC(=O)NCC(O)CO 269982a_100000717927_200012027429 [0,1,0,1,0,0|2,0,0]=4 4927 B16R1.1148 C[C@H]1CCCN(C1)CC(=O)NCC(O)CO 34a_100000717927_200012027429 [0,1,0,1,0,0|2,0,0]=4 4928 B16R1.1148 O=C(CN1CCCC(C1)F)NCC(O)CO 2230a_100000697950_200012027429 [0,1,0,1,0,0|2,0,0]=4 4929 B16R1.1148 O=C(CN1CCCC(C1)F)NCC(O)CO 269982a_100000697950_200012027429 [0,1,0,1,0,0|2,0,0]=4 4930 B16R1.1148 O=C(CN1CCCC(C1)F)NCC(O)CO 34a_100000697950_200012027429 [0,1,0,1,0,0|2,0,0]=4 4931 B16R1.1148 O=C(CN1CCCC(C1)O)NCC(O)CO 2230a_100000211013_200012027429 [0,1,0,1,0,0|2,0,0]=4 4932 B16R1.1148 O=C(CN1CCCC(C1)O)NCC(O)CO 269982a_100000211013_200012027429 [0,1,0,1,0,0|2,0,0]=4 4933 B16R1.1342 CC1CCC(C1)OCC(=O)NCC(O)CO 34a_100000698185_200012027429 [0,1,0,1,0,0|2,0,0]=4 4934 B16R1.6895 CC(C)CCCCCC(=O)C1CCC(C1)O 1458a_100000688591_100000210682 [0,1,0,1,0,0|2,0,0]=4 4935 B16R1.6895 CC(C)CCCCCC(=O)N1CCC(C1)O 240690a_100011215560_100000766313 [0,1,0,1,0,0|2,0,0]=4 4936 B16R1.6895 CC(C)CCCCCC(=O)N1CCC(C1)O 527a_100011215560_100000766313 [0,1,0,1,0,0|2,0,0]=4 4937 B16R1.7447 O=C(COCCNC1CC1)NCC(O)CO 34a_100000738766_200012027429 [0,1,0,1,0,0|2,0,0]=4 4938 B16R1.7447 O=C(CSCCCC1CO1)NCC(O)CO 62a_100000733510_200012027429 [0,1,0,1,0,0|2,0,0]=4 4939 B16R1.7447 O=C(CSCCCC1CO1)NCC(O)CO 62a_200012027429_100000733510 [0,1,0,1,0,0|2,0,0]=4 4940 B16R1.7455 CC(C)C1CCCN1C(=O)NC[C@H](O)CO 273464a_100020644852_100000762757 [0,1,0,1,0,0|2,0,0]=4 4941 B16R1.7455 CC(C)N1CCC[C@@H]1C(=O)NC[C@H](O)CO 240690a_100020644852_100009927065 [0,1,0,1,0,0|2,0,0]=4 4942 B16R1.7455 CC(C)N1CCC[C@@H]1C(=O)NC[C@H](O)CO 527a_100020644852_100009927065 [0,1,0,1,0,0|2,0,0]=4 4943 B16R1.8973 CC(C)CCCCCC(=O)N1C[C@@H]([C@@H]1C)O 11a_206633788156_100000766313 [0,1,0,1,0,0|2,0,0]=4 4944 B16R1.8973 CC(C)CCCCCC(=O)N1C[C@@H]([C@@H]1C)O 240690a_206633788156_100000766313 [0,1,0,1,0,0|2,0,0]=4 4945 B16R1.8973 CC(C)CCCCCC(=O)N1C[C@@H]([C@@H]1C)O 527a_206633788156_100000766313 [0,1,0,1,0,0|2,0,0]=4 4946 B16R1.17037 CC1(CCCN1CC(=O)NCC(O)CO)C 2230a_100000761399_200012027429 [0,1,0,1,0,0|2,0,0]=4 4947 B16R1.17037 CC1(CCCN1CC(=O)NCC(O)CO)C 269982a_100000761399_200012027429 [0,1,0,1,0,0|2,0,0]=4 4948 B16R1.17037 CC1(CCCN1CC(=O)NCC(O)CO)C 34a_100000761399_200012027429 [0,1,0,1,0,0|2,0,0]=4 4949 B16R1.18163 CC(C)CCCCCC(=O)NCC1COC1 11a_100015281925_100000766313 [0,1,0,1,0,0|2,0,0]=4 4950 B16R1.18163 CC(C)CCCCCC(=O)NCC1COC1 1626a_100015281925_100000766313 [0,1,0,1,0,0|2,0,0]=4 4951 B16R1.18163 CC(C)CCCCCC(=O)NCC1COC1 240690a_100015281925_100000766313 [0,1,0,1,0,0|2,0,0]=4 4952 B16R1.18163 CC(C)CCCCCC(=O)NCC1COC1 527a_100015281925_100000766313 [0,1,0,1,0,0|2,0,0]=4 4953 B16R1.18163 CC(C)CCCCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000766313 [0,1,0,1,0,0|2,0,0]=4 4954 B16R1.18163 CC(C)CCCCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000766313 [0,1,0,1,0,0|2,0,0]=4 4955 B16R1.18163 CC(C)CCCCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000766313 [0,1,0,1,0,0|2,0,0]=4 4956 B16R1.18163 CC(C)CCCCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000766313 [0,1,0,1,0,0|2,0,0]=4 4957 B16R1.18486 O=C(COCC1CC(C1)Cl)NCC(O)CO 34a_100009874164_200012027429 [0,1,0,1,0,0|2,0,0]=4 4958 B16R1.19642 CC(C)CCCCCC(=O)C1CC(C1)CO 1458a_206645079618_100000210682 [0,1,0,1,0,0|2,0,0]=4 4959 B16R1.19642 CC(C)CCCCCC(=O)N1CC(C1)CO 240690a_100016987283_100000766313 [0,1,0,1,0,0|2,0,0]=4 4960 B16R1.19642 CC(C)CCCCCC(=O)N1CC(C1)CO 527a_100016987283_100000766313 [0,1,0,1,0,0|2,0,0]=4 4961 B16R1.40118 O=C(NC[C@H](O)CO)N1CCCCC(C1)O 273464a_100020644852_100025706797 [0,1,0,1,0,0|2,0,0]=4 4962 B16R1.40796 CC(C)CCCCCC(=O)NCC1(CC1)O 11a_100011936951_100000766313 [0,1,0,1,0,0|2,0,0]=4 4963 B16R1.40796 CC(C)CCCCCC(=O)NCC1(CC1)O 240690a_100011936951_100000766313 [0,1,0,1,0,0|2,0,0]=4 4964 B16R1.40796 CC(C)CCCCCC(=O)NCC1(CC1)O 527a_100011936951_100000766313 [0,1,0,1,0,0|2,0,0]=4 4965 B16R1.75592 CC1(CC1COCC(=O)NCC(O)CO)C 34a_100000728257_200012027429 [0,1,0,1,0,0|2,0,0]=4 4966 B16R1.75592 CC1(CC1COCC(=O)NCC(O)CO)C 7a_100000728257_200012027429 [0,1,0,1,0,0|2,0,0]=4 4967 B16R1.1147 CC(CO)CNC(=O)CC1CCC(CC1)O 240690a_100000744482_100012184027 [0,1,0,1,0,0|2,0,0]=4 4968 B16R1.1147 CC(CO)CNC(=O)CC1CCC(CC1)O 527a_100000744482_100012184027 [0,1,0,1,0,0|2,0,0]=4 4969 B16R1.1147 CC1CCC(CC1)CC(=O)NCC(C)CO 240690a_100000744482_100011215564 [0,1,0,1,0,0|2,0,0]=4 4970 B16R1.1147 CC1CCC(CC1)CC(=O)NCC(C)CO 527a_100000744482_100011215564 [0,1,0,1,0,0|2,0,0]=4 4971 B16R1.1147 CC1CCC(CC1)CC(=O)NC[C@@H](F)CO 240690a_100015665980_100011215564 [0,1,0,1,0,0|2,0,0]=4 4972 B16R1.1147 CC1CCC(CC1)CC(=O)NC[C@@H](F)CO 527a_100015665980_100011215564 [0,1,0,1,0,0|2,0,0]=4 4973 B16R1.1147 CC1CCC(CC1)CC(=O)NC[C@H](O)CO 240690a_100020644852_100011215564 [0,1,0,1,0,0|1,0,0]=3 4974 B16R1.1147 CC1CCC(CC1)CC(=O)NC[C@H](O)CO 527a_100020644852_100011215564 [0,1,0,1,0,0|1,0,0]=3 4975 B16R1.1147 CC1CCN(CC1)CC(=O)NCC(O)CO 2230a_100000188429_200012027429 [0,1,0,1,0,0|2,0,0]=4 4976 B16R1.1147 CC1CCN(CC1)CC(=O)NCC(O)CO 269982a_100000188429_200012027429 [0,1,0,1,0,0|2,0,0]=4 4977 B16R1.1147 CC1CCN(CC1)CC(=O)NCC(O)CO 34a_100000188429_200012027429 [0,1,0,1,0,0|2,0,0]=4 4978 B16R1.1147 CC1CCN(CC1)CC(=O)NC[C@H](O)CO 240690a_100020644852_100000238061 [0,1,0,1,0,0|2,0,0]=4 4979 B16R1.1147 CC1CCN(CC1)CC(=O)NC[C@H](O)CO 527a_100020644852_100000238061 [0,1,0,1,0,0|2,0,0]=4 4980 B16R1.1147 CCC(O)CNC(=O)CC1CCC(CC1)C 11a_100011218483_100011215564 [0,1,0,1,0,0|2,0,0]=4 4981 B16R1.1147 CCC(O)CNC(=O)CC1CCC(CC1)C 240690a_100011218483_100011215564 [0,1,0,1,0,0|2,0,0]=4 4982 B16R1.1147 CCC(O)CNC(=O)CC1CCC(CC1)C 527a_100011218483_100011215564 [0,1,0,1,0,0|2,0,0]=4 4983 B16R1.1147 CCC(O)CNC(=O)CC1CCC(CC1)O 240690a_100011218483_100012184027 [0,1,0,1,0,0|2,0,0]=4 4984 B16R1.1147 CCC(O)CNC(=O)CC1CCC(CC1)O 527a_100011218483_100012184027 [0,1,0,1,0,0|2,0,0]=4 4985 B16R1.1147 CN1CCC(CC1)CC(=O)NC[C@H](O)CO 240690a_100020644852_100000700355 [0,1,0,1,0,0|2,0,0]=4 4986 B16R1.1147 C[C@H]1CC[C@@H](CC1)NC(=O)NC[C@H](O)CO 2708a_100020625639_100020644852 [0,1,0,1,0,0|2,0,0]=4 4987 B16R1.1147 C[C@H]1CC[C@@H](CC1)NC(=O)NC[C@H](O)CO 273464a_100020625639_100020644852 [0,1,0,1,0,0|2,0,0]=4 4988 B16R1.1147 C[C@H]1CC[C@@H](CC1)NC(=O)NC[C@H](O)CO 273464a_100020644852_100020625639 [0,1,0,1,0,0|2,0,0]=4 4989 B16R1.1147 O=C(CC1CCC(CC1)O)NC[C@@H](F)CO 240690a_100015665980_100012184027 [0,1,0,1,0,0|2,0,0]=4 4990 B16R1.1147 O=C(CC1CCC(CC1)O)NC[C@@H](F)CO 527a_100015665980_100012184027 [0,1,0,1,0,0|2,0,0]=4 4991 B16R1.1147 O=C(CC1CCC(CC1)O)NC[C@H](O)CO 240690a_100020644852_100012184027 [0,1,0,1,0,0|1,0,0]=3 4992 B16R1.1147 O=C(CC1CCC(CC1)O)NC[C@H](O)CO 527a_100020644852_100012184027 [0,1,0,1,0,0|1,0,0]=3 4993 B16R1.1147 O=C(CN1CCC(CC1)F)NCC(O)CO 2230a_100015193889_200012027429 [0,1,0,1,0,0|2,0,0]=4 4994 B16R1.1147 O=C(CN1CCC(CC1)F)NCC(O)CO 269982a_100015193889_200012027429 [0,1,0,1,0,0|2,0,0]=4 4995 B16R1.1147 O=C(CN1CCC(CC1)F)NCC(O)CO 34a_100015193889_200012027429 [0,1,0,1,0,0|2,0,0]=4 4996 B16R1.1147 O=C(CN1CCC(CC1)O)NCC(O)CO 2230a_100025773856_200012027429 [0,1,0,1,0,0|2,0,0]=4 4997 B16R1.1147 O=C(CN1CCC(CC1)O)NCC(O)CO 269982a_100025773856_200012027429 [0,1,0,1,0,0|2,0,0]=4 4998 B16R1.7443 O=C(COCCC1COC1)NCC(O)CO 34a_100009855314_200012027429 [0,1,0,1,0,0|2,0,0]=4 4999 B16R1.19730 CCN1CCCC(C1)C(=O)NC[C@H](O)CO 240690a_100020644852_100000743261 [0,1,0,1,0,0|2,0,0]=4 5000 B16R1.19730 CCN1CCCC(C1)C(=O)NC[C@H](O)CO 527a_100020644852_100000743261 [0,1,0,1,0,0|2,0,0]=4 5001 B16R1.19730 COC1CCCC(C1)C(=O)NC[C@H](O)CO 240690a_100020644852_100011215561 [0,1,0,1,0,0|2,0,0]=4 5002 B16R1.19730 COC1CCCC(C1)C(=O)NC[C@H](O)CO 527a_100020644852_100011215561 [0,1,0,1,0,0|2,0,0]=4 5003 B16R1.40119 CC1CCCN(CC1)C(=O)NC[C@H](O)CO 273464a_100020644852_100025706717 [0,1,0,1,0,0|2,0,0]=4 5004 B16R1.40119 O=C(NC[C@H](O)CO)N1CCCC(CC1)O 273464a_100020644852_100015186869 [0,1,0,1,0,0|2,0,0]=4 5005 B16R1.560 CCC(CNC(=O)CC1CCCCC1)OC 11a_100000731041_100000211666 [0,1,0,1,0,0|2,0,0]=4 5006 B16R1.560 CCC(CNC(=O)CC1CCCCC1)OC 1626a_100000731041_100000211666 [0,1,0,1,0,0|2,0,0]=4 5007 B16R1.560 CCC(CNC(=O)CC1CCCCC1)OC 240690a_100000731041_100000211666 [0,1,0,1,0,0|2,0,0]=4 5008 B16R1.560 CCC(CNC(=O)CC1CCCCC1)OC 527a_100000731041_100000211666 [0,1,0,1,0,0|2,0,0]=4 5009 B16R1.14125 CCC(CNC(=O)CCC1CCCC1)OC 11a_100000731041_100000211120 [0,1,0,1,0,0|2,0,0]=4 5010 B16R1.14125 CCC(CNC(=O)CCC1CCCC1)OC 1626a_100000731041_100000211120 [0,1,0,1,0,0|2,0,0]=4 5011 B16R1.14125 CCC(CNC(=O)CCC1CCCC1)OC 240690a_100000731041_100000211120 [0,1,0,1,0,0|2,0,0]=4 5012 B16R1.14125 CCC(CNC(=O)CCC1CCCC1)OC 527a_100000731041_100000211120 [0,1,0,1,0,0|2,0,0]=4 5013 B16R1.14189 CCC(CNC(=O)C1CCCCC1C)OC 11a_100000731041_100011215568 [0,1,0,1,0,0|2,0,0]=4 5014 B16R1.14189 CCC(CNC(=O)C1CCCCC1C)OC 1626a_100000731041_100011215568 [0,1,0,1,0,0|2,0,0]=4 5015 B16R1.14189 CCC(CNC(=O)C1CCCCC1C)OC 240690a_100000731041_100011215568 [0,1,0,1,0,0|2,0,0]=4 5016 B16R1.14189 CCC(CNC(=O)C1CCCCC1C)OC 527a_100000731041_100011215568 [0,1,0,1,0,0|2,0,0]=4 5017 B16R1.67102 CCC(CNC(=O)C1CCCCCC1)OC 11a_100000731041_100000749507 [0,1,0,1,0,0|2,0,0]=4 5018 B16R1.67102 CCC(CNC(=O)C1CCCCCC1)OC 1626a_100000731041_100000749507 [0,1,0,1,0,0|2,0,0]=4 5019 B16R1.67102 CCC(CNC(=O)C1CCCCCC1)OC 240690a_100000731041_100000749507 [0,1,0,1,0,0|2,0,0]=4 5020 B16R1.67102 CCC(CNC(=O)C1CCCCCC1)OC 527a_100000731041_100000749507 [0,1,0,1,0,0|2,0,0]=4 5021 B16R1.79295 CCCCCCCC(=O)NCC1(CC1)CO 240690a_100000757901_100000211969 [0,1,0,1,0,0|2,0,0]=4 5022 B16R1.79295 CCCCCCCC(=O)NCC1(CC1)CO 527a_100000757901_100000211969 [0,1,0,1,0,0|2,0,0]=4 5023 B16R1.704 CCCCCCC(C)C(=O)C1CCC(C1)O 1458a_100000688591_100011215978 [0,1,0,1,0,0|2,0,0]=4 5024 B16R1.704 CCCCCCC(O)C(=O)N1CCC(C1)O 240690a_100011215560_100011215828 [0,1,0,1,0,0|2,0,0]=4 5025 B16R1.2925 CC(C(=O)NC[C@@H](F)CO)C1CCCCC1 240690a_100015665980_100011435303 [0,1,0,1,0,0|2,0,0]=4 5026 B16R1.2925 CC(C(=O)NC[C@@H](F)CO)C1CCCCC1 527a_100015665980_100011435303 [0,1,0,1,0,0|2,0,0]=4 5027 B16R1.2925 CC(C(=O)NC[C@H](O)CO)C1CCCCC1 240690a_100020644852_100011435303 [0,1,0,1,0,0|1,0,0]=3 5028 B16R1.2925 CC(C(=O)NC[C@H](O)CO)C1CCCCC1 527a_100020644852_100011435303 [0,1,0,1,0,0|1,0,0]=3 5029 B16R1.2925 CC(CO)CNC(=O)C(C)C1CCCCC1 240690a_100000744482_100011435303 [0,1,0,1,0,0|2,0,0]=4 5030 B16R1.2925 CC(CO)CNC(=O)C(C)C1CCCCC1 527a_100000744482_100011435303 [0,1,0,1,0,0|2,0,0]=4 5031 B16R1.2925 CC(CO)CNC(=O)C(O)C1CCCCC1 240690a_100000744482_100000242593 [0,1,0,1,0,0|2,0,0]=4 5032 B16R1.2925 CCC(O)CNC(=O)C(C)C1CCCCC1 11a_100011218483_100011435303 [0,1,0,1,0,0|2,0,0]=4 5033 B16R1.2925 CCC(O)CNC(=O)C(C)C1CCCCC1 240690a_100011218483_100011435303 [0,1,0,1,0,0|2,0,0]=4 5034 B16R1.2925 CCC(O)CNC(=O)C(C)C1CCCCC1 527a_100011218483_100011435303 [0,1,0,1,0,0|2,0,0]=4 5035 B16R1.2925 CCC(O)CNC(=O)C(O)C1CCCCC1 240690a_100011218483_100000242593 [0,1,0,1,0,0|2,0,0]=4 5036 B16R1.2925 CN(C(=O)NC[C@H](O)CO)C1CCCCC1 273464a_100020644852_100000207522 [0,1,0,1,0,0|2,0,0]=4 5037 B16R1.2925 O=C(NC[C@@H](F)CO)C(O)C1CCCCC1 240690a_100015665980_100000242593 [0,1,0,1,0,0|2,0,0]=4 5038 B16R1.2925 O=C(NC[C@H](O)CO)C(O)C1CCCCC1 240690a_100020644852_100000242593 [0,1,0,1,0,0|1,0,0]=3 5039 B16R1.20330 CCCCCCC(O)C(=O)NCC1COC1 240690a_100015281925_100011215828 [0,1,0,1,0,0|2,0,0]=4 5040 B16R1.20330 CCCCCCC(O)C(=O)NC[C@@H]1CCO1 240690a_100020831831_100011215828 [0,1,0,1,0,0|2,0,0]=4 5041 B16R1.26677 CCCCCCC(O)C(=O)NCC1(CC1)O 240690a_100011936951_100011215828 [0,1,0,1,0,0|2,0,0]=4 5042 B16R1.40120 CC(CO)CNC(=O)N1CCCCCCC1 273464a_100000744482_100000211400 [0,1,0,1,0,0|2,0,0]=4 5043 B16R1.40120 CCC(O)CCC(=O)N1CCCCCCC1 1626a_100000211400_203496584001 [0,1,0,1,0,0|2,0,0]=4 5044 B16R1.40120 CCC(O)CCC(=O)N1CCCCCCC1 240690a_100000211400_203496584001 [0,1,0,1,0,0|2,0,0]=4 5045 B16R1.40120 CCC(O)CNC(=O)N1CCCCCCC1 273464a_100011218483_100000211400 [0,1,0,1,0,0|2,0,0]=4 5046 B16R1.40120 O=C(NC[C@@H](F)CO)N1CCCCCCC1 273464a_100015665980_100000211400 [0,1,0,1,0,0|2,0,0]=4 5047 B16R1.40120 O=C(NC[C@H](O)CO)N1CCCCCCC1 273464a_100020644852_100000211400 [0,1,0,1,0,0|1,0,0]=3 5048 B16R1.64168 CCCCCCC(O)C(=O)N1C[C@@H]([C@@H]1C)O 240690a_206633788156_100011215828 [0,1,0,1,0,0|2,0,0]=4 5049 B16R1.64170 CCCCCCC(C)C(=O)C1CC(C1)CO 1458a_206645079618_100011215978 [0,1,0,1,0,0|2,0,0]=4 5050 B16R1.64170 CCCCCCC(O)C(=O)N1CC(C1)CO 240690a_100016987283_100011215828 [0,1,0,1,0,0|2,0,0]=4 5051 B16R1.71 CCCCC1CCC(CC1)OCC(O)CO 34a_200000035503_100011219619 [0,1,0,1,0,0|1,0,1]=4 5052 B16R1.71 CCCCC1CCC(CC1)OCC(O)CO 7a_200000035503_100011219619 [0,1,0,1,0,0|1,0,1]=4 5053 B16R1.71 CCCCC1CCC(CC1)OC[C@@H](O)CO 34a_200000035503_100009815848 [0,1,0,1,0,0|1,0,1]=4 5054 B16R1.71 CCCCC1CCC(CC1)OC[C@@H](O)CO 7a_200000035503_100009815848 [0,1,0,1,0,0|1,0,1]=4 5055 B16R1.63 CCCCCCCCC(=O)C1CCC(C1)O 1458a_100000688591_100000210759 [0,1,0,1,0,0|2,0,0]=4 5056 B16R1.63 CCCCCCCCC(=O)N1CCC(C1)O 240690a_100011215560_100000210188 [0,1,0,1,0,0|2,0,0]=4 5057 B16R1.63 CCCCCCCCC(=O)N1CCC(C1)O 527a_100011215560_100000210188 [0,1,0,1,0,0|2,0,0]=4 5058 B16R1.63 CCCCCCCNC(=O)C1CCC(C1)O 1626a_100000229938_100000688591 [0,1,0,1,0,0|2,0,0]=4 5059 B16R1.63 CCCCCCCNC(=O)C1CCC(C1)O 240690a_100000229938_100000688591 [0,1,0,1,0,0|2,0,0]=4 5060 B16R1.63 CCCCCCCNC(=O)N1CCC(C1)O 2708a_100000229938_100011215560 [0,1,0,1,0,0|2,0,0]=4 5061 B16R1.63 CCCCCCCNC(=O)N1CCC(C1)O 273464a_100000229938_100011215560 [0,1,0,1,0,0|2,0,0]=4 5062 B16R1.63 COCCCCCCC(=O)C1CCC(C1)O 1458a_100000688591_100011998445 [0,1,0,1,0,0|2,0,0]=4 5063 B16R1.63 O=C(CCCCCCCO)C1CCC(C1)O 1458a_100000688591_100000760002 [0,1,0,1,0,0|2,0,0]=4 5064 B16R1.63 O=C(CCCCCCCO)N1CCC(C1)O 240690a_100011215560_100011219782 [0,1,0,1,0,0|2,0,0]=4 5065 B16R1.1343 CC(CNC1CCCCC1)OCC(O)CO 34a_100000202029_100011219619 [0,1,0,1,0,0|1,0,1]=4 5066 B16R1.1343 CC(CNC1CCCCC1)OC[C@@H](O)CO 34a_100000202029_100009815848 [0,1,0,1,0,0|1,0,1]=4 5067 B16R1.1343 CC(CO)CNC(=O)CCC1CCCCC1 240690a_100000744482_100000211375 [0,1,0,1,0,0|2,0,0]=4 5068 B16R1.1343 CC(CO)CNC(=O)CCC1CCCCC1 527a_100000744482_100000211375 [0,1,0,1,0,0|2,0,0]=4 5069 B16R1.1343 CC(CO)CNC(=O)CCN1CCCCC1 240690a_100000744482_100000743487 [0,1,0,1,0,0|2,0,0]=4 5070 B16R1.1343 CC(CO)CNC(=O)COC1CCCCC1 240690a_100000744482_100011223303 [0,1,0,1,0,0|2,0,0]=4 5071 B16R1.1343 CC(CO)CNC(=O)COC1CCCCC1 527a_100000744482_100011223303 [0,1,0,1,0,0|2,0,0]=4 5072 B16R1.1343 CC(CO)CNC(=O)NCC1CCCCC1 2708a_100000210473_100000744482 [0,1,0,1,0,0|2,0,0]=4 5073 B16R1.1343 CC(CO)CNC(=O)NCC1CCCCC1 273464a_100000210473_100000744482 [0,1,0,1,0,0|2,0,0]=4 5074 B16R1.1343 CC(CO)CNC(=O)NCC1CCCCC1 273464a_100000744482_100000210473 [0,1,0,1,0,0|2,0,0]=4 5075 B16R1.1343 CC(CO)CNC(=O)NCC1CCCCC1 512a_100000744482_100000210473 [0,1,0,1,0,0|2,0,0]=4 5076 B16R1.1343 CCC(O)CCC(=O)NCC1CCCCC1 1626a_100000210473_203496584001 [0,1,0,1,0,0|2,0,0]=4 5077 B16R1.1343 CCC(O)CCC(=O)NCC1CCCCC1 240690a_100000210473_203496584001 [0,1,0,1,0,0|2,0,0]=4 5078 B16R1.1343 CCC(O)CNC(=O)CCC1CCCCC1 11a_100011218483_100000211375 [0,1,0,1,0,0|2,0,0]=4 5079 B16R1.1343 CCC(O)CNC(=O)CCC1CCCCC1 240690a_100011218483_100000211375 [0,1,0,1,0,0|2,0,0]=4 5080 B16R1.1343 CCC(O)CNC(=O)CCC1CCCCC1 527a_100011218483_100000211375 [0,1,0,1,0,0|2,0,0]=4 5081 B16R1.1343 CCC(O)CNC(=O)CCN1CCCCC1 240690a_100011218483_100000743487 [0,1,0,1,0,0|2,0,0]=4 5082 B16R1.1343 CCC(O)CNC(=O)COC1CCCCC1 11a_100011218483_100011223303 [0,1,0,1,0,0|2,0,0]=4 5083 B16R1.1343 CCC(O)CNC(=O)COC1CCCCC1 240690a_100011218483_100011223303 [0,1,0,1,0,0|2,0,0]=4 5084 B16R1.1343 CCC(O)CNC(=O)COC1CCCCC1 527a_100011218483_100011223303 [0,1,0,1,0,0|2,0,0]=4 5085 B16R1.1343 CCC(O)CNC(=O)NCC1CCCCC1 2708a_100000210473_100011218483 [0,1,0,1,0,0|2,0,0]=4 5086 B16R1.1343 CCC(O)CNC(=O)NCC1CCCCC1 273464a_100000210473_100011218483 [0,1,0,1,0,0|2,0,0]=4 5087 B16R1.1343 CCC(O)CNC(=O)NCC1CCCCC1 273464a_100011218483_100000210473 [0,1,0,1,0,0|2,0,0]=4 5088 B16R1.1343 CCC(O)CNC(=O)NCC1CCCCC1 512a_100011218483_100000210473 [0,1,0,1,0,0|2,0,0]=4 5089 B16R1.1343 O=C(C=CC1CCCCC1)NC[C@H](O)CO 240690a_100020644852_100102566626 [0,1,0,1,0,0|1,0,1]=4 5090 B16R1.1343 O=C(CCC1CCCCC1)NC[C@@H](F)CO 240690a_100015665980_100000211375 [0,1,0,1,0,0|2,0,0]=4 5091 B16R1.1343 O=C(CCC1CCCCC1)NC[C@@H](F)CO 527a_100015665980_100000211375 [0,1,0,1,0,0|2,0,0]=4 5092 B16R1.1343 O=C(CCC1CCCCC1)NC[C@H](O)CO 240690a_100020644852_100000211375 [0,1,0,1,0,0|1,0,0]=3 5093 B16R1.1343 O=C(CCC1CCCCC1)NC[C@H](O)CO 527a_100020644852_100000211375 [0,1,0,1,0,0|1,0,0]=3 5094 B16R1.1343 O=C(CCN1CCCCC1)NC[C@@H](F)CO 240690a_100015665980_100000743487 [0,1,0,1,0,0|2,0,0]=4 5095 B16R1.1343 O=C(CCN1CCCCC1)NC[C@H](O)CO 240690a_100020644852_100000743487 [0,1,0,1,0,0|1,0,0]=3 5096 B16R1.1343 O=C(CCN1CCCCO1)NC[C@H](O)CO 240690a_100020644852_200015184090 [0,1,0,1,0,0|2,0,0]=4 5097 B16R1.1343 O=C(CCN1CCOCC1)NC[C@H](O)CO 240690a_100020644852_100000749337 [0,1,0,1,0,0|2,0,0]=4 5098 B16R1.1343 O=C(CCN1CCOCC1)NC[C@H](O)CO 527a_100020644852_100000749337 [0,1,0,1,0,0|2,0,0]=4 5099 B16R1.1343 O=C(CNC1CCCCC1)NCC(O)CO 2230a_100000182618_200012027429 [0,1,0,1,0,0|1,0,0]=3 5100 B16R1.1343 O=C(CNC1CCCCC1)NCC(O)CO 34a_100000182618_200012027429 [0,1,0,1,0,0|1,0,0]=3 5101 B16R1.1343 O=C(CNC1CCCOC1)NCC(O)CO 2230a_100000719290_200012027429 [0,1,0,1,0,0|2,0,0]=4 5102 B16R1.1343 O=C(CNC1CCCOC1)NCC(O)CO 34a_100000719290_200012027429 [0,1,0,1,0,0|2,0,0]=4 5103 B16R1.1343 O=C(CNC1CCOCC1)NCC(O)CO 2230a_100000741149_200012027429 [0,1,0,1,0,0|2,0,0]=4 5104 B16R1.1343 O=C(CNC1CCOCC1)NCC(O)CO 34a_100000741149_200012027429 [0,1,0,1,0,0|2,0,0]=4 5105 B16R1.1343 O=C(CNC1CCSCC1)NCC(O)CO 2230a_100000748639_200012027429 [0,1,0,1,0,0|2,0,0]=4 5106 B16R1.1343 O=C(CNC1CCSCC1)NCC(O)CO 34a_100000748639_200012027429 [0,1,0,1,0,0|2,0,0]=4 5107 B16R1.1343 O=C(COC1CCCCC1)NCC(O)CO 34a_100000210231_200012027429 [0,1,0,1,0,0|1,0,0]=3 5108 B16R1.1343 O=C(COC1CCCCC1)NCC(O)CO 7a_100000210231_200012027429 [0,1,0,1,0,0|1,0,0]=3 5109 B16R1.1343 O=C(COC1CCCCC1)NC[C@@H](F)CO 240690a_100015665980_100011223303 [0,1,0,1,0,0|2,0,0]=4 5110 B16R1.1343 O=C(COC1CCCCC1)NC[C@@H](F)CO 527a_100015665980_100011223303 [0,1,0,1,0,0|2,0,0]=4 5111 B16R1.1343 O=C(COC1CCCCC1)NC[C@H](O)CO 240690a_100020644852_100011223303 [0,1,0,1,0,0|1,0,0]=3 5112 B16R1.1343 O=C(COC1CCCCC1)NC[C@H](O)CO 527a_100020644852_100011223303 [0,1,0,1,0,0|1,0,0]=3 5113 B16R1.1343 O=C(COC1CCCCO1)NCC(O)CO 34a_100000033831_200012027429 [0,1,0,1,0,0|2,0,0]=4 5114 B16R1.1343 O=C(COC1CCCOC1)NCC(O)CO 34a_100000754041_200012027429 [0,1,0,1,0,0|2,0,0]=4 5115 B16R1.1343 O=C(COC1CCCSC1)NCC(O)CO 7a_100015962668_200012027429 [0,1,0,1,0,0|2,0,0]=4 5116 B16R1.1343 O=C(COC1CCOCC1)NCC(O)CO 34a_100000744328_200012027429 [0,1,0,1,0,0|2,0,0]=4 5117 B16R1.1343 O=C(COC1CCSCC1)NCC(O)CO 34a_100000731022_200012027429 [0,1,0,1,0,0|2,0,0]=4 5118 B16R1.1343 O=C(COC1CCSCC1)NCC(O)CO 7a_100000731022_200012027429 [0,1,0,1,0,0|2,0,0]=4 5119 B16R1.1343 O=C(CSC1CCCCC1)NCC(O)CO 62a_100000210327_200012027429 [0,1,0,1,0,0|1,0,0]=3 5120 B16R1.1343 O=C(CSC1CCCCC1)NCC(O)CO 62a_200012027429_100000210327 [0,1,0,1,0,0|1,0,0]=3 5121 B16R1.1343 O=C(CSC1CCCOC1)NCC(O)CO 62a_200012027429_100000693364 [0,1,0,1,0,0|2,0,0]=4 5122 B16R1.1343 O=C(CSC1CCOCC1)NCC(O)CO 62a_200012027429_100011324220 [0,1,0,1,0,0|2,0,0]=4 5123 B16R1.1343 O=C(CSC1CCSCC1)NCC(O)CO 62a_200012027429_100000069128 [0,1,0,1,0,0|2,0,0]=4 5124 B16R1.1343 O=C(NCC1CCCCC1)NC[C@@H](F)CO 2708a_100000210473_100015665980 [0,1,0,1,0,0|2,0,0]=4 5125 B16R1.1343 O=C(NCC1CCCCC1)NC[C@@H](F)CO 273464a_100000210473_100015665980 [0,1,0,1,0,0|2,0,0]=4 5126 B16R1.1343 O=C(NCC1CCCCC1)NC[C@@H](F)CO 273464a_100015665980_100000210473 [0,1,0,1,0,0|2,0,0]=4 5127 B16R1.1343 O=C(NCC1CCCCC1)NC[C@@H](F)CO 512a_100015665980_100000210473 [0,1,0,1,0,0|2,0,0]=4 5128 B16R1.1343 O=C(NCC1CCCCC1)NC[C@H](O)CO 2708a_100000210473_100020644852 [0,1,0,1,0,0|1,0,0]=3 5129 B16R1.1343 O=C(NCC1CCCCC1)NC[C@H](O)CO 273464a_100000210473_100020644852 [0,1,0,1,0,0|1,0,0]=3 5130 B16R1.1343 O=C(NCC1CCCCC1)NC[C@H](O)CO 273464a_100020644852_100000210473 [0,1,0,1,0,0|1,0,0]=3 5131 B16R1.1343 O=C(NCC1CCCCO1)NC[C@H](O)CO 2708a_100000174945_100020644852 [0,1,0,1,0,0|2,0,0]=4 5132 B16R1.1343 O=C(NCC1CCCCO1)NC[C@H](O)CO 273464a_100000174945_100020644852 [0,1,0,1,0,0|2,0,0]=4 5133 B16R1.1343 O=C(NCC1CCCCO1)NC[C@H](O)CO 273464a_100020644852_100000174945 [0,1,0,1,0,0|2,0,0]=4 5134 B16R1.1343 O=C(NCC1CCCOC1)NC[C@H](O)CO 2708a_100000720124_100020644852 [0,1,0,1,0,0|2,0,0]=4 5135 B16R1.1343 O=C(NCC1CCCOC1)NC[C@H](O)CO 273464a_100000720124_100020644852 [0,1,0,1,0,0|2,0,0]=4 5136 B16R1.1343 O=C(NCC1CCCOC1)NC[C@H](O)CO 273464a_100020644852_100000720124 [0,1,0,1,0,0|2,0,0]=4 5137 B16R1.1343 O=C(NCC1CCOCC1)NC[C@H](O)CO 2708a_100000746373_100020644852 [0,1,0,1,0,0|2,0,0]=4 5138 B16R1.1343 O=C(NCC1CCOCC1)NC[C@H](O)CO 273464a_100000746373_100020644852 [0,1,0,1,0,0|2,0,0]=4 5139 B16R1.1343 O=C(NCC1CCOCC1)NC[C@H](O)CO 273464a_100020644852_100000746373 [0,1,0,1,0,0|2,0,0]=4 5140 B16R1.1343 O=C(NCC1CCSCC1)NC[C@H](O)CO 2708a_100015188806_100020644852 [0,1,0,1,0,0|2,0,0]=4 5141 B16R1.1343 O=C(NCC1CCSCC1)NC[C@H](O)CO 273464a_100015188806_100020644852 [0,1,0,1,0,0|2,0,0]=4 5142 B16R1.1343 O=C(NCC1CCSCC1)NC[C@H](O)CO 273464a_100020644852_100015188806 [0,1,0,1,0,0|2,0,0]=4 5143 B16R1.5567 CCC(O)CCC(=O)N1CCCCC1CC 1626a_100000210034_203496584001 [0,1,0,1,0,0|2,0,0]=4 5144 B16R1.5567 CCC(O)CCC(=O)N1CCCCC1CC 240690a_100000210034_203496584001 [0,1,0,1,0,0|2,0,0]=4 5145 B16R1.5567 CCC(O)CNC(=O)C1CCCCN1CC 11a_100011218483_100000743832 [0,1,0,1,0,0|2,0,0]=4 5146 B16R1.5567 CCC(O)CNC(=O)C1CCCCN1CC 240690a_100011218483_100000743832 [0,1,0,1,0,0|2,0,0]=4 5147 B16R1.5567 CCC(O)CNC(=O)C1CCCCN1CC 527a_100011218483_100000743832 [0,1,0,1,0,0|2,0,0]=4 5148 B16R1.5567 CCC(O)CNC(=O)N1CCCCC1CC 273464a_100011218483_100000210034 [0,1,0,1,0,0|2,0,0]=4 5149 B16R1.5567 CCC1CCCCN1C(=O)NCC(C)CO 273464a_100000744482_100000210034 [0,1,0,1,0,0|2,0,0]=4 5150 B16R1.5567 CCC1CCCCN1C(=O)NC[C@@H](F)CO 273464a_100015665980_100000210034 [0,1,0,1,0,0|2,0,0]=4 5151 B16R1.5567 CCC1CCCCN1C(=O)NC[C@H](O)CO 273464a_100020644852_100000210034 [0,1,0,1,0,0|1,0,0]=3 5152 B16R1.5567 CCN1CCCCC1C(=O)NCC(C)CO 240690a_100000744482_100000743832 [0,1,0,1,0,0|2,0,0]=4 5153 B16R1.5567 CCN1CCCCC1C(=O)NCC(C)CO 527a_100000744482_100000743832 [0,1,0,1,0,0|2,0,0]=4 5154 B16R1.5567 CCN1CCCCC1C(=O)NC[C@@H](F)CO 240690a_100015665980_100000743832 [0,1,0,1,0,0|2,0,0]=4 5155 B16R1.5567 CCN1CCCCC1C(=O)NC[C@@H](F)CO 527a_100015665980_100000743832 [0,1,0,1,0,0|2,0,0]=4 5156 B16R1.5567 CCN1CCCCC1C(=O)NC[C@H](O)CO 240690a_100020644852_100000743832 [0,1,0,1,0,0|1,0,0]=3 5157 B16R1.5567 CCN1CCCCC1C(=O)NC[C@H](O)CO 527a_100020644852_100000743832 [0,1,0,1,0,0|1,0,0]=3 5158 B16R1.5567 CC[C@H]1COCCN1C(=O)NC[C@H](O)CO 273464a_100020644852_100016988097 [0,1,0,1,0,0|2,0,0]=4 5159 B16R1.5567 O=C(NC[C@H](O)CO)N1CCCCC1CO 273464a_100020644852_100000210821 [0,1,0,1,0,0|2,0,0]=4 5160 B16R1.5742 CCC1CCCN1CC(=O)NCC(O)CO 2230a_100000754278_200012027429 [0,1,0,1,0,0|1,0,0]=3 5161 B16R1.5742 CCC1CCCN1CC(=O)NCC(O)CO 269982a_100000754278_200012027429 [0,1,0,1,0,0|1,0,0]=3 5162 B16R1.5742 CCC1CCCN1CC(=O)NCC(O)CO 34a_100000754278_200012027429 [0,1,0,1,0,0|1,0,0]=3 5163 B16R1.5742 O=C(CN1CCC[C@@H]1CO)NCC(O)CO 2230a_100000745186_200012027429 [0,1,0,1,0,0|2,0,0]=4 5164 B16R1.5742 O=C(CN1CCC[C@@H]1CO)NCC(O)CO 269982a_100000745186_200012027429 [0,1,0,1,0,0|2,0,0]=4 5165 B16R1.5742 O=C(CN1CCC[C@@H]1CO)NCC(O)CO 34a_100000745186_200012027429 [0,1,0,1,0,0|2,0,0]=4 5166 B16R1.7440 CC1CCCC1OCC(=O)NCC(O)CO 34a_100011216460_200012027429 [0,1,0,1,0,0|1,0,0]=3 5167 B16R1.7440 CC1CCCC1OCC(=O)NCC(O)CO 7a_100011216460_200012027429 [0,1,0,1,0,0|1,0,0]=3 5168 B16R1.7440 CN1CCC[C@H]1CNC(=O)NC[C@H](O)CO 2708a_100009821018_100020644852 [0,1,0,1,0,0|2,0,0]=4 5169 B16R1.7440 CN1CCC[C@H]1CNC(=O)NC[C@H](O)CO 273464a_100009821018_100020644852 [0,1,0,1,0,0|2,0,0]=4 5170 B16R1.7440 CN1CCC[C@H]1CNC(=O)NC[C@H](O)CO 273464a_100020644852_100009821018 [0,1,0,1,0,0|2,0,0]=4 5171 B16R1.7440 C[C@@H]1CNC[C@@H]1OCC(=O)NCC(O)CO 34a_200015306588_200012027429 [0,1,0,1,0,0|2,0,0]=4 5172 B16R1.7440 N[C@H]1CCC[C@@H]1OCC(=O)NCC(O)CO 34a_100000748460_200012027429 [0,1,0,1,0,0|2,0,0]=4 5173 B16R1.7440 O=C(CO[C@@H]1CCC[C@H]1Cl)NCC(O)CO 34a_200016002552_200012027429 [0,1,0,1,0,0|2,0,0]=4 5174 B16R1.7440 O=C(CS[C@@H]1CCC[C@H]1O)NCC(O)CO 62a_200012027429_200016002552 [0,1,0,1,0,0|2,0,0]=4 5175 B16R1.7440 O=C(CS[C@@H]1CCC[C@H]1O)NCC(O)CO 62a_200016002552_200012027429 [0,1,0,1,0,0|2,0,0]=4 5176 B16R1.7452 CC(CO)CNC(=O)C1CCCCCN1C 240690a_100000744482_100015187800 [0,1,0,1,0,0|2,0,0]=4 5177 B16R1.7452 CC(CO)CNC(=O)C1CCCCCN1C 527a_100000744482_100015187800 [0,1,0,1,0,0|2,0,0]=4 5178 B16R1.7452 CCC(O)CNC(=O)C1CCCCCN1C 240690a_100011218483_100015187800 [0,1,0,1,0,0|2,0,0]=4 5179 B16R1.7452 CCC(O)CNC(=O)C1CCCCCN1C 527a_100011218483_100015187800 [0,1,0,1,0,0|2,0,0]=4 5180 B16R1.7452 CN1CCCCCC1C(=O)NC[C@@H](F)CO 240690a_100015665980_100015187800 [0,1,0,1,0,0|2,0,0]=4 5181 B16R1.7452 CN1CCCCCC1C(=O)NC[C@@H](F)CO 527a_100015665980_100015187800 [0,1,0,1,0,0|2,0,0]=4 5182 B16R1.7452 CN1CCCCCC1C(=O)NC[C@H](O)CO 240690a_100020644852_100015187800 [0,1,0,1,0,0|1,0,0]=3 5183 B16R1.7452 CN1CCCCCC1C(=O)NC[C@H](O)CO 527a_100020644852_100015187800 [0,1,0,1,0,0|1,0,0]=3 5184 B16R1.7458 CC(CO)CNC(=O)NC1CCCCC1C 2708a_100000211402_100000744482 [0,1,0,1,0,0|2,0,0]=4 5185 B16R1.7458 CC(CO)CNC(=O)NC1CCCCC1C 273464a_100000211402_100000744482 [0,1,0,1,0,0|2,0,0]=4 5186 B16R1.7458 CC(CO)CNC(=O)NC1CCCCC1C 273464a_100000744482_100000211402 [0,1,0,1,0,0|2,0,0]=4 5187 B16R1.7458 CC(CO)CNC(=O)NC1CCCCC1C 512a_100000211402_100000744482 [0,1,0,1,0,0|2,0,0]=4 5188 B16R1.7458 CC(CO)CNC(=O)NC1CCCCC1C 512a_100000744482_100000211402 [0,1,0,1,0,0|2,0,0]=4 5189 B16R1.7458 CC1CCCCC1NC(=O)NC[C@@H](F)CO 2708a_100000211402_100015665980 [0,1,0,1,0,0|2,0,0]=4 5190 B16R1.7458 CC1CCCCC1NC(=O)NC[C@@H](F)CO 273464a_100000211402_100015665980 [0,1,0,1,0,0|2,0,0]=4 5191 B16R1.7458 CC1CCCCC1NC(=O)NC[C@@H](F)CO 273464a_100015665980_100000211402 [0,1,0,1,0,0|2,0,0]=4 5192 B16R1.7458 CC1CCCCC1NC(=O)NC[C@@H](F)CO 512a_100000211402_100015665980 [0,1,0,1,0,0|2,0,0]=4 5193 B16R1.7458 CC1CCCCC1NC(=O)NC[C@@H](F)CO 512a_100015665980_100000211402 [0,1,0,1,0,0|2,0,0]=4 5194 B16R1.7458 CC1CCCCC1NC(=O)NC[C@H](O)CO 2708a_100000211402_100020644852 [0,1,0,1,0,0|1,0,0]=3 5195 B16R1.7458 CC1CCCCC1NC(=O)NC[C@H](O)CO 273464a_100000211402_100020644852 [0,1,0,1,0,0|1,0,0]=3 5196 B16R1.7458 CC1CCCCC1NC(=O)NC[C@H](O)CO 273464a_100020644852_100000211402 [0,1,0,1,0,0|1,0,0]=3 5197 B16R1.7458 CC1CCCCN1CC(=O)NCC(O)CO 2230a_100000211376_200012027429 [0,1,0,1,0,0|1,0,0]=3 5198 B16R1.7458 CC1CCCCN1CC(=O)NCC(O)CO 269982a_100000211376_200012027429 [0,1,0,1,0,0|1,0,0]=3 5199 B16R1.7458 CC1CCCCN1CC(=O)NCC(O)CO 34a_100000211376_200012027429 [0,1,0,1,0,0|1,0,0]=3 5200 B16R1.7458 CCC(O)CCC(=O)NC1CCCCC1C 1626a_100000211402_203496584001 [0,1,0,1,0,0|2,0,0]=4 5201 B16R1.7458 CCC(O)CCC(=O)NC1CCCCC1C 240690a_100000211402_203496584001 [0,1,0,1,0,0|2,0,0]=4 5202 B16R1.7458 CCC(O)CNC(=O)NC1CCCCC1C 2708a_100000211402_100011218483 [0,1,0,1,0,0|2,0,0]=4 5203 B16R1.7458 CCC(O)CNC(=O)NC1CCCCC1C 273464a_100000211402_100011218483 [0,1,0,1,0,0|2,0,0]=4 5204 B16R1.7458 CCC(O)CNC(=O)NC1CCCCC1C 273464a_100011218483_100000211402 [0,1,0,1,0,0|2,0,0]=4 5205 B16R1.7458 CCC(O)CNC(=O)NC1CCCCC1C 512a_100011218483_100000211402 [0,1,0,1,0,0|2,0,0]=4 5206 B16R1.7458 C[C@H]1COCCN1CC(=O)NCC(O)CO 2230a_100009815349_200012027429 [0,1,0,1,0,0|2,0,0]=4 5207 B16R1.7458 C[C@H]1COCCN1CC(=O)NCC(O)CO 269982a_100009815349_200012027429 [0,1,0,1,0,0|2,0,0]=4 5208 B16R1.7458 C[C@H]1COCCN1CC(=O)NCC(O)CO 34a_100009815349_200012027429 [0,1,0,1,0,0|2,0,0]=4 5209 B16R1.7458 O=C(NC[C@H](O)CO)N[C@@H]1CCCC[C@H]1F 2708a_100015195156_100020644852 [0,1,0,1,0,0|2,0,0]=4 5210 B16R1.7458 O=C(NC[C@H](O)CO)N[C@@H]1CCCC[C@H]1F 273464a_100015195156_100020644852 [0,1,0,1,0,0|2,0,0]=4 5211 B16R1.7458 O=C(NC[C@H](O)CO)N[C@@H]1CCCC[C@H]1F 273464a_100020644852_100015195156 [0,1,0,1,0,0|2,0,0]=4 5212 B16R1.9222 COCC1CCN1CC(=O)NCC(O)CO 2230a_100015195929_200012027429 [0,1,0,1,0,0|2,0,0]=4 5213 B16R1.9222 COCC1CCN1CC(=O)NCC(O)CO 269982a_100015195929_200012027429 [0,1,0,1,0,0|2,0,0]=4 5214 B16R1.9222 COCC1CCN1CC(=O)NCC(O)CO 34a_100015195929_200012027429 [0,1,0,1,0,0|2,0,0]=4 5215 B16R1.13568 COC[C@@H]1CCCN1C(=O)NC[C@H](O)CO 273464a_100020644852_100020646714 [0,1,0,1,0,0|2,0,0]=4 5216 B16R1.17901 CCCCCCCCC(=O)NCC1COC1 11a_100015281925_100000210188 [0,1,0,1,0,0|2,0,0]=4 5217 B16R1.17901 CCCCCCCCC(=O)NCC1COC1 1626a_100015281925_100000210188 [0,1,0,1,0,0|2,0,0]=4 5218 B16R1.17901 CCCCCCCCC(=O)NCC1COC1 240690a_100015281925_100000210188 [0,1,0,1,0,0|2,0,0]=4 5219 B16R1.17901 CCCCCCCCC(=O)NCC1COC1 527a_100015281925_100000210188 [0,1,0,1,0,0|2,0,0]=4 5220 B16R1.17901 CCCCCCCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000210188 [0,1,0,1,0,0|2,0,0]=4 5221 B16R1.17901 CCCCCCCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000210188 [0,1,0,1,0,0|2,0,0]=4 5222 B16R1.17901 CCCCCCCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000210188 [0,1,0,1,0,0|2,0,0]=4 5223 B16R1.17901 CCCCCCCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000210188 [0,1,0,1,0,0|2,0,0]=4 5224 B16R1.17901 CCCCCCCNC(=O)NCC1COC1 2708a_100000229938_100015281925 [0,1,0,1,0,0|2,0,0]=4 5225 B16R1.17901 CCCCCCCNC(=O)NCC1COC1 2708a_100015281925_100000229938 [0,1,0,1,0,0|2,0,0]=4 5226 B16R1.17901 CCCCCCCNC(=O)NCC1COC1 273464a_100000229938_100015281925 [0,1,0,1,0,0|2,0,0]=4 5227 B16R1.17901 CCCCCCCNC(=O)NCC1COC1 273464a_100015281925_100000229938 [0,1,0,1,0,0|2,0,0]=4 5228 B16R1.17901 CCCCCCCNC(=O)NCC1COC1 512a_100000229938_100015281925 [0,1,0,1,0,0|2,0,0]=4 5229 B16R1.17901 CCCCCCCNC(=O)NCC1COC1 512a_100015281925_100000229938 [0,1,0,1,0,0|2,0,0]=4 5230 B16R1.17901 CCCCCCCNC(=O)NC[C@@H]1CCO1 2708a_100000229938_100020831831 [0,1,0,1,0,0|2,0,0]=4 5231 B16R1.17901 CCCCCCCNC(=O)NC[C@@H]1CCO1 2708a_100020831831_100000229938 [0,1,0,1,0,0|2,0,0]=4 5232 B16R1.17901 CCCCCCCNC(=O)NC[C@@H]1CCO1 273464a_100000229938_100020831831 [0,1,0,1,0,0|2,0,0]=4 5233 B16R1.17901 CCCCCCCNC(=O)NC[C@@H]1CCO1 273464a_100020831831_100000229938 [0,1,0,1,0,0|2,0,0]=4 5234 B16R1.17901 CCCCCCCNC(=O)NC[C@@H]1CCO1 512a_100000229938_100020831831 [0,1,0,1,0,0|2,0,0]=4 5235 B16R1.17901 CCCCCCCNC(=O)NC[C@@H]1CCO1 512a_100020831831_100000229938 [0,1,0,1,0,0|2,0,0]=4 5236 B16R1.17901 O=C(CCCCCCCO)NCC1COC1 240690a_100015281925_100011219782 [0,1,0,1,0,0|2,0,0]=4 5237 B16R1.17901 O=C(CCCCCCCO)NC[C@@H]1CCO1 240690a_100020831831_100011219782 [0,1,0,1,0,0|2,0,0]=4 5238 B16R1.18481 CC(CO)CNC(=O)CCCN1CCCC1 240690a_100000744482_100000743284 [0,1,0,1,0,0|2,0,0]=4 5239 B16R1.18481 CC(CO)CNC(=O)NCCC1CCCC1 2708a_100000739158_100000744482 [0,1,0,1,0,0|2,0,0]=4 5240 B16R1.18481 CC(CO)CNC(=O)NCCC1CCCC1 273464a_100000739158_100000744482 [0,1,0,1,0,0|2,0,0]=4 5241 B16R1.18481 CC(CO)CNC(=O)NCCC1CCCC1 273464a_100000744482_100000739158 [0,1,0,1,0,0|2,0,0]=4 5242 B16R1.18481 CC(CO)CNC(=O)NCCC1CCCC1 512a_100000739158_100000744482 [0,1,0,1,0,0|2,0,0]=4 5243 B16R1.18481 CC(CO)CNC(=O)NCCC1CCCC1 512a_100000744482_100000739158 [0,1,0,1,0,0|2,0,0]=4 5244 B16R1.18481 CCC(O)CCC(=O)NCCC1CCCC1 1626a_100000739158_203496584001 [0,1,0,1,0,0|2,0,0]=4 5245 B16R1.18481 CCC(O)CCC(=O)NCCC1CCCC1 240690a_100000739158_203496584001 [0,1,0,1,0,0|2,0,0]=4 5246 B16R1.18481 CCC(O)CNC(=O)CCCN1CCCC1 240690a_100011218483_100000743284 [0,1,0,1,0,0|2,0,0]=4 5247 B16R1.18481 CCC(O)CNC(=O)NCCC1CCCC1 2708a_100000739158_100011218483 [0,1,0,1,0,0|2,0,0]=4 5248 B16R1.18481 CCC(O)CNC(=O)NCCC1CCCC1 273464a_100000739158_100011218483 [0,1,0,1,0,0|2,0,0]=4 5249 B16R1.18481 CCC(O)CNC(=O)NCCC1CCCC1 273464a_100011218483_100000739158 [0,1,0,1,0,0|2,0,0]=4 5250 B16R1.18481 CCC(O)CNC(=O)NCCC1CCCC1 512a_100011218483_100000739158 [0,1,0,1,0,0|2,0,0]=4 5251 B16R1.18481 O=C(CCCN1CCCC1)NC[C@@H](F)CO 240690a_100015665980_100000743284 [0,1,0,1,0,0|2,0,0]=4 5252 B16R1.18481 O=C(CCCN1CCCC1)NC[C@H](O)CO 240690a_100020644852_100000743284 [0,1,0,1,0,0|1,0,0]=3 5253 B16R1.18481 O=C(CNCC1CCCC1)NCC(O)CO 2230a_100000737975_200012027429 [0,1,0,1,0,0|1,0,0]=3 5254 B16R1.18481 O=C(CNCC1CCCC1)NCC(O)CO 34a_100000737975_200012027429 [0,1,0,1,0,0|1,0,0]=3 5255 B16R1.18481 O=C(CNCC1CCOC1)NCC(O)CO 2230a_100000737293_200012027429 [0,1,0,1,0,0|2,0,0]=4 5256 B16R1.18481 O=C(CNCC1CCOC1)NCC(O)CO 34a_100000737293_200012027429 [0,1,0,1,0,0|2,0,0]=4 5257 B16R1.18481 O=C(CNC[C@@H]1CCCO1)NCC(O)CO 2230a_100020590478_200012027429 [0,1,0,1,0,0|2,0,0]=4 5258 B16R1.18481 O=C(CNC[C@@H]1CCCO1)NCC(O)CO 34a_100020590478_200012027429 [0,1,0,1,0,0|2,0,0]=4 5259 B16R1.18481 O=C(COCC1CCCC1)NCC(O)CO 34a_100000742336_200012027429 [0,1,0,1,0,0|1,0,0]=3 5260 B16R1.18481 O=C(COCC1CCCC1)NCC(O)CO 7a_100000742336_200012027429 [0,1,0,1,0,0|1,0,0]=3 5261 B16R1.18481 O=C(COCC1CCCO1)NCC(O)CO 34a_100000210270_200012027429 [0,1,0,1,0,0|2,0,0]=4 5262 B16R1.18481 O=C(COCC1CCCO1)NCC(O)CO 7a_100000210270_200012027429 [0,1,0,1,0,0|2,0,0]=4 5263 B16R1.18481 O=C(COCC1CCCO1)NC[C@H](O)CO 240690a_100020644852_100011223388 [0,1,0,1,0,0|2,0,0]=4 5264 B16R1.18481 O=C(COCC1CCCO1)NC[C@H](O)CO 527a_100020644852_100011223388 [0,1,0,1,0,0|2,0,0]=4 5265 B16R1.18481 O=C(COCC1CCNC1)NCC(O)CO 34a_100000748654_200012027429 [0,1,0,1,0,0|2,0,0]=4 5266 B16R1.18481 O=C(COCC1CCOC1)NCC(O)CO 34a_100000740260_200012027429 [0,1,0,1,0,0|2,0,0]=4 5267 B16R1.18481 O=C(COC[C@H]1CCCN1)NCC(O)CO 34a_100000745186_200012027429 [0,1,0,1,0,0|2,0,0]=4 5268 B16R1.18481 O=C(CSCC1CCCC1)NCC(O)CO 62a_100000740388_200012027429 [0,1,0,1,0,0|1,0,0]=3 5269 B16R1.18481 O=C(CSCC1CCCC1)NCC(O)CO 62a_200012027429_100000740388 [0,1,0,1,0,0|1,0,0]=3 5270 B16R1.18481 O=C(CSCC1CCCO1)NCC(O)CO 62a_100000203698_200012027429 [0,1,0,1,0,0|2,0,0]=4 5271 B16R1.18481 O=C(CSCC1CCCO1)NCC(O)CO 62a_200012027429_100000203698 [0,1,0,1,0,0|2,0,0]=4 5272 B16R1.18481 O=C(CSCC1CCCO1)NC[C@H](O)CO 240690a_100020644852_100000217298 [0,1,0,1,0,0|2,0,0]=4 5273 B16R1.18481 O=C(CSCC1CCCO1)NC[C@H](O)CO 527a_100020644852_100000217298 [0,1,0,1,0,0|2,0,0]=4 5274 B16R1.18481 O=C(CSCC1CCOC1)NCC(O)CO 62a_100000702531_200012027429 [0,1,0,1,0,0|2,0,0]=4 5275 B16R1.18481 O=C(CSCC1CCOC1)NCC(O)CO 62a_200012027429_100000702531 [0,1,0,1,0,0|2,0,0]=4 5276 B16R1.18481 O=C(NCCC1CCCC1)NC[C@@H](F)CO 2708a_100000739158_100015665980 [0,1,0,1,0,0|2,0,0]=4 5277 B16R1.18481 O=C(NCCC1CCCC1)NC[C@@H](F)CO 273464a_100000739158_100015665980 [0,1,0,1,0,0|2,0,0]=4 5278 B16R1.18481 O=C(NCCC1CCCC1)NC[C@@H](F)CO 273464a_100015665980_100000739158 [0,1,0,1,0,0|2,0,0]=4 5279 B16R1.18481 O=C(NCCC1CCCC1)NC[C@@H](F)CO 512a_100000739158_100015665980 [0,1,0,1,0,0|2,0,0]=4 5280 B16R1.18481 O=C(NCCC1CCCC1)NC[C@@H](F)CO 512a_100015665980_100000739158 [0,1,0,1,0,0|2,0,0]=4 5281 B16R1.18481 O=C(NCCC1CCCC1)NC[C@H](O)CO 2708a_100000739158_100020644852 [0,1,0,1,0,0|1,0,0]=3 5282 B16R1.18481 O=C(NCCC1CCCC1)NC[C@H](O)CO 273464a_100000739158_100020644852 [0,1,0,1,0,0|1,0,0]=3 5283 B16R1.18481 O=C(NCCC1CCCC1)NC[C@H](O)CO 273464a_100020644852_100000739158 [0,1,0,1,0,0|1,0,0]=3 5284 B16R1.18481 O=C(NCCN1CCCC1)NC[C@H](O)CO 273464a_100000212299_100020644852 [0,1,0,1,0,0|2,0,0]=4 5285 B16R1.18481 O=C(NCCN1CCCC1)NC[C@H](O)CO 273464a_100020644852_100000212299 [0,1,0,1,0,0|2,0,0]=4 5286 B16R1.20489 CCCCCCCCC(=O)NCC1(CC1)O 11a_100011936951_100000210188 [0,1,0,1,0,0|2,0,0]=4 5287 B16R1.20489 CCCCCCCCC(=O)NCC1(CC1)O 240690a_100011936951_100000210188 [0,1,0,1,0,0|2,0,0]=4 5288 B16R1.20489 CCCCCCCCC(=O)NCC1(CC1)O 527a_100011936951_100000210188 [0,1,0,1,0,0|2,0,0]=4 5289 B16R1.20489 CCCCCCCNC(=O)NCC1(CC1)O 2708a_100000229938_100011936951 [0,1,0,1,0,0|2,0,0]=4 5290 B16R1.20489 CCCCCCCNC(=O)NCC1(CC1)O 2708a_100011936951_100000229938 [0,1,0,1,0,0|2,0,0]=4 5291 B16R1.20489 CCCCCCCNC(=O)NCC1(CC1)O 273464a_100000229938_100011936951 [0,1,0,1,0,0|2,0,0]=4 5292 B16R1.20489 CCCCCCCNC(=O)NCC1(CC1)O 512a_100000229938_100011936951 [0,1,0,1,0,0|2,0,0]=4 5293 B16R1.20489 CCCCCCCNC(=O)NCC1(CC1)O 512a_100011936951_100000229938 [0,1,0,1,0,0|2,0,0]=4 5294 B16R1.20489 O=C(CCCCCCCO)NCC1(CC1)O 240690a_100011936951_100011219782 [0,1,0,1,0,0|2,0,0]=4 5295 B16R1.32448 CCCCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 11a_206633788156_100000210188 [0,1,0,1,0,0|2,0,0]=4 5296 B16R1.32448 CCCCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 240690a_206633788156_100000210188 [0,1,0,1,0,0|2,0,0]=4 5297 B16R1.32448 CCCCCCCCC(=O)N1C[C@@H]([C@@H]1C)O 527a_206633788156_100000210188 [0,1,0,1,0,0|2,0,0]=4 5298 B16R1.32448 CCCCCCCNC(=O)N1C[C@@H]([C@@H]1C)O 2708a_100000229938_206633788156 [0,1,0,1,0,0|2,0,0]=4 5299 B16R1.32448 CCCCCCCNC(=O)N1C[C@@H]([C@@H]1C)O 273464a_100000229938_206633788156 [0,1,0,1,0,0|2,0,0]=4 5300 B16R1.32448 C[C@H]1[C@H](CN1C(=O)CCCCCCCO)O 240690a_206633788156_100011219782 [0,1,0,1,0,0|2,0,0]=4 5301 B16R1.32450 CCCCCCCCC(=O)C1CC(C1)CO 1458a_206645079618_100000210759 [0,1,0,1,0,0|2,0,0]=4 5302 B16R1.32450 CCCCCCCCC(=O)N1CC(C1)CO 240690a_100016987283_100000210188 [0,1,0,1,0,0|2,0,0]=4 5303 B16R1.32450 CCCCCCCCC(=O)N1CC(C1)CO 527a_100016987283_100000210188 [0,1,0,1,0,0|2,0,0]=4 5304 B16R1.32450 CCCCCCCNC(=O)C1CC(C1)CO 1626a_100000229938_206645079618 [0,1,0,1,0,0|2,0,0]=4 5305 B16R1.32450 CCCCCCCNC(=O)N1CC(C1)CO 2708a_100000229938_100016987283 [0,1,0,1,0,0|2,0,0]=4 5306 B16R1.32450 CCCCCCCNC(=O)N1CC(C1)CO 273464a_100000229938_100016987283 [0,1,0,1,0,0|2,0,0]=4 5307 B16R1.32450 COCCCCCCC(=O)C1CC(C1)CO 1458a_206645079618_100011998445 [0,1,0,1,0,0|2,0,0]=4 5308 B16R1.32450 O=C(CCCCCCCO)C1CC(C1)CO 1458a_206645079618_100000760002 [0,1,0,1,0,0|2,0,0]=4 5309 B16R1.32450 O=C(CCCCCCCO)N1CC(C1)CO 240690a_100016987283_100011219782 [0,1,0,1,0,0|2,0,0]=4 5310 B16R1.40206 CC(CO)CNC(=O)CC1CCCCCC1 240690a_100000744482_100000685095 [0,1,0,1,0,0|2,0,0]=4 5311 B16R1.40206 CC(CO)CNC(=O)CC1CCCCCC1 527a_100000744482_100000685095 [0,1,0,1,0,0|2,0,0]=4 5312 B16R1.40206 CC(CO)CNC(=O)CN1CCCCCC1 240690a_100000744482_100000740298 [0,1,0,1,0,0|2,0,0]=4 5313 B16R1.40206 CC(CO)CNC(=O)CN1CCCCCC1 527a_100000744482_100000740298 [0,1,0,1,0,0|2,0,0]=4 5314 B16R1.40206 CC(CO)CNC(=O)NC1CCCCCC1 2708a_100000210984_100000744482 [0,1,0,1,0,0|2,0,0]=4 5315 B16R1.40206 CC(CO)CNC(=O)NC1CCCCCC1 273464a_100000210984_100000744482 [0,1,0,1,0,0|2,0,0]=4 5316 B16R1.40206 CC(CO)CNC(=O)NC1CCCCCC1 273464a_100000744482_100000210984 [0,1,0,1,0,0|2,0,0]=4 5317 B16R1.40206 CC(CO)CNC(=O)NC1CCCCCC1 512a_100000744482_100000210984 [0,1,0,1,0,0|2,0,0]=4 5318 B16R1.40206 CCC(O)CCC(=O)NC1CCCCCC1 1626a_100000210984_203496584001 [0,1,0,1,0,0|2,0,0]=4 5319 B16R1.40206 CCC(O)CCC(=O)NC1CCCCCC1 240690a_100000210984_203496584001 [0,1,0,1,0,0|2,0,0]=4 5320 B16R1.40206 CCC(O)CNC(=O)CC1CCCCCC1 11a_100011218483_100000685095 [0,1,0,1,0,0|2,0,0]=4 5321 B16R1.40206 CCC(O)CNC(=O)CC1CCCCCC1 240690a_100011218483_100000685095 [0,1,0,1,0,0|2,0,0]=4 5322 B16R1.40206 CCC(O)CNC(=O)CC1CCCCCC1 527a_100011218483_100000685095 [0,1,0,1,0,0|2,0,0]=4 5323 B16R1.40206 CCC(O)CNC(=O)CN1CCCCCC1 11a_100011218483_100000740298 [0,1,0,1,0,0|2,0,0]=4 5324 B16R1.40206 CCC(O)CNC(=O)CN1CCCCCC1 240690a_100011218483_100000740298 [0,1,0,1,0,0|2,0,0]=4 5325 B16R1.40206 CCC(O)CNC(=O)CN1CCCCCC1 527a_100011218483_100000740298 [0,1,0,1,0,0|2,0,0]=4 5326 B16R1.40206 CCC(O)CNC(=O)NC1CCCCCC1 2708a_100000210984_100011218483 [0,1,0,1,0,0|2,0,0]=4 5327 B16R1.40206 CCC(O)CNC(=O)NC1CCCCCC1 273464a_100000210984_100011218483 [0,1,0,1,0,0|2,0,0]=4 5328 B16R1.40206 CCC(O)CNC(=O)NC1CCCCCC1 273464a_100011218483_100000210984 [0,1,0,1,0,0|2,0,0]=4 5329 B16R1.40206 CCC(O)CNC(=O)NC1CCCCCC1 512a_100011218483_100000210984 [0,1,0,1,0,0|2,0,0]=4 5330 B16R1.40206 O=C(C=C1CCCCCC1)NC[C@H](O)CO 240690a_100020644852_100011240665 [0,1,0,1,0,0|1,0,1]=4 5331 B16R1.40206 O=C(CC1CCCCCC1)NC[C@@H](F)CO 240690a_100015665980_100000685095 [0,1,0,1,0,0|2,0,0]=4 5332 B16R1.40206 O=C(CC1CCCCCC1)NC[C@@H](F)CO 527a_100015665980_100000685095 [0,1,0,1,0,0|2,0,0]=4 5333 B16R1.40206 O=C(CC1CCCCCC1)NC[C@H](O)CO 240690a_100020644852_100000685095 [0,1,0,1,0,0|1,0,0]=3 5334 B16R1.40206 O=C(CC1CCCCCC1)NC[C@H](O)CO 527a_100020644852_100000685095 [0,1,0,1,0,0|1,0,0]=3 5335 B16R1.40206 O=C(CN1CCCCCC1)NCC(O)CO 2230a_100000185865_200012027429 [0,1,0,1,0,0|1,0,0]=3 5336 B16R1.40206 O=C(CN1CCCCCC1)NCC(O)CO 269982a_100000185865_200012027429 [0,1,0,1,0,0|1,0,0]=3 5337 B16R1.40206 O=C(CN1CCCCCC1)NCC(O)CO 34a_100000185865_200012027429 [0,1,0,1,0,0|1,0,0]=3 5338 B16R1.40206 O=C(CN1CCCCCC1)NC[C@@H](F)CO 240690a_100015665980_100000740298 [0,1,0,1,0,0|2,0,0]=4 5339 B16R1.40206 O=C(CN1CCCCCC1)NC[C@@H](F)CO 527a_100015665980_100000740298 [0,1,0,1,0,0|2,0,0]=4 5340 B16R1.40206 O=C(CN1CCCCCC1)NC[C@H](O)CO 240690a_100020644852_100000740298 [0,1,0,1,0,0|1,0,0]=3 5341 B16R1.40206 O=C(CN1CCCCCC1)NC[C@H](O)CO 527a_100020644852_100000740298 [0,1,0,1,0,0|1,0,0]=3 5342 B16R1.40206 O=C(CN1CCCOCC1)NCC(O)CO 2230a_100000685342_200012027429 [0,1,0,1,0,0|2,0,0]=4 5343 B16R1.40206 O=C(CN1CCCOCC1)NCC(O)CO 269982a_100000685342_200012027429 [0,1,0,1,0,0|2,0,0]=4 5344 B16R1.40206 O=C(CN1CCCOCC1)NCC(O)CO 34a_100000685342_200012027429 [0,1,0,1,0,0|2,0,0]=4 5345 B16R1.40206 O=C(NC[C@@H](F)CO)NC1CCCCCC1 2708a_100000210984_100015665980 [0,1,0,1,0,0|2,0,0]=4 5346 B16R1.40206 O=C(NC[C@@H](F)CO)NC1CCCCCC1 273464a_100000210984_100015665980 [0,1,0,1,0,0|2,0,0]=4 5347 B16R1.40206 O=C(NC[C@@H](F)CO)NC1CCCCCC1 273464a_100015665980_100000210984 [0,1,0,1,0,0|2,0,0]=4 5348 B16R1.40206 O=C(NC[C@@H](F)CO)NC1CCCCCC1 512a_100015665980_100000210984 [0,1,0,1,0,0|2,0,0]=4 5349 B16R1.40206 O=C(NC[C@H](O)CO)NC1CCCCCC1 2708a_100000210984_100020644852 [0,1,0,1,0,0|1,0,0]=3 5350 B16R1.40206 O=C(NC[C@H](O)CO)NC1CCCCCC1 273464a_100000210984_100020644852 [0,1,0,1,0,0|1,0,0]=3 5351 B16R1.40206 O=C(NC[C@H](O)CO)NC1CCCCCC1 273464a_100020644852_100000210984 [0,1,0,1,0,0|1,0,0]=3 5352 B16R1.40147 N[C@@H](COCC(=O)NCC(O)CO)C1CC1 34a_100020623730_200012027429 [0,1,0,1,0,0|2,0,0]=4 5353 B16R1.75593 CC1(CCC1)CNCC(=O)NCC(O)CO 2230a_100000706607_200012027429 [0,1,0,1,0,0|2,0,0]=4 5354 B16R1.75593 CC1(CCC1)CSCC(=O)NCC(O)CO 62a_100000726658_200012027429 [0,1,0,1,0,0|2,0,0]=4 5355 B16R1.75593 CC1(CCC1)CSCC(=O)NCC(O)CO 62a_200012027429_100000726658 [0,1,0,1,0,0|2,0,0]=4 5356 B16R1.360 CC(C)(CO)CNC(=O)CC1CCCCC1 240690a_100020635058_100000211666 [0,1,0,1,0,0|2,0,0]=4 5357 B16R1.360 CC(C)(CO)CNC(=O)CC1CCCCC1 527a_100020635058_100000211666 [0,1,0,1,0,0|2,0,0]=4 5358 B16R1.360 O=C(CC1CCCCC1)NCC(F)(F)CO 240690a_100000703232_100000211666 [0,1,0,1,0,0|2,0,0]=4 5359 B16R1.360 O=C(CC1CCCCC1)NCC(F)(F)CO 527a_100000703232_100000211666 [0,1,0,1,0,0|2,0,0]=4 5360 B16R1.10385 CC(C)(CO)CNC(=O)CCC1CCCC1 240690a_100020635058_100000211120 [0,1,0,1,0,0|2,0,0]=4 5361 B16R1.10385 CC(C)(CO)CNC(=O)CCC1CCCC1 527a_100020635058_100000211120 [0,1,0,1,0,0|2,0,0]=4 5362 B16R1.10385 O=C(CCC1CCCC1)NCC(F)(F)CO 240690a_100000703232_100000211120 [0,1,0,1,0,0|2,0,0]=4 5363 B16R1.10385 O=C(CCC1CCCC1)NCC(F)(F)CO 527a_100000703232_100000211120 [0,1,0,1,0,0|2,0,0]=4 5364 B16R1.10467 CC1CCCCC1C(=O)NCC(C)(C)CO 240690a_100020635058_100011215568 [0,1,0,1,0,0|2,0,0]=4 5365 B16R1.10467 CC1CCCCC1C(=O)NCC(C)(C)CO 527a_100020635058_100011215568 [0,1,0,1,0,0|2,0,0]=4 5366 B16R1.10467 CC1CCCCC1C(=O)NCC(F)(F)CO 240690a_100000703232_100011215568 [0,1,0,1,0,0|2,0,0]=4 5367 B16R1.10467 CC1CCCCC1C(=O)NCC(F)(F)CO 527a_100000703232_100011215568 [0,1,0,1,0,0|2,0,0]=4 5368 B16R1.40708 CCCCCCCC(=O)N1CCC(C1)(C)O 11a_100000718628_100000211969 [0,1,0,1,0,0|2,0,0]=4 5369 B16R1.40708 CCCCCCCC(=O)N1CCC(C1)(C)O 240690a_100000718628_100000211969 [0,1,0,1,0,0|2,0,0]=4 5370 B16R1.40708 CCCCCCCC(=O)N1CCC(C1)(C)O 527a_100000718628_100000211969 [0,1,0,1,0,0|2,0,0]=4 5371 B16R1.51483 CC(C)(CO)CNC(=O)C1CCCCCC1 240690a_100020635058_100000749507 [0,1,0,1,0,0|2,0,0]=4 5372 B16R1.51483 CC(C)(CO)CNC(=O)C1CCCCCC1 527a_100020635058_100000749507 [0,1,0,1,0,0|2,0,0]=4 5373 B16R1.51483 O=C(NCC(F)(F)CO)C1CCCCCC1 240690a_100000703232_100000749507 [0,1,0,1,0,0|2,0,0]=4 5374 B16R1.51483 O=C(NCC(F)(F)CO)C1CCCCCC1 527a_100000703232_100000749507 [0,1,0,1,0,0|2,0,0]=4 5375 B16R1.699 CCCCC(C)CCC(=O)N1CCC(C1)O 240690a_100011215560_100000033779 [0,1,0,1,0,0|2,0,0]=4 5376 B16R1.699 CCCCC(C)CCC(=O)N1CCC(C1)O 527a_100011215560_100000033779 [0,1,0,1,0,0|2,0,0]=4 5377 B16R1.18319 CC(NCC(=O)NCC(O)CO)C1CCC1 2230a_100016994624_200012027429 [0,1,0,1,0,0|2,0,0]=4 5378 B16R1.18319 CC(NCC(=O)NCC(O)CO)C1CCC1 34a_100016994624_200012027429 [0,1,0,1,0,0|2,0,0]=4 5379 B16R1.18319 CC(OCC(=O)NCC(O)CO)C1CCC1 34a_100000766398_200012027429 [0,1,0,1,0,0|2,0,0]=4 5380 B16R1.18319 CC(OCC(=O)NCC(O)CO)C1CCC1 7a_100000766398_200012027429 [0,1,0,1,0,0|2,0,0]=4 5381 B16R1.20847 CCCCC(C)CCC(=O)NCC1COC1 11a_100015281925_100000033779 [0,1,0,1,0,0|2,0,0]=4 5382 B16R1.20847 CCCCC(C)CCC(=O)NCC1COC1 1626a_100015281925_100000033779 [0,1,0,1,0,0|2,0,0]=4 5383 B16R1.20847 CCCCC(C)CCC(=O)NCC1COC1 240690a_100015281925_100000033779 [0,1,0,1,0,0|2,0,0]=4 5384 B16R1.20847 CCCCC(C)CCC(=O)NCC1COC1 527a_100015281925_100000033779 [0,1,0,1,0,0|2,0,0]=4 5385 B16R1.20847 CCCCC(C)CCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000033779 [0,1,0,1,0,0|2,0,0]=4 5386 B16R1.20847 CCCCC(C)CCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000033779 [0,1,0,1,0,0|2,0,0]=4 5387 B16R1.20847 CCCCC(C)CCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000033779 [0,1,0,1,0,0|2,0,0]=4 5388 B16R1.20847 CCCCC(C)CCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000033779 [0,1,0,1,0,0|2,0,0]=4 5389 B16R1.40137 CC1(CCCC1)OCC(=O)NCC(O)CO 34a_100000751722_200012027429 [0,1,0,1,0,0|2,0,0]=4 5390 B16R1.40137 CC1(CCCC1)OCC(=O)NCC(O)CO 7a_100000751722_200012027429 [0,1,0,1,0,0|2,0,0]=4 5391 B16R1.40974 CCCCC(C)CCC(=O)NCC1(CC1)O 11a_100011936951_100000033779 [0,1,0,1,0,0|2,0,0]=4 5392 B16R1.40974 CCCCC(C)CCC(=O)NCC1(CC1)O 240690a_100011936951_100000033779 [0,1,0,1,0,0|2,0,0]=4 5393 B16R1.40974 CCCCC(C)CCC(=O)NCC1(CC1)O 527a_100011936951_100000033779 [0,1,0,1,0,0|2,0,0]=4 5394 B16R1.64105 CCCCC(C)CCC(=O)N1C[C@@H]([C@@H]1C)O 11a_206633788156_100000033779 [0,1,0,1,0,0|2,0,0]=4 5395 B16R1.64105 CCCCC(C)CCC(=O)N1C[C@@H]([C@@H]1C)O 240690a_206633788156_100000033779 [0,1,0,1,0,0|2,0,0]=4 5396 B16R1.64105 CCCCC(C)CCC(=O)N1C[C@@H]([C@@H]1C)O 527a_206633788156_100000033779 [0,1,0,1,0,0|2,0,0]=4 5397 B16R1.64107 CCCCC(C)CCC(=O)N1CC(C1)CO 240690a_100016987283_100000033779 [0,1,0,1,0,0|2,0,0]=4 5398 B16R1.64107 CCCCC(C)CCC(=O)N1CC(C1)CO 527a_100016987283_100000033779 [0,1,0,1,0,0|2,0,0]=4 5399 B16R1.75604 CC1CCC(N1CC(=O)NCC(O)CO)C 2230a_100000687148_200012027429 [0,1,0,1,0,0|2,0,0]=4 5400 B16R1.75604 CC1CCC(N1CC(=O)NCC(O)CO)C 269982a_100000687148_200012027429 [0,1,0,1,0,0|2,0,0]=4 5401 B16R1.75604 CC1CCC(N1CC(=O)NCC(O)CO)C 34a_100000687148_200012027429 [0,1,0,1,0,0|2,0,0]=4 5402 B16R1.1311 CC(NC(=O)NC[C@H](O)CO)C1CCCC1 2708a_100015185923_100020644852 [0,1,0,1,0,0|2,0,0]=4 5403 B16R1.1311 CC(NC(=O)NC[C@H](O)CO)C1CCCC1 273464a_100015185923_100020644852 [0,1,0,1,0,0|2,0,0]=4 5404 B16R1.1311 CC(NC(=O)NC[C@H](O)CO)C1CCCC1 273464a_100020644852_100015185923 [0,1,0,1,0,0|2,0,0]=4 5405 B16R1.1311 CN(CC(=O)NCC(O)CO)C1CCCC1 2230a_100000207505_200012027429 [0,1,0,1,0,0|2,0,0]=4 5406 B16R1.1311 CN(CC(=O)NCC(O)CO)C1CCCC1 269982a_100000207505_200012027429 [0,1,0,1,0,0|2,0,0]=4 5407 B16R1.1311 CN(CC(=O)NCC(O)CO)C1CCCC1 34a_100000207505_200012027429 [0,1,0,1,0,0|2,0,0]=4 5408 B16R1.1311 CN(CC(=O)NC[C@H](O)CO)C1CCCC1 240690a_100020644852_100073796569 [0,1,0,1,0,0|2,0,0]=4 5409 B16R1.1311 CN(CC(=O)NC[C@H](O)CO)C1CCCC1 527a_100020644852_100073796569 [0,1,0,1,0,0|2,0,0]=4 5410 B16R1.1311 O=C(CC(=O)C1CCCC1)NCC(O)CO 1458a_100000210718_200012027429 [0,1,0,1,0,0|1,0,1]=4 5411 B16R1.18308 CN(CC(=O)NCC(O)CO)CC1CCC1 2230a_200000750244_200012027429 [0,1,0,1,0,0|2,0,0]=4 5412 B16R1.18308 CN(CC(=O)NCC(O)CO)CC1CCC1 269982a_200000750244_200012027429 [0,1,0,1,0,0|2,0,0]=4 5413 B16R1.18308 CN(CC(=O)NCC(O)CO)CC1CCC1 34a_200000750244_200012027429 [0,1,0,1,0,0|2,0,0]=4 5414 B16R1.18308 O=C(CC(=O)NCC(O)CO)CC1CCC1 1458a_100000763092_200012027429 [0,1,0,1,0,0|1,0,1]=4 5415 B16R1.18309 O=C(CCC1CC1)CC(=O)NCC(O)CO 1458a_100000756386_200012027429 [0,1,0,1,0,0|1,0,1]=4 5416 B16R1.19435 CCC1CC1C(=O)CC(=O)NCC(O)CO 1458a_200011661523_200012027429 [0,1,0,1,0,0|1,0,1]=4 5417 B16R1.75607 CC(CO)CNC(=O)CC1(CCCCC1)O 240690a_100000744482_100000755886 [0,1,0,1,0,0|2,0,0]=4 5418 B16R1.75607 CC(CO)CNC(=O)CC1(CCCCC1)O 527a_100000744482_100000755886 [0,1,0,1,0,0|2,0,0]=4 5419 B16R1.75607 CC1(CCCCC1)NC(=O)NC[C@H](O)CO 273464a_100000741114_100020644852 [0,1,0,1,0,0|2,0,0]=4 5420 B16R1.75607 CC1(CCCCC1)NC(=O)NC[C@H](O)CO 273464a_100020644852_100000741114 [0,1,0,1,0,0|2,0,0]=4 5421 B16R1.75607 CCC(O)CNC(=O)CC1(CCCCC1)O 240690a_100011218483_100000755886 [0,1,0,1,0,0|2,0,0]=4 5422 B16R1.75607 CCC(O)CNC(=O)CC1(CCCCC1)O 527a_100011218483_100000755886 [0,1,0,1,0,0|2,0,0]=4 5423 B16R1.75607 O=C(CC1(CCCCC1)O)NC[C@@H](F)CO 240690a_100015665980_100000755886 [0,1,0,1,0,0|2,0,0]=4 5424 B16R1.75607 O=C(CC1(CCCCC1)O)NC[C@@H](F)CO 527a_100015665980_100000755886 [0,1,0,1,0,0|2,0,0]=4 5425 B16R1.75607 O=C(CC1(CCCCC1)O)NC[C@H](O)CO 240690a_100020644852_100000755886 [0,1,0,1,0,0|1,0,0]=3 5426 B16R1.75607 O=C(CC1(CCCCC1)O)NC[C@H](O)CO 527a_100020644852_100000755886 [0,1,0,1,0,0|1,0,0]=3 5427 B16R1.131047 CC1CCCC(N1C(=O)NC[C@H](O)CO)C 273464a_100020644852_100000210447 [0,1,0,1,0,0|2,0,0]=4 5428 B16R2.2843 O=C(CC1CCCCC1)C2CCC(C2)O 1458a_100000688591_100000211423 [0,0,0,2,0,0|2,0,0]=4 5429 B16R2.2843 O=C(CC1CCCCC1)N2CCC(C2)O 240690a_100011215560_100000211666 [0,0,0,2,0,0|2,0,0]=4 5430 B16R2.2843 O=C(CC1CCCCC1)N2CCC(C2)O 527a_100011215560_100000211666 [0,0,0,2,0,0|2,0,0]=4 5431 B16R2.2855 O=C(CCC1CCCC1)C2CCC(C2)O 1458a_100000688591_100000760354 [0,0,0,2,0,0|2,0,0]=4 5432 B16R2.2855 O=C(CCC1CCCC1)N2CCC(C2)O 240690a_100011215560_100000211120 [0,0,0,2,0,0|2,0,0]=4 5433 B16R2.2855 O=C(CCC1CCCC1)N2CCC(C2)O 527a_100011215560_100000211120 [0,0,0,2,0,0|2,0,0]=4 5434 B16R2.11440 CC1CCCCC1C(=O)N2CCC(C2)O 240690a_100011215560_100011215568 [0,0,0,2,0,0|2,0,0]=4 5435 B16R2.11440 CC1CCCCC1C(=O)N2CCC(C2)O 527a_100011215560_100011215568 [0,0,0,2,0,0|2,0,0]=4 5436 B16R2.79192 O=C(C1CCCCCC1)C2CCC(C2)O 1458a_100000688591_100011217769 [0,0,0,2,0,0|2,0,0]=4 5437 B16R2.79192 O=C(C1CCCCCC1)N2CCC(C2)O 240690a_100011215560_100000749507 [0,0,0,2,0,0|2,0,0]=4 5438 B16R2.79192 O=C(C1CCCCCC1)N2CCC(C2)O 527a_100011215560_100000749507 [0,0,0,2,0,0|2,0,0]=4 5439 B16R2.1357 OCC(O)COC1CCC2CCCC2C1 34a_100000073670_100011219619 [0,0,0,2,0,0|1,0,1]=4 5440 B16R2.1357 OCC(O)COC1CCC2CCCC2C1 7a_100000073670_100011219619 [0,0,0,2,0,0|1,0,1]=4 5441 B16R2.1357 OC[C@H](O)COC1CCC2CCCC2C1 34a_100000073670_100009815848 [0,0,0,2,0,0|1,0,1]=4 5442 B16R2.1357 OC[C@H](O)COC1CCC2CCCC2C1 7a_100000073670_100009815848 [0,0,0,2,0,0|1,0,1]=4 5443 B16R2.1895 O=C(CC1CCCCC1)C2CC(C2)CO 1458a_206645079618_100000211423 [0,0,0,2,0,0|2,0,0]=4 5444 B16R2.1895 O=C(CC1CCCCC1)N2CC(C2)CO 240690a_100016987283_100000211666 [0,0,0,2,0,0|2,0,0]=4 5445 B16R2.1895 O=C(CC1CCCCC1)N2CC(C2)CO 527a_100016987283_100000211666 [0,0,0,2,0,0|2,0,0]=4 5446 B16R2.3341 C[C@H]1[C@H](CN1C(=O)CC2CCCCC2)O 11a_206633788156_100000211666 [0,0,0,2,0,0|2,0,0]=4 5447 B16R2.3341 C[C@H]1[C@H](CN1C(=O)CC2CCCCC2)O 240690a_206633788156_100000211666 [0,0,0,2,0,0|2,0,0]=4 5448 B16R2.3341 C[C@H]1[C@H](CN1C(=O)CC2CCCCC2)O 527a_206633788156_100000211666 [0,0,0,2,0,0|2,0,0]=4 5449 B16R2.10948 O=C(CC1CCCCC1)NCC2COC2 11a_100015281925_100000211666 [0,0,0,2,0,0|2,0,0]=4 5450 B16R2.10948 O=C(CC1CCCCC1)NCC2COC2 1626a_100015281925_100000211666 [0,0,0,2,0,0|2,0,0]=4 5451 B16R2.10948 O=C(CC1CCCCC1)NCC2COC2 240690a_100015281925_100000211666 [0,0,0,2,0,0|2,0,0]=4 5452 B16R2.10948 O=C(CC1CCCCC1)NCC2COC2 527a_100015281925_100000211666 [0,0,0,2,0,0|2,0,0]=4 5453 B16R2.10948 O=C(CC1CCCCC1)NC[C@@H]2CCO2 11a_100020831831_100000211666 [0,0,0,2,0,0|2,0,0]=4 5454 B16R2.10948 O=C(CC1CCCCC1)NC[C@@H]2CCO2 1626a_100020831831_100000211666 [0,0,0,2,0,0|2,0,0]=4 5455 B16R2.10948 O=C(CC1CCCCC1)NC[C@@H]2CCO2 240690a_100020831831_100000211666 [0,0,0,2,0,0|2,0,0]=4 5456 B16R2.10948 O=C(CC1CCCCC1)NC[C@@H]2CCO2 527a_100020831831_100000211666 [0,0,0,2,0,0|2,0,0]=4 5457 B16R2.84381 O=C(NC[C@H](O)CO)N1C2CCC1CC2 273464a_100020644852_100000735658 [0,0,0,2,0,0|2,0,0]=4 5458 B16R2.147271 O=C(CC1CCCCC1)NCC2(CC2)O 11a_100011936951_100000211666 [0,0,0,2,0,0|2,0,0]=4 5459 B16R2.147271 O=C(CC1CCCCC1)NCC2(CC2)O 240690a_100011936951_100000211666 [0,0,0,2,0,0|2,0,0]=4 5460 B16R2.147271 O=C(CC1CCCCC1)NCC2(CC2)O 527a_100011936951_100000211666 [0,0,0,2,0,0|2,0,0]=4 5461 B16R2.171588 O=C(CN1CC2CC2C1)NCC(O)CO 2230a_100000741873_200012027429 [0,0,0,2,0,0|2,0,0]=4 5462 B16R2.171588 O=C(CN1CC2CC2C1)NCC(O)CO 269982a_100000741873_200012027429 [0,0,0,2,0,0|2,0,0]=4 5463 B16R2.171588 O=C(CN1CC2CC2C1)NCC(O)CO 34a_100000741873_200012027429 [0,0,0,2,0,0|2,0,0]=4 5464 B16R2.326913 CC(CO)CNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 240690a_100000744482_100153394716 [0,0,0,2,0,0|2,0,0]=4 5465 B16R2.326913 CC(CO)CNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 527a_100000744482_100153394716 [0,0,0,2,0,0|2,0,0]=4 5466 B16R2.326913 CCC(O)CNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 11a_100011218483_100153394716 [0,0,0,2,0,0|2,0,0]=4 5467 B16R2.326913 CCC(O)CNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 240690a_100011218483_100153394716 [0,0,0,2,0,0|2,0,0]=4 5468 B16R2.326913 CCC(O)CNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 527a_100011218483_100153394716 [0,0,0,2,0,0|2,0,0]=4 5469 B16R2.326913 O=C(NC[C@@H](F)CO)[C@H]1[C@H]2[C@@H]1CCCC2 240690a_100015665980_100153394716 [0,0,0,2,0,0|2,0,0]=4 5470 B16R2.326913 O=C(NC[C@@H](F)CO)[C@H]1[C@H]2[C@@H]1CCCC2 527a_100015665980_100153394716 [0,0,0,2,0,0|2,0,0]=4 5471 B16R2.326913 O=C(NC[C@H](O)CO)[C@H]1[C@H]2[C@@H]1CCCC2 240690a_100020644852_100153394716 [0,0,0,2,0,0|1,0,0]=3 5472 B16R2.326913 O=C(NC[C@H](O)CO)[C@H]1[C@H]2[C@@H]1CCCC2 527a_100020644852_100153394716 [0,0,0,2,0,0|1,0,0]=3 5473 B16R2.1912 O=C(CCC1CCCC1)C2CC(C2)CO 1458a_206645079618_100000760354 [0,0,0,2,0,0|2,0,0]=4 5474 B16R2.1912 O=C(CCC1CCCC1)N2CC(C2)CO 240690a_100016987283_100000211120 [0,0,0,2,0,0|2,0,0]=4 5475 B16R2.1912 O=C(CCC1CCCC1)N2CC(C2)CO 527a_100016987283_100000211120 [0,0,0,2,0,0|2,0,0]=4 5476 B16R2.15658 C[C@H]1[C@H](CN1C(=O)CCC2CCCC2)O 11a_206633788156_100000211120 [0,0,0,2,0,0|2,0,0]=4 5477 B16R2.15658 C[C@H]1[C@H](CN1C(=O)CCC2CCCC2)O 240690a_206633788156_100000211120 [0,0,0,2,0,0|2,0,0]=4 5478 B16R2.15658 C[C@H]1[C@H](CN1C(=O)CCC2CCCC2)O 527a_206633788156_100000211120 [0,0,0,2,0,0|2,0,0]=4 5479 B16R2.44159 O=C(CCC1CCCC1)NCC2(CC2)O 11a_100011936951_100000211120 [0,0,0,2,0,0|2,0,0]=4 5480 B16R2.44159 O=C(CCC1CCCC1)NCC2(CC2)O 240690a_100011936951_100000211120 [0,0,0,2,0,0|2,0,0]=4 5481 B16R2.44159 O=C(CCC1CCCC1)NCC2(CC2)O 527a_100011936951_100000211120 [0,0,0,2,0,0|2,0,0]=4 5482 B16R2.84414 CC(CO)CNC(=O)C1CC2CCC1C2 240690a_100000744482_100000181847 [0,0,0,2,0,0|2,0,0]=4 5483 B16R2.84414 CC(CO)CNC(=O)C1CC2CCC1C2 527a_100000744482_100000181847 [0,0,0,2,0,0|2,0,0]=4 5484 B16R2.84414 CCC(O)CNC(=O)C1CC2CCC1C2 11a_100011218483_100000181847 [0,0,0,2,0,0|2,0,0]=4 5485 B16R2.84414 CCC(O)CNC(=O)C1CC2CCC1C2 240690a_100011218483_100000181847 [0,0,0,2,0,0|2,0,0]=4 5486 B16R2.84414 CCC(O)CNC(=O)C1CC2CCC1C2 527a_100011218483_100000181847 [0,0,0,2,0,0|2,0,0]=4 5487 B16R2.84414 O=C(NC[C@@H](F)CO)C1CC2CCC1C2 240690a_100015665980_100000181847 [0,0,0,2,0,0|2,0,0]=4 5488 B16R2.84414 O=C(NC[C@@H](F)CO)C1CC2CCC1C2 527a_100015665980_100000181847 [0,0,0,2,0,0|2,0,0]=4 5489 B16R2.84414 O=C(NC[C@H](O)CO)C1CC2CCC1C2 240690a_100020644852_100000181847 [0,0,0,2,0,0|1,0,0]=3 5490 B16R2.84414 O=C(NC[C@H](O)CO)C1CC2CCC1C2 527a_100020644852_100000181847 [0,0,0,2,0,0|1,0,0]=3 5491 B16R2.84414 O=C(NC[C@H](O)CO)N1CC2CCC1C2 273464a_100020644852_100000743476 [0,0,0,2,0,0|2,0,0]=4 5492 B16R2.214628 O=C(CCC1CCCC1)NCC2COC2 11a_100015281925_100000211120 [0,0,0,2,0,0|2,0,0]=4 5493 B16R2.214628 O=C(CCC1CCCC1)NCC2COC2 1626a_100015281925_100000211120 [0,0,0,2,0,0|2,0,0]=4 5494 B16R2.214628 O=C(CCC1CCCC1)NCC2COC2 240690a_100015281925_100000211120 [0,0,0,2,0,0|2,0,0]=4 5495 B16R2.214628 O=C(CCC1CCCC1)NCC2COC2 527a_100015281925_100000211120 [0,0,0,2,0,0|2,0,0]=4 5496 B16R2.214628 O=C(CCC1CCCC1)NC[C@@H]2CCO2 11a_100020831831_100000211120 [0,0,0,2,0,0|2,0,0]=4 5497 B16R2.214628 O=C(CCC1CCCC1)NC[C@@H]2CCO2 1626a_100020831831_100000211120 [0,0,0,2,0,0|2,0,0]=4 5498 B16R2.214628 O=C(CCC1CCCC1)NC[C@@H]2CCO2 240690a_100020831831_100000211120 [0,0,0,2,0,0|2,0,0]=4 5499 B16R2.214628 O=C(CCC1CCCC1)NC[C@@H]2CCO2 527a_100020831831_100000211120 [0,0,0,2,0,0|2,0,0]=4 5500 B16R2.12488 CC1CCCCC1C(=O)NCC2(CC2)O 11a_100011936951_100011215568 [0,0,0,2,0,0|2,0,0]=4 5501 B16R2.12488 CC1CCCCC1C(=O)NCC2(CC2)O 240690a_100011936951_100011215568 [0,0,0,2,0,0|2,0,0]=4 5502 B16R2.12488 CC1CCCCC1C(=O)NCC2(CC2)O 527a_100011936951_100011215568 [0,0,0,2,0,0|2,0,0]=4 5503 B16R2.40888 CC1CCCCC1C(=O)N2CC(C2)CO 240690a_100016987283_100011215568 [0,0,0,2,0,0|2,0,0]=4 5504 B16R2.40888 CC1CCCCC1C(=O)N2CC(C2)CO 527a_100016987283_100011215568 [0,0,0,2,0,0|2,0,0]=4 5505 B16R2.83938 CC1CCCCC1C(=O)N2C[C@@H]([C@@H]2C)O 11a_206633788156_100011215568 [0,0,0,2,0,0|2,0,0]=4 5506 B16R2.83938 CC1CCCCC1C(=O)N2C[C@@H]([C@@H]2C)O 240690a_206633788156_100011215568 [0,0,0,2,0,0|2,0,0]=4 5507 B16R2.83938 CC1CCCCC1C(=O)N2C[C@@H]([C@@H]2C)O 527a_206633788156_100011215568 [0,0,0,2,0,0|2,0,0]=4 5508 B16R2.95971 CC1CCCCC1C(=O)NCC2COC2 11a_100015281925_100011215568 [0,0,0,2,0,0|2,0,0]=4 5509 B16R2.95971 CC1CCCCC1C(=O)NCC2COC2 1626a_100015281925_100011215568 [0,0,0,2,0,0|2,0,0]=4 5510 B16R2.95971 CC1CCCCC1C(=O)NCC2COC2 240690a_100015281925_100011215568 [0,0,0,2,0,0|2,0,0]=4 5511 B16R2.95971 CC1CCCCC1C(=O)NCC2COC2 527a_100015281925_100011215568 [0,0,0,2,0,0|2,0,0]=4 5512 B16R2.95971 CC1CCCCC1C(=O)NC[C@@H]2CCO2 11a_100020831831_100011215568 [0,0,0,2,0,0|2,0,0]=4 5513 B16R2.95971 CC1CCCCC1C(=O)NC[C@@H]2CCO2 1626a_100020831831_100011215568 [0,0,0,2,0,0|2,0,0]=4 5514 B16R2.95971 CC1CCCCC1C(=O)NC[C@@H]2CCO2 240690a_100020831831_100011215568 [0,0,0,2,0,0|2,0,0]=4 5515 B16R2.95971 CC1CCCCC1C(=O)NC[C@@H]2CCO2 527a_100020831831_100011215568 [0,0,0,2,0,0|2,0,0]=4 5516 B16R2.293591 O=C(NCC1COC1)C2CCCCCC2 11a_100015281925_100000749507 [0,0,0,2,0,0|2,0,0]=4 5517 B16R2.293591 O=C(NCC1COC1)C2CCCCCC2 1626a_100015281925_100000749507 [0,0,0,2,0,0|2,0,0]=4 5518 B16R2.293591 O=C(NCC1COC1)C2CCCCCC2 240690a_100015281925_100000749507 [0,0,0,2,0,0|2,0,0]=4 5519 B16R2.293591 O=C(NCC1COC1)C2CCCCCC2 527a_100015281925_100000749507 [0,0,0,2,0,0|2,0,0]=4 5520 B16R2.293591 O=C(NC[C@@H]1CCO1)C2CCCCCC2 11a_100020831831_100000749507 [0,0,0,2,0,0|2,0,0]=4 5521 B16R2.293591 O=C(NC[C@@H]1CCO1)C2CCCCCC2 1626a_100020831831_100000749507 [0,0,0,2,0,0|2,0,0]=4 5522 B16R2.293591 O=C(NC[C@@H]1CCO1)C2CCCCCC2 240690a_100020831831_100000749507 [0,0,0,2,0,0|2,0,0]=4 5523 B16R2.293591 O=C(NC[C@@H]1CCO1)C2CCCCCC2 527a_100020831831_100000749507 [0,0,0,2,0,0|2,0,0]=4 5524 B16R2.691970 O=C(NCC1(CC1)O)C2CCCCCC2 11a_100011936951_100000749507 [0,0,0,2,0,0|2,0,0]=4 5525 B16R2.691970 O=C(NCC1(CC1)O)C2CCCCCC2 240690a_100011936951_100000749507 [0,0,0,2,0,0|2,0,0]=4 5526 B16R2.691970 O=C(NCC1(CC1)O)C2CCCCCC2 527a_100011936951_100000749507 [0,0,0,2,0,0|2,0,0]=4 5527 B16R2.101002 C[C@H]1[C@H](CN1C(=O)C2CCCCCC2)O 11a_206633788156_100000749507 [0,0,0,2,0,0|2,0,0]=4 5528 B16R2.101002 C[C@H]1[C@H](CN1C(=O)C2CCCCCC2)O 240690a_206633788156_100000749507 [0,0,0,2,0,0|2,0,0]=4 5529 B16R2.101002 C[C@H]1[C@H](CN1C(=O)C2CCCCCC2)O 527a_206633788156_100000749507 [0,0,0,2,0,0|2,0,0]=4 5530 B16R2.200735 O=C(C1CCCCCC1)C2CC(C2)CO 1458a_206645079618_100011217769 [0,0,0,2,0,0|2,0,0]=4 5531 B16R2.200735 O=C(C1CCCCCC1)N2CC(C2)CO 240690a_100016987283_100000749507 [0,0,0,2,0,0|2,0,0]=4 5532 B16R2.200735 O=C(C1CCCCCC1)N2CC(C2)CO 527a_100016987283_100000749507 [0,0,0,2,0,0|2,0,0]=4 5533 B12R0.4 C#CCCCCCC(=O)CC(C)O 1458a_100000694772_100011218427 [1,0,0,0,1,0|0,0,2]=4 5534 B12R0.4 C#CCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100012094781 [1,0,0,0,1,0|0,0,2]=4 5535 B12R0.4 C=C(C)CC(=O)CCCCCCC 1458a_100000211969_100000748629 [1,0,0,0,1,0|1,0,1]=4 5536 B12R0.4 C=CCCCCCC(=O)CC(C)O 1458a_100011934241_100011218427 [1,0,0,0,1,0|0,0,2]=4 5537 B12R0.4 C=CCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000700193 [1,0,0,0,1,0|0,0,2]=4 5538 B12R0.4 CC(C)CC(=O)CCCCCCF 1458a_100000210554_100015922095 [1,0,0,0,1,0|2,0,0]=4 5539 B12R0.4 CC(C)CC(=O)CCCCCCO 1458a_100000210554_100000766143 [1,0,0,0,1,0|2,0,0]=4 5540 B12R0.4 CC(C)CC(=O)CCCCCCO 1458a_100011996774_100000210624 [1,0,0,0,1,0|2,0,0]=4 5541 B12R0.4 CC(C)OC(=O)CCCCCS[13CH3] 62a_200010986244_200025704644 [1,0,0,0,1,0|2,0,0]=4 5542 B12R0.4 CC(C)OC(=O)CCCCCS[13CH3] 62a_200025704644_200010986244 [1,0,0,0,1,0|2,0,0]=4 5543 B12R0.4 CC(O)CC(=O)CCCCCCO 1458a_100011996774_100011218427 [1,0,0,0,1,0|1,0,0]=3 5544 B12R0.4 CCCC/C=C/CC(=O)CC(C)O 1458a_200016282684_100011218427 [1,0,0,0,1,0|0,0,2]=4 5545 B12R0.4 CCCCCC#CC(=O)CC(C)O 1458a_100011215388_100011218427 [1,0,0,0,1,0|0,0,2]=4 5546 B12R0.4 CCCCCC=CC(=O)CC(C)O 1458a_100016263427_100011218427 [1,0,0,0,1,0|0,0,2]=4 5547 B12R0.4 CCCCCCCC(=O)CC(C)C 1458a_100000210554_100000210614 [1,0,0,0,1,0|1,0,0]=3 5548 B12R0.4 CCCCCCCC(=O)CC(C)C 1458a_100000211969_100000210624 [1,0,0,0,1,0|1,0,0]=3 5549 B12R0.4 CCCCCCCC(=O)CC(C)O 1458a_100000211969_100011218427 [1,0,0,0,1,0|0,0,0]=2 5550 B12R0.4 CCCCCCCC(=O)CC(F)F 1458a_100000211969_100011934356 [1,0,0,0,1,0|2,0,0]=4 5551 B12R0.4 CCCCCCCC(=O)CN(C)C 1458a_100000750896_100000210614 [1,0,0,0,1,0|2,0,0]=4 5552 B12R0.4 CCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210614 [1,0,0,0,1,0|0,0,0]=2 5553 B12R0.4 CCCCCCCC(=O)C[S+](C)C 1458a_200159257847_100000210614 [1,0,0,0,1,0|2,0,0]=4 5554 B12R0.4 CCCCCCCC(=O)NC(C)C 11a_100138425928_100000211969 [1,0,0,0,1,0|2,0,0]=4 5555 B12R0.4 CCCCCCCC(=O)NC(C)C 1626a_100138425928_100000211969 [1,0,0,0,1,0|2,0,0]=4 5556 B12R0.4 CCCCCCCC(=O)NC(C)C 240690a_100138425928_100000211969 [1,0,0,0,1,0|2,0,0]=4 5557 B12R0.4 CCCCCCCC(=O)NC(C)C 527a_100138425928_100000211969 [1,0,0,0,1,0|2,0,0]=4 5558 B12R0.4 CCCCCCCN(C)CC(C)O 2230a_100000227577_100000210681 [1,0,0,0,1,0|2,0,0]=4 5559 B12R0.4 CCCCCCCN(C)CC(C)O 2230a_100000228206_100011218427 [1,0,0,0,1,0|2,0,0]=4 5560 B12R0.4 CCCCCCCN(C)CC(C)O 269982a_100000227577_100000210681 [1,0,0,0,1,0|2,0,0]=4 5561 B12R0.4 CCCCCCCN(C)CC(C)O 269982a_100000228206_100011218427 [1,0,0,0,1,0|2,0,0]=4 5562 B12R0.4 CCCCCCCN(C)C[C@@H](C)O 2230a_100000228206_100009817552 [1,0,0,0,1,0|2,0,0]=4 5563 B12R0.4 CCCCCCCN(C)C[C@@H](C)O 269982a_100000228206_100009817552 [1,0,0,0,1,0|2,0,0]=4 5564 B12R0.4 CCCCCCNC(=O)CC(C)C 11a_100000210581_100000210554 [1,0,0,0,1,0|2,0,0]=4 5565 B12R0.4 CCCCCCNC(=O)CC(C)C 1626a_100000210581_100000210554 [1,0,0,0,1,0|2,0,0]=4 5566 B12R0.4 CCCCCCNC(=O)CC(C)C 240690a_100000210581_100000210554 [1,0,0,0,1,0|2,0,0]=4 5567 B12R0.4 CCCCCCNC(=O)CC(C)C 527a_100000210581_100000210554 [1,0,0,0,1,0|2,0,0]=4 5568 B12R0.4 CCCCCCNC(=O)C[C@@H](C)O 240690a_100000210581_100011933948 [1,0,0,0,1,0|1,0,0]=3 5569 B12R0.4 CCCCCNCC(=O)OC(C)C 2230a_100000209983_100011215430 [1,0,0,0,1,0|2,0,0]=4 5570 B12R0.4 CCCCCNNC(=O)C[C@@H](C)O 22a_100000694160_100011933948 [1,0,0,0,1,0|2,0,0]=4 5571 B12R0.4 CCCCCOCC(=O)OC(C)C 34a_100000210253_100011215430 [1,0,0,0,1,0|2,0,0]=4 5572 B12R0.4 CCCCCOCC(=O)OC(C)C 7a_100000210253_100011215430 [1,0,0,0,1,0|2,0,0]=4 5573 B12R0.4 CCCCCSCC(=O)OC(C)C 62a_100000210326_100011215430 [1,0,0,0,1,0|2,0,0]=4 5574 B12R0.4 CCCCCSCC(=O)OC(C)C 62a_100011215430_100000210326 [1,0,0,0,1,0|2,0,0]=4 5575 B12R0.4 CCCCNCCC(=O)OC(C)C 2230a_100000102301_100000760027 [1,0,0,0,1,0|2,0,0]=4 5576 B12R0.4 CCCCNCCC(=O)OC(C)C 7a_106832991798_100000760027 [1,0,0,0,1,0|2,0,0]=4 5577 B12R0.4 CCCCOCCC(=O)CC(C)C 1458a_100000210554_100000743108 [1,0,0,0,1,0|2,0,0]=4 5578 B12R0.4 CCCCOCCC(=O)C[C@@H](C)O 1458a_100011933948_100000743108 [1,0,0,0,1,0|1,0,0]=3 5579 B12R0.4 CCCCOCCC(=O)OC(C)C 7a_100000210227_100000760027 [1,0,0,0,1,0|2,0,0]=4 5580 B12R0.4 CCCCSCCC(=O)OC(C)C 62a_100000210211_100000760027 [1,0,0,0,1,0|2,0,0]=4 5581 B12R0.4 CCCCSCCC(=O)OC(C)C 62a_100000760027_100000210210 [1,0,0,0,1,0|2,0,0]=4 5582 B12R0.4 CCCOCCNC(=O)C[C@@H](C)O 240690a_100161115042_100011933948 [1,0,0,0,1,0|2,0,0]=4 5583 B12R0.4 CCCSCCNC(=O)C[C@@H](C)O 240690a_100020603323_100011933948 [1,0,0,0,1,0|2,0,0]=4 5584 B12R0.4 CCOCCCNC(=O)C[C@@H](C)O 240690a_100000210961_100011933948 [1,0,0,0,1,0|2,0,0]=4 5585 B12R0.4 CNCCCCCC(=O)OC(C)C 2230a_106832991635_200010986244 [1,0,0,0,1,0|2,0,0]=4 5586 B12R0.4 CNCCCCCC(=O)OC(C)C 34a_100102657272_200010986244 [1,0,0,0,1,0|2,0,0]=4 5587 B12R0.4 CNCCCCCC(=O)OC(C)C 7a_106832991635_200010986244 [1,0,0,0,1,0|2,0,0]=4 5588 B12R0.4 COCCCCCC(=O)CC(C)C 1458a_100011935119_100000210624 [1,0,0,0,1,0|2,0,0]=4 5589 B12R0.4 COCCCCCC(=O)CC(C)O 1458a_100011935119_100011218427 [1,0,0,0,1,0|1,0,0]=3 5590 B12R0.4 COCCCCCC(=O)OC(C)C 34a_100138415774_200010986244 [1,0,0,0,1,0|2,0,0]=4 5591 B12R0.4 COCCOCCC(=O)CC(C)O 1458a_100000745395_100011218427 [1,0,0,0,1,0|2,0,0]=4 5592 B12R0.4 COCCOCCC(=O)C[C@@H](C)O 1458a_100011933948_100000695917 [1,0,0,0,1,0|2,0,0]=4 5593 B12R0.4 CSCCCCCC(=O)OC(C)C 62a_200000210301_200010986244 [1,0,0,0,1,0|2,0,0]=4 5594 B12R0.4 CSCCCCCC(=O)OC(C)C 62a_200010986244_200000210301 [1,0,0,0,1,0|2,0,0]=4 5595 B12R0.4 C[C@@H](O)CC(=O)CCCCCC#N 1458a_100011933948_100009813376 [1,0,0,0,1,0|1,0,1]=4 5596 B12R0.4 C[C@@H](O)CC(=O)CCCCCCF 1458a_100011933948_100015922095 [1,0,0,0,1,0|1,0,0]=3 5597 B12R0.4 C[C@@H](O)CC(=O)CCCCCCO 1458a_100011933948_100000766143 [1,0,0,0,1,0|1,0,0]=3 5598 B12R0.4 C[C@@H](O)CC(=O)NCCCCCO 240690a_100000762737_100011933948 [1,0,0,0,1,0|2,0,0]=4 5599 B12R0.113 CCC(O)CC(=O)CCCCCF 1458a_100011667805_100000729378 [1,0,0,0,1,0|2,0,0]=4 5600 B12R0.113 CCC(O)CC(=O)CCCCCO 1458a_100011667805_100000746330 [1,0,0,0,1,0|2,0,0]=4 5601 B12R0.113 CCC(O)CC(=O)CCCCCO 1458a_100102619762_100011218378 [1,0,0,0,1,0|2,0,0]=4 5602 B12R0.113 CCC(O)CC(=O)CCCCOC 1458a_100011667805_100000755781 [1,0,0,0,1,0|2,0,0]=4 5603 B12R0.113 CCCCCCC(=O)CC(C)CC 1458a_100000708755_100000210757 [1,0,0,0,1,0|2,0,0]=4 5604 B12R0.113 CCCCCCC(=O)CC(C)CC 1458a_100102632555_100000748023 [1,0,0,0,1,0|2,0,0]=4 5605 B12R0.113 CCCCCCC(=O)CC(O)CC 1458a_100011667805_100000210757 [1,0,0,0,1,0|1,0,0]=3 5606 B12R0.113 CCCCCCC(=O)CC(O)CC 1458a_100102632555_100011218378 [1,0,0,0,1,0|1,0,0]=3 5607 B12R0.113 CCCCCCC(=O)C[C@@H](C)CC 1458a_100102632555_100009816398 [1,0,0,0,1,0|2,0,0]=4 5608 B12R0.113 CCCCCCC(=O)C[C@@H](C)CO 1458a_100102632555_100000059175 [1,0,0,0,1,0|1,0,0]=3 5609 B12R0.113 CCCCCCC(=O)N[C@H](C)CO 240690a_100000737577_100102632555 [1,0,0,0,1,0|2,0,0]=4 5610 B12R0.113 CCCCCCC(=O)N[C@H](C)CO 527a_100000737577_100102632555 [1,0,0,0,1,0|2,0,0]=4 5611 B12R0.113 CCCCCCN(C)CC(O)CO 2230a_100011216503_100000210314 [1,0,0,0,1,0|2,0,0]=4 5612 B12R0.113 CCCCCCN(C)CC(O)CO 2230a_106256046315_100011219619 [1,0,0,0,1,0|2,0,0]=4 5613 B12R0.113 CCCCCCN(C)CC(O)CO 269982a_100011216503_100000210757 [1,0,0,0,1,0|2,0,0]=4 5614 B12R0.113 CCCCCCN(C)C[C@@H](O)CO 2230a_106256046315_100009815848 [1,0,0,0,1,0|2,0,0]=4 5615 B12R0.113 CCCCCNC(=O)CC(O)CC 1626a_100000209983_100011667805 [1,0,0,0,1,0|2,0,0]=4 5616 B12R0.113 CCCCCNC(=O)CC(O)CC 240690a_100000209983_100011667805 [1,0,0,0,1,0|2,0,0]=4 5617 B12R0.113 CCCCOCC(=O)CC(O)CC 1458a_100000757543_100011218378 [1,0,0,0,1,0|2,0,0]=4 5618 B12R0.113 CCCCOCC(=O)CC(O)CC 1458a_100011667805_100011995733 [1,0,0,0,1,0|2,0,0]=4 5619 B12R0.113 CCCCOCC(=O)C[C@@H](C)CO 1458a_100000757543_100000059175 [1,0,0,0,1,0|2,0,0]=4 5620 B12R0.113 CCCCSCC(=O)CC(O)CC 1458a_100000191162_100011218378 [1,0,0,0,1,0|2,0,0]=4 5621 B12R0.113 CCCCSCC(=O)C[C@@H](C)CO 1458a_100000191162_100000059175 [1,0,0,0,1,0|2,0,0]=4 5622 B12R0.113 CCCOCCC(=O)CC(O)CC 1458a_100011667805_100011215938 [1,0,0,0,1,0|2,0,0]=4 5623 B12R0.113 CCOCCCC(=O)CC(O)CC 1458a_100011667805_100012232248 [1,0,0,0,1,0|2,0,0]=4 5624 B12R0.113 C[C@@H](CO)CC(=O)CCCCCO 1458a_100102619762_100000059175 [1,0,0,0,1,0|2,0,0]=4 5625 B12R0.49 C#CCCCCCC(=O)C(O)CO 1458a_100011215603_100012094781 [0,0,0,0,2,0|0,0,2]=4 5626 B12R0.49 C=CCCCCCC(=O)C(O)CO 1458a_100011215603_100000700193 [0,0,0,0,2,0|0,0,2]=4 5627 B12R0.49 CCC(O)C(=O)CCCCCCF 1458a_100011196387_100015922095 [0,0,0,0,2,0|2,0,0]=4 5628 B12R0.49 CCC(O)C(=O)CCCCCCO 1458a_100011196387_100000766143 [0,0,0,0,2,0|2,0,0]=4 5629 B12R0.49 CCCCCCCC(=O)C(C)CC 1458a_100000211969_100000758301 [0,0,0,0,2,0|2,0,0]=4 5630 B12R0.49 CCCCCCCC(=O)C(C)CC 1458a_100011192722_100000210614 [0,0,0,0,2,0|2,0,0]=4 5631 B12R0.49 CCCCCCCC(=O)C(O)CC 1458a_100011196387_100000210614 [0,0,0,0,2,0|1,0,0]=3 5632 B12R0.49 CCCCCCCC(=O)C(O)CO 1458a_100011215603_100000210614 [0,0,0,0,2,0|0,0,0]=2 5633 B12R0.49 CCCCCCNC(=O)C(O)CC 240690a_100000210581_100011196387 [0,0,0,0,2,0|2,0,0]=4 5634 B12R0.49 CCCCCCNC(=O)C(O)CO 240690a_100000210581_100011215603 [0,0,0,0,2,0|1,0,0]=3 5635 B12R0.49 CCCCCNNC(=O)C(O)CO 22a_100000694160_100011215603 [0,0,0,0,2,0|2,0,0]=4 5636 B12R0.49 CCCCOCCC(=O)C(O)CC 1458a_100011196387_100000743108 [0,0,0,0,2,0|2,0,0]=4 5637 B12R0.49 CCCCOCCC(=O)C(O)CO 1458a_100011215603_100000743108 [0,0,0,0,2,0|1,0,0]=3 5638 B12R0.49 CCCOCCNC(=O)C(O)CO 240690a_100161115042_100011215603 [0,0,0,0,2,0|2,0,0]=4 5639 B12R0.49 CCCSCCNC(=O)C(O)CO 240690a_100020603323_100011215603 [0,0,0,0,2,0|2,0,0]=4 5640 B12R0.49 CCOCCCNC(=O)C(O)CO 240690a_100000210961_100011215603 [0,0,0,0,2,0|2,0,0]=4 5641 B12R0.49 COCCOCCC(=O)C(O)CO 1458a_100011215603_100000695917 [0,0,0,0,2,0|2,0,0]=4 5642 B12R0.49 N#CCCCCCC(=O)C(O)CO 1458a_100011215603_100009813376 [0,0,0,0,2,0|1,0,1]=4 5643 B12R0.49 O=C(CCCCCCF)C(O)CO 1458a_100011215603_100015922095 [0,0,0,0,2,0|1,0,0]=3 5644 B12R0.49 O=C(CCCCCCO)C(O)CO 1458a_100011215603_100000766143 [0,0,0,0,2,0|1,0,0]=3 5645 B12R0.49 O=C(NCCCCCO)C(O)CO 240690a_100000762737_100011215603 [0,0,0,0,2,0|2,0,0]=4 5646 B16R0.108 C=CC(O)CSCOC(=O)CCCCCCC 62a_100000730141_100009852258 [0,0,0,0,0,2|1,0,1]=4 5647 B16R0.108 CCCCCCCC(=O)OCNCC(C)CC 2230a_100020588543_100009852258 [0,0,0,0,0,2|2,0,0]=4 5648 B16R0.108 CCCCCCCC(=O)OCNCC(C)CO 34a_100000744482_100009852258 [0,0,0,0,0,2|1,0,0]=3 5649 B16R0.108 CCCCCCCC(=O)OCNCC(O)CC 2230a_100011218483_100009852258 [0,0,0,0,0,2|1,0,0]=3 5650 B16R0.108 CCCCCCCC(=O)OCNC[C@@H](F)CO 34a_100015665980_100009852258 [0,0,0,0,0,2|1,0,0]=3 5651 B16R0.108 CCCCCCCC(=O)OCNC[C@H](O)CO 2230a_100020644852_100009852258 [0,0,0,0,0,2|0,0,0]=2 5652 B16R0.108 CCCCCCCC(=O)OCOCC(C)CN 34a_100000744482_100009852258 [0,0,0,0,0,2|2,0,0]=4 5653 B16R0.108 CCCCCCCC(=O)OCOCC(Cl)CCl 34a_100000033668_100009852258 [0,0,0,0,0,2|2,0,0]=4 5654 B16R0.108 CCCCCCCC(=O)OCOC[C@@H](C)CC 7a_100009816381_100009852258 [0,0,0,0,0,2|2,0,0]=4 5655 B16R0.108 CCCCCCCC(=O)OCOC[C@H](F)CN 34a_100015665980_100009852258 [0,0,0,0,0,2|2,0,0]=4 5656 B16R0.108 CCCCCCCC(=O)OCSCC(C)CC 62a_100000748023_100009852258 [0,0,0,0,0,2|2,0,0]=4 5657 B16R0.108 CCCCCCCC(=O)OCSCC(O)CC 62a_100011218378_100009852258 [0,0,0,0,0,2|1,0,0]=3 5658 B16R0.108 CCCCCCCC(=O)OCSCC(O)CO 62a_100011219619_100009852258 [0,0,0,0,0,2|0,0,0]=2 5659 B16R0.108 CCCCCCCC(=O)OCSC[C@@H](C)CC 62a_100009816398_100009852258 [0,0,0,0,0,2|2,0,0]=4 5660 B16R0.108 CCCCCCCC(=O)OCSC[C@@H](C)CO 62a_100000059175_100009852258 [0,0,0,0,0,2|1,0,0]=3 5661 B16R0.108 CCCCCCCC(=O)OCSC[C@@H](O)CF 62a_100015614560_100009852258 [0,0,0,0,0,2|1,0,0]=3 5662 B16R0.108 CCCCCCCC(=O)OCSC[C@@H](O)CO 62a_100009815848_100009852258 [0,0,0,0,0,2|0,0,0]=2