0 B11R0.106 COC(=O)CCCCC(=O)OC CNP0317209.0 [0,0,0,0,0,0|0,0,0]=0 1 B10R0.55 C=CC(=O)CCCOC(=O)C CNP0357217.0 [1,0,0,0,0,0|2,0,1]=4 2 B10R0.55 CC(=O)OCCCC(=O)CO CNP0357573.0 [1,0,0,0,0,0|3,0,0]=4 3 B10R0.55 CCC(=O)CCC=CC(=O)C CNP0534993.0 [1,0,0,0,0,0|1,0,2]=4 4 B10R0.55 CC[C@H](C)CCCCC(=O)O CNP0159275.1 [1,0,0,0,0,0|2,0,1]=4 5 B10R0.55 COC(=O)CC=COC(=O)C CNP0064090.0 [1,0,0,0,0,0|1,0,2]=4 6 B10R0.55 COC(=O)CCCCC(=O)C CNP0524250.0 [1,0,0,0,0,0|0,0,0]=1 7 B10R0.55 COC(=O)CCCCC(=O)O CNP0188266.0 [1,0,0,0,0,0|0,0,0]=1 8 B10R0.55 COC(=O)CCCCC(C)C CNP0109196.0 [1,0,0,0,0,0|1,0,1]=3 9 B10R0.55 COC(=O)CCCNC(=N)N CNP0188338.0 [1,0,0,0,0,0|3,0,0]=4 10 B10R0.74 CCC=CCCCC(=O)OC CNP0397287.0 [1,0,0,0,0,0|1,0,1]=3 11 B10R0.74 CCCCCCCC(=O)CC CNP0252003.0 [1,0,0,0,0,0|2,0,1]=4 12 B10R0.74 CCCCCCCC(=O)OC CNP0276319.0 [1,0,0,0,0,0|1,0,1]=3 13 B10R0.74 CCCCCCCC(=O)OO CNP0355653.0 [1,0,0,0,0,0|2,0,1]=4 14 B10R0.74 CCCCCCCC(=O)SC CNP0611999.0 [1,0,0,0,0,0|1,1,1]=4 15 B12R0.147 COC(=O)CCC(=O)CC(=O)OC CNP0306860.0 [0,1,0,0,0,0|0,0,1]=2 16 B12R0.156 CCC(C)CCCC(C)C(=O)OC CNP0310637.0 [0,1,0,0,0,0|2,0,1]=4 17 B12R0.276 CCOC(=O)CCCC[C@@H](C)CC CNP0170449.1 [0,1,0,0,0,0|2,0,1]=4 18 B10R0.59 COC(=O)CCCC(=O)OC CNP0334682.0 [0,0,0,0,1,0|0,0,0]=1 19 B10R0.59 COC(=O)COCC(=O)OC CNP0414365.0 [0,0,0,0,1,0|1,0,0]=2 20 B12R0.183 COC(=O)CCCCCC(=O)OC CNP0193203.0 [0,0,0,0,0,1|0,0,0]=1 21 B9R0.2 CC=CCCCOC(=O)C CNP0248523.0 [2,0,0,0,0,0|2,0,0]=4 22 B9R0.2 CCC=CCCCC(=O)O CNP0227056.0 [2,0,0,0,0,0|1,0,1]=4 23 B9R0.2 CCCCCCCC(=O)C CNP0364677.0 [2,0,0,0,0,0|1,0,1]=4 24 B9R0.2 CCCCCCCC(=O)O CNP0295653.0 [2,0,0,0,0,0|1,0,1]=4 25 B9R0.46 C=CCCCCC(=O)CC CNP0107479.0 [2,0,0,0,0,0|1,0,1]=4 26 B9R0.46 CCC=CCCC(=O)OC CNP0175025.0 [2,0,0,0,0,0|1,0,1]=4 27 B9R0.46 CCCCCCC(=O)CC CNP0226154.0 [2,0,0,0,0,0|1,0,1]=4 28 B9R0.46 CCCCCCC(=O)OC CNP0149439.0 [2,0,0,0,0,0|0,0,1]=3 29 B9R0.55 CC(=O)CCCCC(=O)O CNP0590711.0 [2,0,0,0,0,0|0,0,0]=2 30 B9R0.55 CC(=O)CCCCC(C)C CNP0596169.0 [2,0,0,0,0,0|1,0,1]=4 31 B9R0.55 CC(=O)CCCNC(=O)C CNP0404524.0 [2,0,0,0,0,0|1,0,0]=3 32 B9R0.55 CC(=O)NCCCC(=O)O CNP0201600.0 [2,0,0,0,0,0|1,0,0]=3 33 B9R0.55 CC(=O)NCCNC(=O)C CNP0287260.0 [2,0,0,0,0,0|2,0,0]=4 34 B9R0.55 CC(C)CCCCC(=O)O CNP0196819.0 [2,0,0,0,0,0|1,0,1]=4 35 B9R0.55 C[S+](C)CCCCC(=O)O CNP0043116.0 [2,0,0,0,0,0|2,0,0]=4 36 B9R0.55 C[S](C)CCCCC(=O)O CNP0533226.0 [2,0,0,0,0,0|2,0,0]=4 37 B9R0.55 NC(=O)CCCCC(=O)N CNP0104382.0 [2,0,0,0,0,0|2,0,0]=4 38 B9R0.55 NC(=O)NCCCC(=O)O CNP0167058.0 [2,0,0,0,0,0|2,0,0]=4 39 B9R0.55 O=C(Cl)CCCCC(=O)Cl CNP0235392.0 [2,0,0,0,0,0|2,0,0]=4 40 B9R0.55 O=C(O)C=CCCC(=O)O CNP0419680.0 [2,0,0,0,0,0|0,0,2]=4 41 B9R0.55 O=C(O)CC=CCC(=O)O CNP0098647.0 [2,0,0,0,0,0|0,0,2]=4 42 B9R0.55 O=C(O)CCCCC(=O)O CNP0296801.0 [2,0,0,0,0,0|0,0,0]=2 43 B9R0.55 O=C(O)CCNCC(=O)O CNP0174380.0 [2,0,0,0,0,0|1,0,0]=3 44 B11R0.29 O=C(O)CCCCC(=O)C(=O)O CNP0201111.0 [1,1,0,0,0,0|2,0,0]=4 45 B11R0.93 COC(=O)C[C@@H](O)COC(=O)C CNP0042929.1 [1,1,0,0,0,0|1,0,0]=3 46 B11R0.93 COC(=O)C[C@H](O)COC(=O)C CNP0042929.2 [1,1,0,0,0,0|1,0,0]=3 47 B11R0.107 COC(=O)CCC(=O)CC(=O)C CNP0305846.0 [1,1,0,0,0,0|0,0,1]=3 48 B11R0.114 COC(=O)CCCC[N+](C)(C)C CNP0515668.0 [1,1,0,0,0,0|2,0,0]=4 49 B11R0.114 COC(=O)CCCC[N+](C)(C)C CNP0520726.0 [1,1,0,0,0,0|2,0,0]=4 50 B11R0.176 CC(=O)OCCCC(=O)CCO CNP0357221.0 [1,1,0,0,0,0|2,0,0]=4 51 B11R0.176 CCOC(=O)CCCCC(C)C CNP0312915.0 [1,1,0,0,0,0|1,0,1]=4 52 B11R0.176 CCOC(=O)CCCC[C@H](C)O CNP0017820.1 [1,1,0,0,0,0|0,0,2]=4 53 B11R0.176 CCOC(=O)CCCSC(=O)C CNP0003277.0 [1,1,0,0,0,0|1,0,0]=3 54 B11R0.4 CCCCCCCC(=O)OCC CNP0311189.0 [1,1,0,0,0,0|1,0,1]=4 55 B11R0.40 CC=CCCCCCC(=O)OC CNP0525056.0 [1,1,0,0,0,0|1,0,0]=3 56 B11R0.40 CCC=CCCCCC(=O)OC CNP0111381.0 [1,1,0,0,0,0|1,0,0]=3 57 B11R0.40 CCCCCCCCC(=O)OC CNP0418286.0 [1,1,0,0,0,0|1,0,1]=4 58 B11R0.40 COC(=O)CCCCCCCO CNP0247810.0 [1,1,0,0,0,0|1,0,1]=4 59 B11R0.70 CCCCC(C)CCC(=O)OC CNP0076241.0 [1,1,0,0,0,0|1,0,1]=4 60 B11R0.142 CCCCCC[C@@H](O)C(=O)OC CNP0039109.2 [1,1,0,0,0,0|1,0,1]=4 61 B11R0.142 CCCCCC[C@H](O)C(=O)OC CNP0039109.1 [1,1,0,0,0,0|1,0,1]=4 62 B11R0.154 CCCCC[C@@H](O)CC(=O)OC CNP0364637.1 [1,1,0,0,0,0|1,0,1]=4 63 B11R0.154 CCCCC[C@H](O)CC(=O)OC CNP0364637.2 [1,1,0,0,0,0|1,0,1]=4 64 B11R0.120 COC(=O)CC[C@H](N)C(=O)OC CNP0287333.1 [0,1,0,0,1,0|0,0,0]=2 65 B13R0.250 COC(=O)CCCC[C@@H](N)C(=O)OC CNP0176274.1 [0,1,0,0,0,1|0,0,0]=2 66 B13R0.429 COC(=O)CCC[C@@H](C)CC(=O)OC CNP0190063.1 [0,1,0,0,0,1|0,0,0]=2 67 B13R0.367 CCOC(=O)CCCCC(=O)OCC CNP0031190.0 [0,2,0,0,0,0|0,0,0]=2 68 B11R1.20 CC(=O)NC1CCC(=O)CC1 CNP0508651.0 [1,0,0,1,0,0|2,0,0]=4 69 B11R1.23 COC(=O)[C@@H]1CCCN(C1)C CNP0201885.1 [1,0,0,1,0,0|2,0,0]=4 70 B11R1.23 COC(=O)[C@H]1CCCC(=O)N1 CNP0329486.1 [1,0,0,1,0,0|1,0,0]=3 71 B11R1.23 COC(=O)[C@H]1CCCN(C1)C CNP0201885.2 [1,0,0,1,0,0|2,0,0]=4 72 B11R1.39 COC(=O)C[C@@H]1C=CC(=O)O1 CNP0175302.2 [1,0,0,1,0,0|0,0,2]=4 73 B11R1.39 COC(=O)C[C@H]1C=CC(=O)O1 CNP0175302.1 [1,0,0,1,0,0|0,0,2]=4 74 B11R1.75 O=C(O)CCC1=CC(=O)OC1 CNP0583583.0 [1,0,0,1,0,0|0,0,2]=4 75 B11R1.75 O=C(O)CC[C@@H]1CCC(=O)N1 CNP0399000.1 [1,0,0,1,0,0|2,0,0]=4 76 B11R1.75 O=C(O)CC[C@H]1CCC(=O)N1 CNP0399000.2 [1,0,0,1,0,0|2,0,0]=4 77 B11R1.228 COC(=O)C[C@@H]1CCCN1C CNP0238623.1 [1,0,0,1,0,0|1,0,1]=4 78 B11R1.865 COC(=O)[C@@H]1CCC(=O)N1C CNP0354040.1 [0,0,0,1,1,0|1,0,0]=3 79 B11R1.865 COC(=O)[C@@H]1CCC(=O)[C@H]1C CNP0292154.1 [0,0,0,1,1,0|1,0,0]=3 80 B13R1.4920 COC(=O)CC1(CCC(=O)CC1)O CNP0138264.0 [0,1,0,1,0,0|1,0,0]=3 81 B13R1.534 COC(=O)C1CCC(N1)C(=O)OC CNP0089390.0 [0,1,0,1,0,0|0,0,0]=2 82 B13R2.1157 COC(=O)[C@@H]1CN2C(=O)C[C@H]2O1 CNP0294470.1 [0,0,0,2,0,0|2,0,0]=4 83 B9R0.1 COC(=O)CCCC(=O)C CNP0609095.0 [1,0,0,0,1,0|0,0,0]=2 84 B9R0.1 COC(=O)CCCC(=O)Cl CNP0360552.0 [1,0,0,0,1,0|1,0,0]=3 85 B9R0.1 COC(=O)CCCC(=O)O CNP0216180.0 [1,0,0,0,1,0|0,0,0]=2 86 B9R0.1 COC(=O)CCCC(C)C CNP0354056.0 [1,0,0,0,1,0|1,0,1]=4 87 B9R0.1 COC(=O)CCCN(C)C CNP0185464.0 [1,0,0,0,1,0|2,0,0]=4 88 B9R0.1 COC(=O)CONC(=O)C CNP0170381.0 [1,0,0,0,1,0|2,0,0]=4 89 B9R0.24 CCC(=O)CCC(=O)CC CNP0280257.0 [0,0,0,0,2,0|2,0,0]=4 90 B9R0.24 COC(=O)C#CC(=O)OC CNP0341643.0 [0,0,0,0,2,0|0,0,2]=4 91 B9R0.24 COC(=O)C=CC(=O)OC CNP0328522.0 [0,0,0,0,2,0|0,0,2]=4 92 B9R0.24 COC(=O)CCC(=O)CN CNP0363549.0 [0,0,0,0,2,0|2,0,0]=4 93 B9R0.24 COC(=O)CCC(=O)CO CNP0195106.0 [0,0,0,0,2,0|2,0,0]=4 94 B9R0.24 COC(=O)CCC(=O)OC CNP0301716.0 [0,0,0,0,2,0|0,0,0]=2 95 B9R0.24 COC(=O)NNC(=O)OC CNP0145555.0 [0,0,0,0,2,0|2,0,0]=4 96 B13R0.201 COC(=O)CCCCCCC(=O)OC CNP0371182.0 [0,0,0,0,0,2|0,0,0]=2 97 B13R0.201 COC(=O)COCCOCC(=O)OC CNP0197583.0 [0,0,0,0,0,2|0,0,0]=2