0 B9R0.24 COC(=O)CCC(=O)CN 4158-5-00 [0,0,0,0,0,0|2,0,0]=2 1 B9R0.24 COC(=O)CCC(=O)OC 2123-1-0Z [0,0,0,0,0,0|0,0,0]=0 2 B9R0.24 COC(=O)NNC(=O)OC 4148-1-06 [0,0,0,0,0,0|2,0,0]=2 3 B9R0.24 COC(=O)\C=C\C(=O)OC 2323-1-16 [0,0,0,0,0,0|0,0,2]=2 4 B8R0.6 C=CCCCC(=O)OC 2324-1-0B [1,0,0,0,0,0|1,0,2]=4 5 B8R0.6 CCCCCC(=O)OC 2123-1-90 [1,0,0,0,0,0|1,0,1]=3 6 B8R0.6 CCNCCC(=O)OC 4158-1-0D [1,0,0,0,0,0|2,0,0]=3 7 B8R0.6 COC(=O)CCCC#N 4137-1-0F [1,0,0,0,0,0|2,0,1]=4 8 B8R0.6 COC(=O)CCCCBr 2123-9-14 [1,0,0,0,0,0|2,0,1]=4 9 B8R0.6 COC(=O)CCCCCl 2123-5-1C [1,0,0,0,0,0|2,0,1]=4 10 B8R0.6 COC(=O)CCCCN 4158-5-0A [1,0,0,0,0,0|2,0,1]=4 11 B8R0.6 COC(=O)CCN=C=O 4149-1-09 [1,0,0,0,0,0|3,0,0]=4 12 B8R0.6 COCCCC(=O)OC G311-A-58 [1,0,0,0,0,0|0,0,1]=2 13 B8R0.6 C\C=C\C=C\C(=O)OC 2323-1-0M [1,0,0,0,0,0|1,0,2]=4 14 B8R0.9 CC(=O)OCC(=O)CCl 2129-5-0G [1,0,0,0,0,0|3,0,0]=4 15 B8R0.9 CNC(=O)\C=C/C(=O)O 4348-1-17 [1,0,0,0,0,0|1,0,2]=4 16 B8R0.9 COC(=O)CCC(=O)Cl 2123-5-1D [1,0,0,0,0,0|1,0,0]=2 17 B8R0.9 COC(=O)CCC(N)=O 4148-1-1L [1,0,0,0,0,0|1,0,0]=2 18 B8R0.9 COC(=O)OCC(C)F 2128-3-0J [1,0,0,0,0,0|2,0,1]=4 19 B8R0.9 COC(=O)\C=C\C(=O)O 2323-1-35 [1,0,0,0,0,0|0,0,2]=3 20 B8R0.9 COC(=O)\C=C\C(C)=O 2329-1-E0 [1,0,0,0,0,0|0,0,2]=3 21 B10R0.46 C=C(CC(=O)OC)C(=O)OC 2323-1-29 [0,1,0,0,0,0|0,0,1]=2 22 B10R0.46 COC(=O)CC(C)C(=O)OC 2123-1-0H [0,1,0,0,0,0|0,0,0]=1 23 B10R0.46 COC(=O)C[C@@H](C)C(=O)OC 2123-1-R3 [0,1,0,0,0,0|0,0,0]=1 24 B10R0.46 COC(=O)C[C@@H](O)C(=O)OC 2129-1-55 [0,1,0,0,0,0|0,0,0]=1 25 B10R0.46 COC(=O)C[C@H](C)C(=O)OC 2123-1-S3 [0,1,0,0,0,0|0,0,0]=1 26 B10R0.46 COC(=O)\C=C(/C)C(=O)OC 2323-1-0E [0,1,0,0,0,0|0,0,2]=3 27 B10R0.108 CCOC(=O)CNC(=O)OC 4158-1-0S [0,1,0,0,0,0|1,0,0]=2 28 B10R1.14 C=C1CN[C@H](C(=O)OC)C1 4H56-1-SC [0,0,0,1,0,0|3,0,0]=4 29 B10R1.14 COC(=O)C1CNC(=O)C1 4H29-1-3A [0,0,0,1,0,0|1,0,0]=2 30 B10R1.14 COC(=O)C1COC(=O)N1 4H58-1-344 [0,0,0,1,0,0|1,0,0]=2 31 B10R1.14 COC(=O)C1CSC(N)=N1 8H70-1-9M [0,0,0,1,0,0|2,1,0]=4 32 B10R1.14 COC(=O)[C@@H]1COC(=O)N1 4H58-1-S14 [0,0,0,1,0,0|1,0,0]=2 33 B10R1.14 COC(=O)[C@H]1CC[C@@H](O)C1 2229-1-92 [0,0,0,1,0,0|1,0,2]=4 34 B10R1.14 COC(=O)[C@H]1COC(=O)N1 4H58-1-R14 [0,0,0,1,0,0|1,0,0]=2 35 B10R1.71 O=C1CCC(=O)NCCN1 4H48-1-40 [0,0,0,1,0,0|2,0,0]=3 36 B8R0.19 CC[C@H](O)CC(=O)OC 2129-1-SE [0,0,0,0,1,0|1,0,2]=4 37 B8R0.19 CN\C(C)=C\C(=O)OC G311-A-54 [0,0,0,0,1,0|2,0,1]=4 38 B8R0.19 COC(=O)\C=C(/C)OC 2323-1-E4 [0,0,0,0,1,0|1,0,1]=3 39 B7R0.3 C#CCCC(=O)OC 2523-1-06 [2,0,0,0,0,0|0,0,2]=4 40 B7R0.3 CCCCC(=O)CC 2117-1-03 [2,0,0,0,0,0|1,0,1]=4 41 B7R0.3 CCNCC(=O)OC 4158-5-0Q [2,0,0,0,0,0|1,0,1]=4 42 B7R0.3 CNCCC(=O)OC 4158-1-78 [2,0,0,0,0,0|1,0,0]=3 43 B7R0.3 COC(=O)CCC#N 4137-1-0H [2,0,0,0,0,0|1,0,1]=4 44 B7R0.3 COC(=O)CCC=O 2123-1-29 [2,0,0,0,0,0|0,0,0]=2 45 B7R0.3 COCCC(=O)OC 2123-1-0T [2,0,0,0,0,0|0,0,0]=2 46 B7R0.3 CO\C=C\C(=O)OC 2124-1-00 [2,0,0,0,0,0|0,0,1]=3 47 B7R0.4 CCCCCC(C)=O 2117-1-14 [2,0,0,0,0,0|1,0,1]=4 48 B7R0.4 CCOCCC(=O)O 2121-1-0E [2,0,0,0,0,0|2,0,0]=4 49 B7R0.4 COCCCC(=O)O 2121-1-51 [2,0,0,0,0,0|0,0,1]=3 50 B7R0.4 C\C=C\CCC(=O)O 2321-1-X1 [2,0,0,0,0,0|1,0,0]=3 51 B7R0.4 NOCCCC(=O)O 4147-9-01 [2,0,0,0,0,0|1,0,1]=4 52 B7R0.6 C=C(C)CCC(=O)O 2321-1-0E [2,0,0,0,0,0|1,0,0]=3 53 B7R0.6 C=C(C)COC(C)=O 2324-1-0F [2,0,0,0,0,0|2,0,0]=4 54 B7R0.6 CC(=O)CCC(C)C 2117-1-12 [2,0,0,0,0,0|1,0,1]=4 55 B7R0.6 CC(=O)NNC(C)=O 4139-1-02 [2,0,0,0,0,0|2,0,0]=4 56 B7R0.6 CC(=O)\C=C\C(=O)O 2329-1-08 [2,0,0,0,0,0|0,0,2]=4 57 B7R0.6 CC(C)CCC(=O)O 2121-1-29 [2,0,0,0,0,0|1,0,1]=4 58 B7R0.6 CC(N)CCC(=O)O 4157-5-14 [2,0,0,0,0,0|1,0,1]=4 59 B7R0.6 O=C(Cl)CCC(=O)Cl 2116-5-18 [2,0,0,0,0,0|2,0,0]=4 60 B7R0.6 O=C(O)CCC(=O)O 2121-1-24 [2,0,0,0,0,0|0,0,0]=2 61 B7R0.6 O=C([O-])CCC(=O)[O-] 2122-1-00 [2,0,0,0,0,0|0,0,2]=4 62 B9R0.5 CC\C=C\CC(=O)OCC 2324-1-24 [1,1,0,0,0,0|1,0,1]=4 63 B9R0.8 CCCCC(Br)C(=O)OC 2123-9-27 [1,1,0,0,0,0|1,0,1]=4 64 B9R0.8 CCCC[C@@H](N)C(=O)OC 4158-5-RM [1,1,0,0,0,0|1,0,1]=4 65 B9R0.8 CCCC[C@H](N)C(=O)OC 4158-5-SM [1,1,0,0,0,0|1,0,1]=4 66 B9R0.8 COC(=O)[C@@H](N)CCSC 8166-5-S0 [1,1,0,0,0,0|0,1,1]=4 67 B9R0.8 COC(=O)[C@H](N)CCSC 8166-5-R0 [1,1,0,0,0,0|0,1,1]=4 68 B9R0.7 CC(N)C(=O)NCC(=O)O 4157-1-21 [1,1,0,0,0,0|2,0,0]=4 69 B9R0.21 COC(=O)CCS(=O)(=O)Cl 6162-5-03 [1,1,0,0,0,0|1,0,1]=4 70 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O 4157-1-R9 [1,1,0,0,0,0|1,0,0]=3 71 B9R0.48 CCOC(=O)CCC(=O)O 2123-1-0C [1,1,0,0,0,0|0,0,0]=2 72 B9R0.48 CCOC(=O)CCC(C)C 2123-1-0W [1,1,0,0,0,0|1,0,1]=4 73 B9R0.48 CCOC(=O)CNC(C)=O 4158-1-25 [1,1,0,0,0,0|1,0,0]=3 74 B9R0.48 CCOC(=O)CNC(N)=O 4153-1-04 [1,1,0,0,0,0|2,0,0]=4 75 B9R0.26 COC(=O)\C=C(/CCl)OC 2323-5-04 [0,1,0,0,1,0|1,0,1]=4 76 B9R0.27 COC(=O)C(Cl)C(=O)OC 2123-5-06 [0,1,0,0,1,0|0,0,0]=2 77 B9R0.27 COC(=O)C(N)C(=O)OC 4158-1-18 [0,1,0,0,1,0|0,0,0]=2 78 B11R0.120 COC(=O)CCC(=O)C(=O)OC 2129-1-43 [0,1,0,0,0,1|0,0,0]=2 79 B11R0.120 COC(=O)CC[C@H](N)C(=O)OC 4158-1-SC [0,1,0,0,0,1|0,0,0]=2 80 B11R0.120 COC(=O)\C=C\C(=O)C(=O)OC 2323-1-14 [0,1,0,0,0,1|0,0,2]=4 81 B11R0.66 COC(=O)C(Br)C(Br)C(=O)OC 2123-9-X3 [0,2,0,0,0,0|0,0,0]=2 82 B11R0.66 COC(=O)C(O)C(O)C(=O)OC 2129-1-21 [0,2,0,0,0,0|0,0,0]=2 83 B11R0.66 COC(=O)[C@@H](O)[C@H](O)C(=O)OC 2129-1-54 [0,2,0,0,0,0|0,0,0]=2 84 B11R0.66 COC(=O)[C@H](O)[C@@H](O)C(=O)OC 2129-1-23 [0,2,0,0,0,0|0,0,0]=2 85 B11R0.88 CCC(CC(=O)OC)C(=O)OC 2123-1-28 [0,2,0,0,0,0|0,0,0]=2 86 B11R0.62 CCOC(=O)\N=N\C(=O)OCC 4140-1-X1 [0,2,0,0,0,0|2,0,0]=4 87 B9R1.1 COC1CCC(=O)CC1 2217-1-0A [1,0,0,1,0,0|1,0,1]=4 88 B9R1.7 COCC1COC(=O)O1 2H28-1-14 [1,0,0,1,0,0|1,0,1]=4 89 B9R1.7 COC[C@@H]1COC(=O)O1 2H28-1-R0 [1,0,0,1,0,0|1,0,1]=4 90 B9R1.7 COC[C@H]1COC(=O)O1 2H28-1-S0 [1,0,0,1,0,0|1,0,1]=4 91 B9R1.11 COC(=O)C1CCOC1 2H23-1-44 [1,0,0,1,0,0|0,0,1]=3 92 B9R1.11 COC(=O)[C@@H]1CCNC1 4H22-3-02 [1,0,0,1,0,0|1,0,1]=4 93 B9R1.11 COC(=O)[C@@H]1CCNC1 4H57-5-R2 [1,0,0,1,0,0|1,0,1]=4 94 B9R1.11 COC(=O)[C@@H]1CCOC1 2H23-1-R1 [1,0,0,1,0,0|0,0,1]=3 95 B9R1.11 COC(=O)[C@H]1CCNC1 4H22-3-03 [1,0,0,1,0,0|1,0,1]=4 96 B9R1.11 COC(=O)[C@H]1CCNC1 4H57-5-S2 [1,0,0,1,0,0|1,0,1]=4 97 B9R1.79 COC(=O)CC1CNC1 4H22-3-05 [1,0,0,1,0,0|1,0,1]=4 98 B9R1.132 COC1=C(Br)C(=O)CC1 2417-9-00 [1,0,0,1,0,0|2,0,0]=4 99 B9R1.35 CC(=O)C1CCC(=O)O1 2H25-1-36 [1,0,0,1,0,0|2,0,0]=4 100 B9R1.35 NC(=O)C1CNC(=O)C1 4H48-1-00Y [1,0,0,1,0,0|2,0,0]=4 101 B9R1.35 O=C1CCC(C(=O)O)C1 2229-1-06 [1,0,0,1,0,0|1,0,0]=3 102 B9R1.35 O=C1CCC(C(=O)O)N1 4H58-1-009 [1,0,0,1,0,0|2,0,0]=4 103 B9R1.35 O=C1CN[C@H](C(=O)O)C1 4H33-9-0A [1,0,0,1,0,0|2,0,0]=4 104 B9R1.35 O=C1NC(C(=O)O)CO1 4H58-1-346 [1,0,0,1,0,0|1,0,0]=3 105 B9R1.35 O=C1NCC(C(=O)O)N1 4H29-1-1Q [1,0,0,1,0,0|2,0,0]=4 106 B9R1.35 O=C1N[C@@H](C(=O)O)CO1 4H58-1-R15 [1,0,0,1,0,0|1,0,0]=3 107 B9R1.35 O=C1N[C@H](C(=O)O)CO1 4H58-1-S15 [1,0,0,1,0,0|1,0,0]=3 108 B9R1.69 CC1=NN(C)C(=O)CC1 4H17-1-89 [1,0,0,1,0,0|2,0,0]=4 109 B9R1.82 C=C1CC(C(=O)OC)C1 2323-1-39 [1,0,0,1,0,0|1,0,0]=3 110 B9R1.82 COC(=O)[C@@H]1C[C@@H](C)O1 2H23-1-E0 [1,0,0,1,0,0|0,0,2]=4 111 B9R1.82 COC(=O)[C@H]1C[C@@H](N)C1 4258-5-05 [1,0,0,1,0,0|1,0,1]=4 112 B9R1.82 COC(=O)[C@H]1C[C@@H](O)C1 2229-1-36 [1,0,0,1,0,0|0,0,2]=4 113 B9R1.82 COC(=O)[C@H]1C[C@H](N)C1 4258-5-04 [1,0,0,1,0,0|1,0,1]=4 114 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 2221-1-Z0 [1,0,0,1,0,0|1,0,1]=4 115 B9R1.37 CC1C(=O)CC(=O)N1C 4H18-1-51 [0,0,0,1,1,0|2,0,0]=4 116 B9R1.48 O=C1CCCCC(=O)C1 2218-1-0J [0,0,0,1,1,0|2,0,0]=4 117 B11R1.22 COC(=O)C1CCC(=O)CC1 2229-1-1B [0,0,0,1,0,1|1,0,0]=3 118 B11R1.22 COC(=O)C1CCC(=O)NC1 4H58-1-A2 [0,0,0,1,0,1|1,0,0]=3 119 B11R1.23 COC(=O)C1CCCC(=O)C1 2223-1-0J [0,1,0,1,0,0|1,0,0]=3 120 B11R1.23 COC(=O)C1CCNC(=O)C1 4H48-1-58 [0,1,0,1,0,0|1,0,0]=3 121 B11R1.15 CCOC(=O)C1CNC(=O)C1 4H48-1-YX [0,1,0,1,0,0|1,0,0]=3 122 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)N1 4H58-1-216 [0,1,0,1,0,0|2,0,0]=4 123 B11R1.15 CCOC(=O)[C@H]1CCC(=O)N1 4H58-1-R11 [0,1,0,1,0,0|2,0,0]=4 124 B11R2.60 O=C1CCC2C(=O)CCC12 2218-1-08 [0,0,0,2,0,0|2,0,0]=4 125 B7R0.2 CCC(=O)CC(=O)O 2129-1-1N [1,0,0,0,1,0|1,0,0]=3 126 B7R0.2 CCC(=O)CC(C)=O 2118-1-09 [1,0,0,0,1,0|1,0,0]=3 127 B7R0.2 CNC(=O)NC(C)=O 4148-1-32 [1,0,0,0,1,0|2,0,0]=4 128 B7R0.2 COC(=O)C=C(C)C 2324-1-25 [1,0,0,0,1,0|1,0,1]=4 129 B7R0.2 COC(=O)CC(=O)O 2123-1-85 [1,0,0,0,1,0|0,0,0]=2 130 B7R0.2 COC(=O)CN(C)C 4158-5-0L [1,0,0,0,1,0|2,0,0]=4 131 B7R0.2 COC(=O)C[C@@H](C)N 4158-5-R2 [1,0,0,0,1,0|1,0,1]=4 132 B7R0.2 COC(=O)C[C@H](C)N 4158-5-S2 [1,0,0,0,1,0|1,0,1]=4 133 B7R0.2 COC(=O)C[C@H](C)O 2129-1-62 [1,0,0,0,1,0|0,0,2]=4 134 B7R0.2 COC(=O)\C=C(/C)N 4358-1-01 [1,0,0,0,1,0|1,0,1]=4 135 B7R0.10 CCC(=O)C(=O)OC 2129-1-61 [0,0,0,0,2,0|1,0,0]=3 136 B7R0.10 CNC(=O)C(=O)NC 4148-1-21 [0,0,0,0,2,0|2,0,0]=4 137 B7R0.10 COC(=O)C(=O)OC 2123-1-68 [0,0,0,0,2,0|0,0,0]=2 138 B7R0.10 C\C=C(\C)C(=O)OC 2323-1-1B [0,0,0,0,2,0|2,0,0]=4 139 B11R0.106 COC(=O)CCCCC(=O)OC 2123-1-89 [0,0,0,0,0,2|0,0,0]=2 140 B11R0.106 COC(=O)CCNCC(=O)OC 4158-1-46 [0,0,0,0,0,2|0,0,0]=2