0 B9R0.24 C(CC(=O)NN)C(=O)NN PI-50262 [0,0,0,0,0,0|4,0,0]=4 1 B9R0.24 COC(=O)C#CC(=O)OC PI-36955 [0,0,0,0,0,0|0,0,2]=2 2 B8R0.6 O=C(OC)CCCCBr PI-40014 [1,0,0,0,0,0|2,0,1]=4 3 B8R0.9 CCC(C)CCC(O)=O PI-37097 [1,0,0,0,0,0|2,0,1]=4 4 B8R0.9 COC(=O)CCC(=O)Cl PI-13416 [1,0,0,0,0,0|1,0,0]=2 5 B8R0.9 NCC(=O)CCC(=O)O PI-10027 [1,0,0,0,0,0|2,0,0]=3 6 B8R0.9 NCC(=O)NCC(=O)O PI-10062 [1,0,0,0,0,0|3,0,0]=4 7 B10R0.46 CN(CC(=O)OC)C(=O)C=C PI-29876 [0,1,0,0,0,0|2,0,1]=4 8 B10R0.46 COC(=O)CC(C(=O)OC)O PI-12144 [0,1,0,0,0,0|0,0,0]=1 9 B10R1.14 COC(=O)C1CCC(=O)C1 PI-42489 [0,0,0,1,0,0|1,0,0]=2 10 B10R1.14 COC(C1NC(=O)CC1)=O PI-41045 [0,0,0,1,0,0|2,0,0]=3 11 B10R1.14 O=C1CC[C@@H]([C@](OC)=O)N1 PI-37268 [0,0,0,1,0,0|2,0,0]=3 12 B8R0.19 CC(=CC(=O)OC)NC PI-30121 [0,0,0,0,1,0|2,0,1]=4 13 B8R0.19 CCC(=O)CC(=O)CC PI-15985 [0,0,0,0,1,0|2,0,0]=3 14 B8R0.19 CCC(=O)CC(=O)OC PI-10902 [0,0,0,0,1,0|1,0,0]=2 15 B8R0.19 CCC(CC(=O)OC)O PI-42251 [0,0,0,0,1,0|1,0,2]=4 16 B8R0.19 CC[C@H](O)CC(OC)=O PI-42252 [0,0,0,0,1,0|1,0,2]=4 17 B8R0.19 COC(=O)CC(=O)CCl PI-18464 [0,0,0,0,1,0|2,0,0]=3 18 B10R0.59 COC(=O)CCCC(=O)OC PI-44636 [0,0,0,0,0,1|0,0,0]=1 19 B10R0.59 COC(=O)CNCC(=O)OC PI-15685 [0,0,0,0,0,1|0,0,0]=1 20 B7R0.3 COC(=O)CCC#C PI-39349 [2,0,0,0,0,0|0,0,2]=4 21 B7R0.3 COC(=O)CCC=O PI-48276 [2,0,0,0,0,0|0,0,0]=2 22 B7R0.3 COC(=O)CCCBr PI-44980 [2,0,0,0,0,0|1,0,1]=4 23 B7R0.3 COC(=O)CCCN PI-42165 [2,0,0,0,0,0|1,0,1]=4 24 B7R0.3 COC(=O)CCSC PI-45979 [2,0,0,0,0,0|0,1,0]=3 25 B7R0.3 COC(=O)CNC=O PI-33232 [2,0,0,0,0,0|1,0,0]=3 26 B7R0.3 COCCC(=O)NN PI-50294 [2,0,0,0,0,0|2,0,0]=4 27 B7R0.3 CO\C=C\C(=O)OC PI-37579 [2,0,0,0,0,0|0,0,1]=3 28 B7R0.3 O=C(OC)CCNC PI-40057 [2,0,0,0,0,0|1,0,0]=3 29 B7R0.4 COCCOC(=O)C PI-12910 [2,0,0,0,0,0|1,0,1]=4 30 B7R0.6 C(CC(=O)[O-])C(=O)[O-] PI-13200 [2,0,0,0,0,0|0,0,2]=4 31 B7R0.6 C(C[N+](=O)[O-])C(=O)O PI-41737 [2,0,0,0,0,0|1,0,1]=4 32 B7R0.6 CC(=C)COC(=O)C PI-47091 [2,0,0,0,0,0|2,0,0]=4 33 B7R0.6 CC(=O)C=CC(=O)O PI-29616 [2,0,0,0,0,0|0,0,2]=4 34 B7R0.6 CC(=O)CCC(=O)C PI-48500 [2,0,0,0,0,0|0,0,0]=2 35 B7R0.6 CC(=O)NCC(=O)C PI-36400 [2,0,0,0,0,0|1,0,0]=3 36 B7R0.6 CC(=O)NCC(=O)O PI-33247 [2,0,0,0,0,0|1,0,0]=3 37 B7R0.6 CC(=O)NNC(=O)C PI-30465 [2,0,0,0,0,0|2,0,0]=4 38 B7R0.6 CC(=O)OCC(=O)Cl PI-13657 [2,0,0,0,0,0|2,0,0]=4 39 B7R0.6 CC(=O)OCC(=O)O PI-26120 [2,0,0,0,0,0|1,0,0]=3 40 B7R0.6 CC(C)CCC(=O)O PI-25767 [2,0,0,0,0,0|1,0,1]=4 41 B7R0.6 C[S+](C)CCC(=O)O PI-45961 [2,0,0,0,0,0|2,0,0]=4 42 B7R0.6 O=C([O-])CCC([O-])=O PI-13219 [2,0,0,0,0,0|0,0,2]=4 43 B9R0.1 CC(=O)NCCC(=O)OC PI-33249 [1,1,0,0,0,0|2,0,0]=4 44 B9R0.8 CCCCC(C(=O)OC)Br PI-12723 [1,1,0,0,0,0|1,0,1]=4 45 B9R0.8 COC(=O)C(CCSC)N PI-25385 [1,1,0,0,0,0|0,1,1]=4 46 B9R0.8 COC(=O)C(CCSC)N PI-44538 [1,1,0,0,0,0|0,1,1]=4 47 B9R0.34 CCCC(CC(=O)OC)O PI-45929 [1,1,0,0,0,0|1,0,1]=4 48 B9R0.46 COC(=O)CCCCCO PI-45931 [1,1,0,0,0,0|1,0,1]=4 49 B9R0.46 O=C(OC)CCCCCBr PI-40016 [1,1,0,0,0,0|1,0,1]=4 50 B9R0.7 C(CC(=O)O)C(=O)C(=O)O PI-34101 [1,1,0,0,0,0|2,0,0]=4 51 B9R0.7 OC(=O)CCC(=O)C(=O)[O-] PI-13145 [1,1,0,0,0,0|2,0,0]=4 52 B9R0.23 CC(=O)CC(=O)C(=O)OC PI-29316 [1,1,0,0,0,0|0,0,1]=3 53 B9R0.23 CC(C(=O)OC)NC(=O)C PI-26364 [1,1,0,0,0,0|1,0,0]=3 54 B9R0.23 CC(C)CC(C(=O)OC)N PI-14279 [1,1,0,0,0,0|1,0,1]=4 55 B9R0.23 COC(=O)[C@H](CC(=O)O)N PI-37616 [1,1,0,0,0,0|0,0,0]=2 56 B9R0.23 N[C@@H](CC(C)C)C(OC)=O PI-25825 [1,1,0,0,0,0|1,0,1]=4 57 B9R0.42 COC(=O)CC(=C)C(=O)O PI-47078 [1,1,0,0,0,0|0,0,1]=3 58 B9R0.42 COC(=O)CC(C(=O)O)N PI-48757 [1,1,0,0,0,0|0,0,0]=2 59 B9R0.42 COC(=O)C[C@@H](C(=O)O)N PI-13089 [1,1,0,0,0,0|0,0,0]=2 60 B9R0.48 CCOC(=O)C=CC(=O)O PI-47111 [1,1,0,0,0,0|0,0,2]=4 61 B9R0.48 CCOC(=O)CCC(=O)Cl PI-12811 [1,1,0,0,0,0|1,0,0]=3 62 B9R0.48 CCOC(=O)CNC(=O)C PI-33248 [1,1,0,0,0,0|1,0,0]=3 63 B9R0.26 COC(=CC(=O)OC)CCl PI-11568 [0,1,0,0,1,0|1,0,1]=4 64 B9R0.26 COC(=O)CC(OC)OC PI-37580 [0,1,0,0,1,0|0,0,2]=4 65 B9R0.27 CC(C(=O)OC)C(=O)OC PI-41196 [0,1,0,0,1,0|0,0,0]=2 66 B9R0.27 CCC(=O)C(C(=O)OC)F PI-36598 [0,1,0,0,1,0|1,0,0]=3 67 B9R0.27 COC(=O)C(C(=O)OC)Cl PI-37603 [0,1,0,0,1,0|0,0,0]=2 68 B9R0.27 COC(=O)C(C(=O)OC)F PI-21949 [0,1,0,0,1,0|0,0,0]=2 69 B9R0.27 COC(=O)C(C(=O)OC)N PI-18228 [0,1,0,0,1,0|0,0,0]=2 70 B11R0.110 CC(CC(=O)OC)CC(=O)OC PI-23880 [0,1,0,0,0,1|0,0,0]=2 71 B11R0.110 COC(=O)CC(=O)CC(=O)OC PI-34732 [0,1,0,0,0,1|0,0,0]=2 72 B11R0.120 COC(=O)CCC(=O)C(=O)OC PI-13079 [0,1,0,0,0,1|0,0,0]=2 73 B11R0.120 COC(=O)CCC(C(=O)OC)N PI-20694 [0,1,0,0,0,1|0,0,0]=2 74 B11R0.120 COC(=O)CNC(=O)C(=O)OC PI-38614 [0,1,0,0,0,1|0,0,1]=3 75 B11R0.43 CCC(=O)CC(=O)C(=O)OCC PI-50427 [0,2,0,0,0,0|1,0,1]=4 76 B11R0.66 COC(=O)C(C(C(=O)OC)O)O PI-11214 [0,2,0,0,0,0|0,0,0]=2 77 B11R0.66 O=C(OC)\C(O)=C(O)\C(OC)=O PI-37053 [0,2,0,0,0,0|0,0,2]=4 78 B11R0.62 CCOC(=O)\N=N\C(=O)OCC PI-24202 [0,2,0,0,0,0|2,0,0]=4 79 B9R1.1 COC1CCC(CC1)=O PI-40302 [1,0,0,1,0,0|1,0,1]=4 80 B9R1.7 CCCC1CC(=O)OC1 PI-44369 [1,0,0,1,0,0|1,0,1]=4 81 B9R1.11 COC(=O)C1CC=CC1 PI-37831 [1,0,0,1,0,0|1,0,0]=3 82 B9R1.11 COC(=O)C1CCNC1 PI-27313 [1,0,0,1,0,0|1,0,1]=4 83 B9R1.11 O=C(C1CNCC1)OC PI-46627 [1,0,0,1,0,0|1,0,1]=4 84 B9R1.11 O=C(C1COCC1)OC PI-42697 [1,0,0,1,0,0|0,0,1]=3 85 B9R1.35 C1C(NC(=O)S1)C(=O)O PI-47157 [1,0,0,1,0,0|1,1,0]=4 86 B9R1.35 C1CC(=O)NC1C(=O)O PI-10056 [1,0,0,1,0,0|2,0,0]=4 87 B9R1.35 O=C1CCC(C1)C(=O)O PI-34867 [1,0,0,1,0,0|1,0,0]=3 88 B9R1.35 O=C1CC[C@H](N1)C(=O)O PI-33313 [1,0,0,1,0,0|2,0,0]=4 89 B9R1.35 O=C1CC[C@H](O1)C(=O)O PI-39065 [1,0,0,1,0,0|2,0,0]=4 90 B9R1.35 O=C1CNC(C1)C(=O)O PI-36300 [1,0,0,1,0,0|2,0,0]=4 91 B9R1.82 COC(=O)C1CC(=O)C1 PI-48951 [1,0,0,1,0,0|0,0,0]=2 92 B9R1.82 COC(=O)C1CC(C1)O PI-45752 [1,0,0,1,0,0|0,0,2]=4 93 B9R1.82 O=C([C@H]1C[C@@H](N)C1)OC PI-41849 [1,0,0,1,0,0|1,0,1]=4 94 B9R1.48 C1CCC(=O)CC(=O)C1 PI-35810 [0,0,0,1,1,0|2,0,0]=4 95 B11R1.15 CCOC(=O)C1CCC(=O)C1 PI-42490 [0,1,0,1,0,0|1,0,0]=3 96 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)N1 PI-34624 [0,1,0,1,0,0|2,0,0]=4 97 B7R0.2 CC(=CC(=O)OC)C PI-13263 [1,0,0,0,1,0|1,0,1]=4 98 B7R0.2 CC(=CC(=O)OC)N PI-13659 [1,0,0,0,1,0|1,0,1]=4 99 B7R0.2 CC(CC(=O)OC)N PI-42254 [1,0,0,0,1,0|1,0,1]=4 100 B7R0.2 CC(CC(=O)OC)O PI-42249 [1,0,0,0,1,0|0,0,2]=4 101 B7R0.2 CC(CC(=O)OC)O PI-42250 [1,0,0,0,1,0|0,0,2]=4 102 B7R0.2 COC(=O)CC(C)N PI-42155 [1,0,0,0,1,0|1,0,1]=4 103 B7R0.2 COC(=O)C[N+](=O)[O-] PI-40485 [1,0,0,0,1,0|1,0,1]=4 104 B7R0.2 C[C@@H](N)CC(OC)=O PI-42154 [1,0,0,0,1,0|1,0,1]=4 105 B7R0.2 C[C@H](N)CC(OC)=O PI-42253 [1,0,0,0,1,0|1,0,1]=4 106 B7R0.2 O=C([O-])CC(OC)=O PI-18514 [1,0,0,0,1,0|0,0,1]=3 107 B7R0.10 CNC(=O)C(=O)NC PI-14652 [0,0,0,0,2,0|2,0,0]=4 108 B7R0.10 COC(=O)C(=O)NN PI-50286 [0,0,0,0,2,0|2,0,0]=4