0 B9R1.35 CC(C)C1CC(O)CO1 F2147-4089 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.35 NC(=O)C1CC(F)CN1 F1907-2144 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.35 NC1CC=C(C(=O)O)C1 F1967-2233 [0,0,0,0,0,0|2,0,1]=3 3 B9R1.35 O=C1CC(C(=O)O)CO1 F2147-1585 [0,0,0,0,0,0|2,0,2]=4 4 B8R1.1 OCC1CC(O)CN1 F1905-6965 [1,0,0,0,0,0|0,0,1]=2 5 B8R1.7 O=C(O)C1=CCCO1 F8889-5190 [1,0,0,0,0,0|1,0,2]=4 6 B8R1.7 O=C(O)C1CCSC1 F2147-1614 [1,0,0,0,0,0|2,0,0]=3 7 B10R1.14 C=C1CNC(C(=O)OC)C1 F2167-4379 [0,1,0,0,0,0|1,0,1]=3 8 B10R1.14 NCC(=O)N1CCC(O)C1 F8886-4754 [0,1,0,0,0,0|3,0,0]=4 9 B10R1.14 O=C(CCl)N1CCC(O)C1 F8886-4440 [0,1,0,0,0,0|3,0,0]=4 10 B10R1.55 CS(=O)(=O)[C@H]1CC[C@@H](O)C1 F1913-6328 [0,1,0,0,0,0|2,0,1]=4 11 B10R1.55 CS(=O)(=O)[C@H]1CC[C@H](O)C1 F1913-6329 [0,1,0,0,0,0|2,0,1]=4 12 B10R1.359 CC1(C)CC(C(=O)O)CN1 F2185-0662 [0,1,0,0,0,0|3,0,0]=4 13 B10R1.470 CN1CCC(F)(C(=O)O)C1 F2197-0411 [0,1,0,0,0,0|3,0,0]=4 14 B8R0.9 C#CC(N)CCC(=O)O F1913-0216 [0,0,1,0,0,0|2,0,1]=4 15 B8R0.23 C=C(C)CC(F)C(=O)O F2147-5976 [0,0,1,0,0,0|2,0,1]=4 16 B8R0.23 CC(CC(F)F)C(=O)O F1913-0355 [0,0,1,0,0,0|3,0,0]=4 17 B8R0.23 NC(CC(F)F)C(=O)O F8887-3929 [0,0,1,0,0,0|2,0,0]=3 18 B8R0.23 O=C(O)C(F)CC(F)F F2147-6009 [0,0,1,0,0,0|3,0,0]=4 19 B8R0.23 O=C(O)CC(F)C(=O)O F2147-5754 [0,0,1,0,0,0|2,0,1]=4 20 B8R0.28 CC(Cl)CCCC(=O)Cl F8889-6486 [0,0,1,0,0,0|3,0,0]=4 21 B8R0.28 CC(O)CNCC(F)F F1913-1843 [0,0,1,0,0,0|2,0,1]=4 22 B8R0.28 O=C(O)CCCC(F)F F1905-8061 [0,0,1,0,0,0|3,0,0]=4 23 B10R2.178 O=C1NCC2CCC1C2 F2197-2339 [0,0,0,1,0,0|3,0,0]=4 24 B10R2.348 O=C(O)C12CC(CN1)C2 F2124-0081 [0,0,0,1,0,0|1,0,0]=2 25 B10R2.348 O=C(O)C12CC(CN1)C2 F8888-2779 [0,0,0,1,0,0|1,0,0]=2 26 B10R2.355 O=C(O)C1NCC2CC21 F2124-1142 [0,0,0,1,0,0|1,0,0]=2 27 B8R1.23 CC(=O)C1CC(=O)C1 F2147-4832 [0,0,0,0,1,0|1,0,2]=4 28 B8R1.23 N=C(N)N1CC(O)C1 F1907-4834 [0,0,0,0,1,0|3,0,0]=4 29 B8R1.23 NC(=O)N1CC(N)C1 F2147-4842 [0,0,0,0,1,0|3,0,0]=4 30 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 F1913-7309 [0,0,0,0,1,0|1,0,0]=2 31 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 F1913-7308 [0,0,0,0,1,0|1,0,0]=2 32 B8R1.23 OC1CC(C(F)F)C1 F1913-7360 [0,0,0,0,1,0|2,0,1]=4 33 B8R1.31 CC1CCC1C(=O)O F8880-6303 [0,0,0,0,1,0|2,0,0]=3 34 B10R1.54 CC(=O)CN1CCC(O)C1 F1908-2312 [0,0,0,0,0,1|3,0,0]=4 35 B10R1.54 CC1CCC(CC(=O)O)C1 F8880-1453 [0,0,0,0,0,1|2,0,0]=3 36 B10R1.54 NC(=O)CN1CCC(O)C1 F8884-2239 [0,0,0,0,0,1|3,0,0]=4 37 B10R1.54 O=C(O)CC1CCC(=O)C1 F2147-3720 [0,0,0,0,0,1|1,0,2]=4 38 B7R0.3 C=CCCC(C)CN F2147-8858 [1,0,1,0,0,0|2,0,0]=4 39 B7R0.3 C=CCCC(F)CN F2147-5994 [1,0,1,0,0,0|2,0,0]=4 40 B7R0.4 O=C(O)C#CCCO F1913-6697 [1,0,1,0,0,0|1,0,1]=4 41 B7R0.5 CCSC(F)C(=O)O F8884-4602 [1,0,1,0,0,0|2,0,0]=4 42 B7R0.5 NC(CCF)C(=O)O F1913-7468 [1,0,1,0,0,0|1,0,0]=3 43 B7R0.6 O=C(O)CCC(F)F F8880-4978 [1,0,1,0,0,0|2,0,0]=4 44 B7R0.15 CCC(OC)C(N)=O F3310-0230 [1,0,1,0,0,0|2,0,0]=4 45 B7R0.15 COC(CN)C(=O)O F8888-0400 [1,0,1,0,0,0|2,0,0]=4 46 B7R1.1 C=CC1CCCN1 F2147-2045 [2,0,0,0,0,0|1,0,0]=3 47 B7R1.1 FCC1CCCN1 F8887-7377 [2,0,0,0,0,0|1,0,1]=4 48 B7R1.2 CC1CC(O)CN1 F8889-6343 [2,0,0,0,0,0|0,0,1]=3 49 B9R0.7 CC(CCC(F)F)C(=O)O F2147-8564 [0,1,1,0,0,0|2,0,0]=4 50 B9R0.64 CC(C)(CN)CCC(=O)O F2147-8205 [0,1,1,0,0,0|1,0,0]=3 51 B9R0.39 CCC(CC(F)F)C(=O)O F1913-0357 [0,1,1,0,0,0|2,0,0]=4 52 B9R0.11 CN(C)CC(C)(N)C(=O)O F8882-7257 [0,1,1,0,0,0|2,0,0]=4 53 B9R0.56 CC(F)(F)CCCC(=O)O F2147-8527 [0,1,1,0,0,0|2,0,0]=4 54 B9R1.133 CC1(C)CNC(CO)C1 F1913-0642 [1,1,0,0,0,0|1,0,1]=4 55 B9R1.133 OCC1CC(F)(F)CN1 F1908-1592 [1,1,0,0,0,0|1,0,1]=4 56 B9R1.41 CC1NCCC1C(=O)O F1913-1553 [1,1,0,0,0,0|2,0,0]=4 57 B9R1.41 O=C(O)C1CCNC1=O F2147-4959 [1,1,0,0,0,0|2,0,0]=4 58 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O F1913-3325 [1,1,0,0,0,0|2,0,0]=4 59 B9R1.41 O=C(O)[C@H]1CNC[C@H]1F F1913-3322 [1,1,0,0,0,0|2,0,0]=4 60 B9R1.163 CC1(C(N)=O)CCCN1 F2147-6037 [1,1,0,0,0,0|1,0,0]=3 61 B9R1.163 O=C(O)C1(F)CCCC1 F8889-1819 [1,1,0,0,0,0|1,0,0]=3 62 B9R1.163 O=C(O)C1(F)CCNC1 F2197-0387 [1,1,0,0,0,0|2,0,0]=4 63 B9R1.82 CCC(=O)N1CC(O)C1 F1908-1260 [0,1,0,0,1,0|2,0,0]=4 64 B9R1.82 NCC(=O)N1CC(O)C1 F1907-4823 [0,1,0,0,1,0|2,0,0]=4 65 B9R1.95 CC=C1CC(C(=O)O)C1 F2167-7754 [0,1,0,0,1,0|1,0,1]=4 66 B9R1.95 CCC1CC(C(=O)O)C1 F2167-8038 [0,1,0,0,1,0|1,0,0]=3 67 B9R1.95 CS[C@H]1C[C@@H](C(=O)O)C1 F2147-8650 [0,1,0,0,1,0|0,1,0]=3 68 B9R1.95 CS[C@H]1C[C@H](C(=O)O)C1 F2147-8649 [0,1,0,0,1,0|0,1,0]=3 69 B9R1.164 CC(=O)C1CC(C)(C)C1 F2147-2586 [0,1,0,0,1,0|2,0,0]=4 70 B9R1.164 CC1(C)CC(C(=O)O)N1 F1905-7334 [0,1,0,0,1,0|1,0,0]=3 71 B9R1.164 CC1(F)CC(C(=O)O)C1 F2147-5292 [0,1,0,0,1,0|1,0,0]=3 72 B9R1.164 O=C(Cl)C1CC(F)(F)C1 F2147-4625 [0,1,0,0,1,0|2,0,0]=4 73 B11R1.3 C#C[C@H]1CC[C@@H](C(=O)O)CC1 F1913-6444 [0,1,0,0,0,1|2,0,0]=4 74 B11R1.3 C#C[C@H]1CC[C@H](C(=O)O)CC1 F2147-2819 [0,1,0,0,0,1|2,0,0]=4 75 B11R1.22 COC(=O)C1CNC(=O)CN1 F8888-7663 [0,1,0,0,0,1|0,0,2]=4 76 B11R1.43 O=C(O)CN1CCC(CO)C1 F1908-0538 [0,1,0,0,0,1|2,0,0]=4 77 B11R1.23 COC(=O)C1CC(C)=CCN1 F1967-2950 [0,1,0,0,0,1|1,0,1]=4 78 B11R1.23 COC(=O)C1CC(C)CCN1 F8887-3425 [0,1,0,0,0,1|1,0,0]=3 79 B11R1.730 O=C(O)C1CCCC(F)(F)C1 F9994-0662 [0,1,0,0,0,1|2,0,0]=4 80 B11R1.866 COC(=O)C1CC(F)(F)CN1 F1907-0075 [0,2,0,0,0,0|1,0,0]=3 81 B11R1.644 CC1(C)CC(C(=O)O)NC1=O F1913-3195 [0,2,0,0,0,0|1,0,1]=4 82 B9R1.39 OCCN[C@@H]1CC[C@H]1O F6619-0483 [0,0,1,1,0,0|1,0,1]=4 83 B9R1.1 NCC1CNC(=O)CO1 F8880-7551 [0,0,1,1,0,0|2,0,0]=4 84 B9R1.49 NC1CCOC(=O)CC1 F2147-2083 [0,0,1,1,0,0|2,0,0]=4 85 B9R1.49 O=C1CCC(O)CCO1 F2147-2084 [0,0,1,1,0,0|1,0,0]=3 86 B9R1.84 O=C(O)CCC1CNC1 F2158-1592 [0,0,1,1,0,0|1,0,0]=3 87 B9R1.36 CC1(C)CC(N)C(=O)N1 F1913-1882 [0,0,1,1,0,0|2,0,0]=4 88 B9R1.36 CC1(C)CC(N)C(=O)N1 F1913-1883 [0,0,1,1,0,0|2,0,0]=4 89 B9R1.53 CC(=O)CN1CC(O)C1 F1907-2879 [0,0,1,1,0,0|1,0,0]=3 90 B9R1.53 NC(=O)CN1CC(N)C1 F1908-2323 [0,0,1,1,0,0|2,0,0]=4 91 B9R1.53 NC(=O)CN1CC(O)C1 F1908-2322 [0,0,1,1,0,0|1,0,0]=3 92 B9R1.53 O=C(O)CN1CC(O)C1 F1908-0472 [0,0,1,1,0,0|0,0,0]=2 93 B9R2.7 O=C1CC2CCCC12 F8884-9269 [1,0,0,1,0,0|2,0,0]=4 94 B9R2.7 OC1CC2CCNC12 F1913-0513 [1,0,0,1,0,0|1,0,1]=4 95 B11R2.857 O=C(O)CC12CC(CN1)C2 F2147-8208 [0,0,0,1,0,1|1,0,0]=3 96 B11R2.1826 O=C(O)C12CNCC(C1)C2 F2147-5117 [0,0,0,1,0,1|1,0,0]=3 97 B11R2.201 O=C1OC(=O)C2CCC1C2 F3161-0426 [0,1,0,1,0,0|1,0,1]=4 98 B7R0.16 CC(C)C(F)C(=O)O F8889-5916 [0,0,1,0,1,0|2,0,0]=4 99 B7R1.10 CO[C@H]1C[C@@H](O)C1 F1913-1421 [1,0,0,0,1,0|2,0,0]=4 100 B7R1.10 CO[C@H]1C[C@H](O)C1 F1913-1500 [1,0,0,0,1,0|2,0,0]=4 101 B7R1.10 OC[C@H]1C[C@@H](F)C1 F1913-7314 [1,0,0,0,1,0|1,0,1]=4 102 B7R1.10 OC[C@H]1C[C@H](F)C1 F1913-7310 [1,0,0,0,1,0|1,0,1]=4 103 B7R1.18 NC(=S)C1CCC1 F1913-0023 [1,0,0,0,1,0|1,1,0]=4 104 B7R1.18 O=C(O)C1=CCC1 F8889-7863 [1,0,0,0,1,0|0,0,2]=4 105 B9R1.13 CC(C)=CC1CCCN1 F2167-7579 [1,0,0,0,0,1|2,0,0]=4 106 B9R1.13 O=C(O)CC1CCCS1 F2147-4096 [1,0,0,0,0,1|1,0,0]=3