0 B9R0.35 CCOC(=O)C(F)CC=O F1913-0170 [0,0,0,0,0,0|2,0,1]=3 1 B9R0.35 CCOC(=O)\C(Br)=C\CS F1913-6621 [0,0,0,0,0,0|2,0,2]=4 2 B9R0.35 CCOC(=O)\C(F)=C\CS F1913-6623 [0,0,0,0,0,0|2,0,2]=4 3 B8R0.1 CCNC(=O)NCCN F2167-2509 [1,0,0,0,0,0|3,0,0]=4 4 B8R0.1 CCOC(=O)\C=C\CF F1913-6629 [1,0,0,0,0,0|1,0,2]=4 5 B8R0.1 CCOC(=O)\C=C\CS F1913-6620 [1,0,0,0,0,0|1,0,2]=4 6 B8R0.3 COC(=O)C(N)CCF F1913-7467 [1,0,0,0,0,0|2,0,0]=3 7 B10R0.19 C=CCCC(=O)C(=O)OCC F1913-2949 [0,1,0,0,0,0|1,0,2]=4 8 B10R1.4 C#CCC1CCCCC1=O F8882-5657 [0,0,0,1,0,0|1,0,2]=4 9 B10R1.4 NCCN1CCCNC1=O F8887-5345 [0,0,0,1,0,0|3,0,0]=4 10 B10R1.4 O=C1CCCCN1CCCl F1905-0054 [0,0,0,1,0,0|3,0,0]=4 11 B10R1.140 CCCC(=O)N1CC(N)C1 F1907-3515 [0,0,0,1,0,0|3,0,0]=4 12 B10R1.140 CCOC(=O)N1CC(O)C1 F6661-6530 [0,0,0,1,0,0|2,0,0]=3 13 B10R0.2 CCC\C(C)=C\C(=O)OCC F1913-7269 [0,0,0,0,0,1|0,0,1]=2 14 B10R0.2 CCNC(=S)NC(=O)OCC F1904-5457 [0,0,0,0,0,1|2,0,1]=4 15 B7R0.3 CCNCC(C)CC F8881-5417 [2,0,0,0,0,0|1,0,1]=4 16 B7R0.3 COCCC(=O)CCl F8889-0261 [2,0,0,0,0,0|2,0,0]=4 17 B7R0.3 O=C(CCl)CCCCl F8881-1741 [2,0,0,0,0,0|2,0,0]=4 18 B7R0.5 CCCC(C)C(C)N F8882-3710 [2,0,0,0,0,0|1,0,1]=4 19 B7R0.5 CCSC(F)C(=O)O F8884-4602 [2,0,0,0,0,0|2,0,0]=4 20 B7R0.5 NC(CCF)C(=O)O F1913-7468 [2,0,0,0,0,0|2,0,0]=4 21 B9R0.5 CCOC(=O)CCCC=O F1913-2944 [1,1,0,0,0,0|0,0,1]=3 22 B9R0.5 CCOC(=O)CCN=[N+]=[N-] F1901-3139 [1,1,0,0,0,0|2,0,0]=4 23 B9R0.48 CCOC(=O)CCC(C)N F8888-5167 [1,1,0,0,0,0|0,0,0]=2 24 B9R0.23 COC(=O)C(N)CC(F)F F8888-3496 [1,1,0,0,0,0|2,0,0]=4 25 B9R0.60 C#CCC(C)(C)C(=O)OC F2147-6077 [1,1,0,0,0,0|0,0,2]=4 26 B9R0.60 C=CCC(C)(C)C(=O)OC F2147-6069 [1,1,0,0,0,0|0,0,2]=4 27 B9R0.60 CCCC(C)(C)C(=O)OC F2147-6043 [1,1,0,0,0,0|0,0,0]=2 28 B11R0.5 CCCNC(=S)NC(=O)OCC F1904-5366 [0,1,0,0,0,1|1,0,1]=4 29 B11R0.59 CCOC(=O)C(C)CCC(C)=O F2147-8549 [0,2,0,0,0,0|0,0,0]=2 30 B11R0.73 CCC(Cl)C(=O)N(C)CCOC F1907-8618 [0,2,0,0,0,0|2,0,0]=4 31 B11R0.73 CCCCN(C)C(=O)C(Cl)CC F1907-8517 [0,2,0,0,0,0|2,0,0]=4 32 B11R0.247 CCOC(=O)C(F)(F)CCC#N F1913-7069 [0,2,0,0,0,0|1,0,1]=4 33 B11R0.149 CC(C)C[C@H](N)C(=O)NC(C)C F2147-1610 [0,2,0,0,0,0|2,0,0]=4 34 B9R1.8 CCCC1CCCNC1 F2167-1864 [1,0,0,1,0,0|1,0,1]=4 35 B9R1.8 CCCC1CCCNC1 F8881-5623 [1,0,0,1,0,0|1,0,1]=4 36 B9R1.12 CCNCC1CCCC1 F8885-5894 [1,0,0,1,0,0|1,0,1]=4 37 B9R1.12 CCOCC1CCNC1 F8889-6576 [1,0,0,1,0,0|1,0,1]=4 38 B9R1.12 CC\C=C/C1CCCN1 F2167-7844 [1,0,0,1,0,0|2,0,0]=4 39 B9R1.12 CC\C=C/C1CCNC1 F2167-7845 [1,0,0,1,0,0|2,0,0]=4 40 B9R1.15 CCC1CCCNC1=O F1913-7612 [1,0,0,1,0,0|2,0,0]=4 41 B9R1.49 CC1CCNC(=O)CO1 F1913-2480 [1,0,0,1,0,0|2,0,0]=4 42 B9R1.49 NC1CCOC(=O)CC1 F2147-2083 [1,0,0,1,0,0|1,0,0]=3 43 B9R1.49 O=C1CCC(O)CCO1 F2147-2084 [1,0,0,1,0,0|1,0,0]=3 44 B9R1.69 CC1NC(=O)CCC1N F2147-7967 [1,0,0,1,0,0|2,0,0]=4 45 B9R1.73 CCOC(=O)C1=CCC1 F1967-2952 [1,0,0,1,0,0|0,0,2]=4 46 B9R1.75 CCOC(=O)C=C1CC1 F2147-3516 [1,0,0,1,0,0|0,0,2]=4 47 B9R1.5 CC1CSCCNC1=O F2147-1410 [1,0,0,1,0,0|2,0,0]=4 48 B9R1.82 CCC(=O)N1CC(O)C1 F1908-1260 [1,0,0,1,0,0|2,0,0]=4 49 B9R1.88 C#CC1CC1C(=O)OC F1913-5197 [1,0,0,1,0,0|0,0,2]=4 50 B9R1.88 C=CC1CC1C(=O)OC F1913-5192 [1,0,0,1,0,0|0,0,2]=4 51 B9R1.88 COC(=O)[C@@H]1C[C@H]1CO F1913-6664 [1,0,0,1,0,0|1,0,0]=3 52 B9R1.132 CN1C(=O)CCC1CBr F1905-0025 [1,0,0,1,0,0|2,0,0]=4 53 B9R1.202 CC1(CO)CCNC1=O F1913-7522 [1,0,0,1,0,0|2,0,0]=4 54 B9R1.202 CCC1(C)CCCC1=O F2167-7957 [1,0,0,1,0,0|1,0,0]=3 55 B11R1.30 CCOC(=O)CC1CCNC1 F2167-8214 [0,0,0,1,0,1|1,0,0]=3 56 B11R1.30 CCOC(=O)\C=C1\CCNC1 F2167-8198 [0,0,0,1,0,1|1,0,1]=4 57 B11R1.5 CCCN1CCNCCC1=O F2167-7680 [0,1,0,1,0,0|2,0,0]=4 58 B11R1.16 CCNC(=O)N1CCOCC1 F8887-1840 [0,1,0,1,0,0|2,0,0]=4 59 B11R1.16 CCNC(=O)N1CCSCC1 F8885-6235 [0,1,0,1,0,0|2,0,0]=4 60 B11R1.287 CCOCC(=O)N1CC(N)C1 F1908-1104 [0,1,0,1,0,0|2,0,0]=4 61 B11R1.287 CCOCC(=O)N1CC(O)C1 F1908-1103 [0,1,0,1,0,0|2,0,0]=4 62 B11R1.349 CCOC(=O)C(F)C1CNC1 F1913-0190 [0,1,0,1,0,0|1,0,0]=3 63 B11R1.77 CC(C)NC(=O)N1CCCC1 F8887-1858 [0,1,0,1,0,0|2,0,0]=4 64 B11R1.86 O=C1NCCCC1CC(F)F F2147-4958 [0,1,0,1,0,0|2,0,0]=4 65 B11R1.816 CCOC(=O)[C@@H]1C[C@@H]1C(=O)Cl F1913-7168 [0,1,0,1,0,0|1,0,1]=4 66 B11R1.816 CCOC(=O)[C@@H]1C[C@H]1C(=O)Cl F1913-7167 [0,1,0,1,0,0|1,0,1]=4 67 B11R1.831 C#CC1(C(=O)OCC)CCC1 F1913-6337 [0,1,0,1,0,0|0,0,1]=3 68 B11R1.831 CCOC(=O)C1(C=O)CCC1 F2147-3074 [0,1,0,1,0,0|0,0,1]=3 69 B11R1.31 CCC(Cl)C(=O)N1CCCC1 F8882-8763 [0,1,0,1,0,0|2,0,0]=4 70 B11R1.268 CCC1CCNC(=O)C1(F)F F1913-7116 [0,1,0,1,0,0|2,0,0]=4 71 B11R2.55 O=C1CCCCC1C2CC2 F8889-2957 [0,0,0,2,0,0|1,0,0]=3 72 B11R2.370 O=C1NCCOC12CCC2 F2147-5081 [0,0,0,2,0,0|2,0,0]=4 73 B11R2.8 NC1CC2CCCN2C1=O F1913-0580 [0,0,0,2,0,0|2,0,0]=4 74 B11R2.3 O=C1CCCC12CCNC2 F2147-4039 [0,0,0,2,0,0|2,0,0]=4 75 B11R2.3 O=C1CCCC12CCOC2 F2167-7914 [0,0,0,2,0,0|2,0,0]=4 76 B11R2.3 O=C1NCCC12CCCN2 F1913-4941 [0,0,0,2,0,0|2,0,0]=4 77 B11R2.3 O=C1OCCC12CCNC2 F1913-3227 [0,0,0,2,0,0|1,0,0]=3 78 B11R2.201 O=C1OC(=O)C2CCC1C2 F3161-0426 [0,0,0,2,0,0|1,0,1]=4