0 B7R0.4 C#CCSCC(=O)O F2147-0623 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.4 CC(=O)NCCCN F8888-5285 [0,0,0,0,0,0|2,0,0]=2 2 B7R0.4 CC(C)COCCN F2167-3704 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.4 CCCCNC(C)C F1911-1667 [0,0,0,0,0,0|2,0,1]=3 4 B7R0.4 CCNCCC(C)C F1911-1772 [0,0,0,0,0,0|2,0,1]=3 5 B6R0.4 C=C(C)CCCBr F1913-0542 [1,0,0,0,0,0|2,0,0]=3 6 B6R0.4 C=C(C)CCCO F1913-0541 [1,0,0,0,0,0|2,0,0]=3 7 B6R0.4 CCCNC(C)C F8889-6089 [1,0,0,0,0,0|2,0,1]=4 8 B6R0.4 CCNCC(C)C F8880-2710 [1,0,0,0,0,0|2,0,1]=4 9 B6R0.4 CCOCC(C)N F2167-3742 [1,0,0,0,0,0|2,0,1]=4 10 B6R0.6 CCCCN=[N+]=[N-] F1901-3137 [1,0,0,0,0,0|3,0,0]=4 11 B6R0.6 CCOCCNC F8880-1014 [1,0,0,0,0,0|2,0,0]=3 12 B6R0.6 COCCCNN F8887-6111 [1,0,0,0,0,0|3,0,0]=4 13 B8R0.5 CCC\C(C)=C\C(=O)O F8880-7277 [0,1,0,0,0,0|1,0,2]=4 14 B8R0.7 CC(C)CCOCCO F2148-1935 [0,1,0,0,0,0|2,0,1]=4 15 B8R0.7 CCOCCNC(C)C F1911-1743 [0,1,0,0,0,0|2,0,1]=4 16 B8R0.7 COCCCNC(C)C F1967-9278 [0,1,0,0,0,0|2,0,1]=4 17 B8R0.7 O=[N+]([O-])OCCCCBr F9995-2702 [0,1,0,0,0,0|3,0,0]=4 18 B8R0.9 CCC(C)CNC(C)C F1911-1806 [0,1,0,0,0,0|2,0,1]=4 19 B8R0.28 CC(C)=CCCC(=O)O F8885-2839 [0,1,0,0,0,0|1,0,2]=4 20 B8R0.28 CC(C)CCNC(C)C F1911-1773 [0,1,0,0,0,0|2,0,1]=4 21 B8R0.28 O=C(O)CCC[N+](=O)[O-] F2147-8057 [0,1,0,0,0,0|3,0,0]=4 22 B8R1.1 NN1CCC(CF)C1 F1907-4561 [0,0,0,1,0,0|3,0,0]=4 23 B8R1.1 O=C1NC(CO)CO1 F2147-2878 [0,0,0,1,0,0|3,0,0]=4 24 B8R1.7 O=C(Cl)C1CCOC1 F0001-1806 [0,0,0,1,0,0|2,0,0]=3 25 B8R1.19 CC1NCCC1(C)C F2147-7983 [0,0,0,1,0,0|2,0,1]=4 26 B8R1.22 CC1CCCCCN1 F8880-1466 [0,0,0,1,0,0|1,0,1]=3 27 B8R1.22 CC1CNCCCO1 F2148-0118 [0,0,0,1,0,0|1,0,2]=4 28 B8R1.34 CC(=O)C=C1COC1 F2147-8623 [0,0,0,1,0,0|1,0,2]=4 29 B8R1.34 CC(=O)OC1CNC1 F2147-1188 [0,0,0,1,0,0|2,0,0]=3 30 B8R1.34 O=C(O)CC1CNC1 F8887-4133 [0,0,0,1,0,0|2,0,0]=3 31 B8R1.35 CC(C)NCC1CC1 F8880-6352 [0,0,0,1,0,0|2,0,1]=4 32 B8R1.35 O=C(O)CNC1CC1 F2147-0954 [0,0,0,1,0,0|2,0,0]=3 33 B5R0.1 CNCC(N)=O F8880-4275 [2,0,0,0,0,0|2,0,0]=4 34 B5R0.1 COCC(N)=O F1913-0020 [2,0,0,0,0,0|2,0,0]=4 35 B5R0.2 C=CCCNC F1911-1847 [2,0,0,0,0,0|1,0,1]=4 36 B7R0.3 CCCCC(O)CN F2189-0851 [1,1,0,0,0,0|0,0,2]=4 37 B7R0.3 COC(=O)NCCN F8882-3539 [1,1,0,0,0,0|2,0,0]=4 38 B7R0.8 CS(=O)(=O)CCCBr F8881-7268 [1,1,0,0,0,0|2,0,0]=4 39 B7R0.1 CCNCCOCC F8880-0814 [1,1,0,0,0,0|1,0,1]=4 40 B9R0.53 CC(C)CC(N)CN(C)C F2147-2535 [0,2,0,0,0,0|2,0,0]=4 41 B9R0.1 COC(=O)CCNC(C)C F3367-0316 [0,2,0,0,0,0|1,0,0]=3 42 B9R0.46 COC(=O)CCCN=C=O F8880-0122 [0,2,0,0,0,0|1,0,1]=4 43 B9R0.2 CCCCSCCC(=O)O F0907-4170 [0,2,0,0,0,0|1,0,0]=3 44 B9R0.7 CC(C)CCC(N)C(=O)O F8887-4015 [0,2,0,0,0,0|1,0,0]=3 45 B9R0.51 COCCC(C)(C)C(=O)O F8880-7379 [0,2,0,0,0,0|2,0,0]=4 46 B7R1.2 CC1CCC(C)N1 F2124-0275 [1,0,0,1,0,0|1,0,1]=4 47 B7R1.2 NC1CNC(=O)C1 F2158-1004 [1,0,0,1,0,0|2,0,0]=4 48 B7R1.10 C=C1CC(CN)C1 F2147-8211 [1,0,0,1,0,0|2,0,0]=4 49 B7R1.1 C=CC1CCNC1 F2167-8027 [1,0,0,1,0,0|1,0,1]=4 50 B7R1.1 CCC1CCCN1 F8880-6440 [1,0,0,1,0,0|1,0,1]=4 51 B7R1.1 CCC1CCCN1 F8888-3269 [1,0,0,1,0,0|1,0,1]=4 52 B7R1.1 CCC1CCNC1 F8881-7172 [1,0,0,1,0,0|1,0,0]=3 53 B7R1.1 CCC1CCNC1 F8887-6136 [1,0,0,1,0,0|1,0,0]=3 54 B7R1.1 CNC1CCOC1 F1906-0103 [1,0,0,1,0,0|2,0,0]=4 55 B7R1.1 CNC1CCSC1 F2158-1845 [1,0,0,1,0,0|2,0,0]=4 56 B7R1.1 NOC1CCCC1 F1913-1612 [1,0,0,1,0,0|2,0,0]=4 57 B7R1.4 CC1CCCC1N F8888-6869 [1,0,0,1,0,0|1,0,1]=4 58 B7R1.4 O=C1CCCC1Br F8888-2301 [1,0,0,1,0,0|1,0,0]=3 59 B7R1.6 CCSC1CNC1 F2147-1202 [1,0,0,1,0,0|2,0,0]=4 60 B7R1.6 NNCC1CCC1 F1904-0041 [1,0,0,1,0,0|2,0,0]=4 61 B7R1.24 C1CNCCOC1 F1905-6472 [1,0,0,1,0,0|2,0,0]=4 62 B9R1.13 CC(N)CN1CCCC1 F8880-3927 [0,1,0,1,0,0|1,0,1]=4 63 B9R1.13 CN(C)CC1CCNC1 F2158-0996 [0,1,0,1,0,0|2,0,0]=4 64 B9R1.13 O=C(O)CC1CCCO1 F8881-1071 [0,1,0,1,0,0|1,0,0]=3 65 B9R1.41 CC(C)C1CCCC1O F8885-0772 [0,1,0,1,0,0|1,0,1]=4 66 B9R1.41 CN(C)C1CCCC1N F8880-7992 [0,1,0,1,0,0|2,0,0]=4 67 B9R1.48 O=C1CCCNC(=O)C1 F2147-2486 [0,1,0,1,0,0|1,0,1]=4 68 B9R1.53 CC(=O)CN1CC(N)C1 F1907-2880 [0,1,0,1,0,0|1,0,0]=3 69 B9R1.1 CCC1CCC(N)CC1 F2167-8035 [0,1,0,1,0,0|1,0,1]=4 70 B9R1.2 CN1CCCC(CN)C1 F2147-0147 [0,1,0,1,0,0|2,0,0]=4 71 B9R1.2 NN1CCCC(CF)C1 F1907-4518 [0,1,0,1,0,0|2,0,0]=4 72 B9R1.5 CN1CCNCCC1=O F2167-7649 [0,1,0,1,0,0|1,0,0]=3 73 B9R1.11 CNC(=O)C1CCNC1 F2197-5156 [0,1,0,1,0,0|1,0,0]=3 74 B9R1.118 NCC1(F)CCCCC1 F8888-6591 [0,1,0,1,0,0|1,0,1]=4 75 B9R1.118 OCC1(F)CCCCC1 F2167-7997 [0,1,0,1,0,0|1,0,1]=4 76 B9R1.6 CC(=O)C1=CNCCC1 F8880-8034 [0,1,0,1,0,0|0,0,2]=4 77 B9R1.6 CC(C)C1CCCCN1 F8880-1089 [0,1,0,1,0,0|1,0,1]=4 78 B9R1.6 CC(O)C1CCCNC1 F8887-4658 [0,1,0,1,0,0|0,0,2]=4 79 B9R1.6 NC(=O)C1CNCCO1 F1913-0331 [0,1,0,1,0,0|2,0,0]=4 80 B9R1.85 O=C(O)COCC1CC1 F8889-0413 [0,1,0,1,0,0|1,0,0]=3 81 B9R1.110 C[C@@H](C(=O)O)N1CCC1 F2147-2564 [0,1,0,1,0,0|2,0,0]=4 82 B9R1.163 CC1(C(=O)O)CCCN1 F8888-1238 [0,1,0,1,0,0|2,0,0]=4 83 B9R1.163 CC1(C(=O)O)CCCO1 F8881-6403 [0,1,0,1,0,0|2,0,0]=4 84 B9R1.163 NC1(C(=O)O)CCSC1 F2147-2001 [0,1,0,1,0,0|2,0,0]=4 85 B9R1.133 O=S1(=O)CCC(CO)C1 F1294-0070 [0,1,0,1,0,0|2,0,0]=4 86 B9R1.19 CS(=O)(=O)C1CCNC1 F9995-1818 [0,1,0,1,0,0|2,0,0]=4 87 B9R2.138 O=C1CC2(CCC2)C1 F8889-0829 [0,0,0,2,0,0|0,0,0]=2