0 B8R0.6 CNC\C=C\C(=O)NC F1913-0318 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.6 COC(=O)CCCC=O F1913-2954 [0,0,0,0,0,0|2,0,0]=2 2 B7R0.3 COC(=O)CN=C=O F2163-0159 [1,0,0,0,0,0|1,1,1]=4 3 B7R0.3 COC(=O)\C=C\CF F1913-6628 [1,0,0,0,0,0|1,0,2]=4 4 B7R0.3 COC(=O)\C=C\CS F1913-7698 [1,0,0,0,0,0|0,0,2]=3 5 B7R0.3 COCCC(=O)CCl F8889-0261 [1,0,0,0,0,0|2,1,0]=4 6 B7R0.3 O=C(CCl)CCCCl F8881-1741 [1,0,0,0,0,0|3,0,0]=4 7 B7R0.4 C#CCOCC(=O)O F8885-6186 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.4 C=C(C)CCCNC F1913-0544 [1,0,0,0,0,0|2,0,0]=3 9 B9R0.5 CCOC(=O)CCCC=O F1913-2944 [0,1,0,0,0,0|2,0,0]=3 10 B9R0.5 CCOC(=O)CCN=[N+]=[N-] F1901-3139 [0,1,0,0,0,0|3,0,0]=4 11 B9R0.8 C#CCCC(N)C(=O)OC F1913-2966 [0,1,0,0,0,0|1,0,1]=3 12 B9R0.24 C#CC(N)CCC(=O)OC F1913-0217 [0,1,0,0,0,0|1,0,1]=3 13 B9R0.46 COCCCNC(=O)CN F1908-0835 [0,1,0,0,0,0|2,1,0]=4 14 B9R1.1 C#CC1CCC(=O)CC1 F8888-1106 [0,0,0,1,0,0|2,0,1]=4 15 B9R1.1 CC=C1CCC(=O)CC1 F2167-7755 [0,0,0,1,0,0|2,0,1]=4 16 B9R1.5 CC1CSCCNC1=O F2147-1410 [0,0,0,1,0,0|2,0,0]=3 17 B9R1.7 CSC[C@H]1CC[C@@H](N)C1 F1913-6206 [0,0,0,1,0,0|2,0,1]=4 18 B9R1.7 NCCC1CNC(=O)C1 F2147-1996 [0,0,0,1,0,0|3,0,0]=4 19 B9R1.7 O=C1CC(CCO)CN1 F2147-1995 [0,0,0,1,0,0|3,0,0]=4 20 B9R1.11 CCN(N)C1CCSC1 F1907-7636 [0,0,0,1,0,0|3,0,0]=4 21 B9R1.88 C#CC1CC1C(=O)OC F1913-5197 [0,0,0,1,0,0|1,0,1]=3 22 B9R1.88 C=CC1CC1C(=O)OC F1913-5192 [0,0,0,1,0,0|1,0,1]=3 23 B9R1.88 COC(=O)[C@@H]1C[C@H]1CO F1913-6664 [0,0,0,1,0,0|2,0,0]=3 24 B9R1.89 C\C=C1\CCCNCC1 F2167-7748 [0,0,0,1,0,0|3,0,0]=4 25 B9R1.132 CN1C(=O)CCC1CBr F1905-0025 [0,0,0,1,0,0|3,0,0]=4 26 B6R0.6 C=CCCCC=O F2147-8874 [2,0,0,0,0,0|1,0,1]=4 27 B6R0.4 C=C(C)CCCN F1913-0543 [2,0,0,0,0,0|2,0,0]=4 28 B6R0.4 CSSCC(=O)O F8881-3230 [2,0,0,0,0,0|1,0,0]=3 29 B8R0.1 CNCC(F)CCOC F2147-5765 [1,1,0,0,0,0|1,0,1]=4 30 B8R0.3 COC(=O)C(N)CCF F1913-7467 [1,1,0,0,0,0|1,0,0]=3 31 B8R0.5 C=C(C)CC(F)CNC F2147-5980 [1,1,0,0,0,0|2,0,0]=4 32 B8R0.5 COCC(C)CC(=O)O F8881-0004 [1,1,0,0,0,0|0,1,0]=3 33 B8R0.28 CC(Cl)CCCC(=O)Cl F8889-6486 [1,1,0,0,0,0|2,0,0]=4 34 B8R0.28 O=C(O)CCCC(F)F F1905-8061 [1,1,0,0,0,0|2,0,0]=4 35 B10R0.3 CCOC(=O)CCC=C(C)C F2147-8297 [0,2,0,0,0,0|1,0,1]=4 36 B10R0.3 CCOC(=O)CCC[N+](=O)[O-] F2147-8059 [0,2,0,0,0,0|2,0,0]=4 37 B10R0.81 CCCCC(Br)C(=O)N(C)C F1913-0282 [0,2,0,0,0,0|2,0,0]=4 38 B10R0.124 C#CCCC(C)(C)C(=O)OC F2147-6395 [0,2,0,0,0,0|1,0,1]=4 39 B10R0.124 CC#CCC(C)(C)C(=O)OC F2147-6085 [0,2,0,0,0,0|1,0,1]=4 40 B10R0.124 CCCCC(C)(C)C(=O)OC F2147-6049 [0,2,0,0,0,0|1,0,0]=3 41 B10R0.124 COCCC(C)(C)C(=O)OC F2147-6252 [0,2,0,0,0,0|0,1,0]=3 42 B10R0.55 COC(=O)\C=C\CSC(F)F F1913-7700 [0,2,0,0,0,0|0,0,2]=4 43 B8R1.2 CC=C1CCCNC1 F8884-6468 [1,0,0,1,0,0|2,0,0]=4 44 B8R1.8 CNCC1CCSC1 F2147-4276 [1,0,0,1,0,0|1,0,1]=4 45 B8R1.8 C\C=C\C1CCNC1 F2167-7751 [1,0,0,1,0,0|2,0,0]=4 46 B8R1.10 COCCC1CNC1 F8887-6268 [1,0,0,1,0,0|1,0,1]=4 47 B8R1.10 COCCC1CNC1 F8888-1515 [1,0,0,1,0,0|1,0,1]=4 48 B8R1.1 NCC1COC(=O)C1 F2147-1307 [1,0,0,1,0,0|1,0,0]=3 49 B8R1.1 NCC1COC(=O)O1 F1913-0465 [1,0,0,1,0,0|2,0,0]=4 50 B8R1.1 O=C1CC(CO)CO1 F2147-2093 [1,0,0,1,0,0|0,1,0]=3 51 B8R1.3 O=C1CC[C@@H](O)CN1 F1911-5596 [1,0,0,1,0,0|1,1,0]=4 52 B8R1.38 CNC(=O)C1CNC1 F2158-1523 [1,0,0,1,0,0|2,0,0]=4 53 B8R1.38 CNC(=O)C1CNC1 F2185-0744 [1,0,0,1,0,0|2,0,0]=4 54 B8R1.38 COC(=O)C1=CCC1 F1967-2951 [1,0,0,1,0,0|0,0,2]=4 55 B8R1.40 COC(=O)C=C1CC1 F2147-3517 [1,0,0,1,0,0|0,0,2]=4 56 B8R1.6 C=C1CC(CNC)C1 F2147-8213 [1,0,0,1,0,0|2,0,0]=4 57 B8R1.6 CCOC1CC(=O)C1 F8889-5960 [1,0,0,1,0,0|2,0,0]=4 58 B8R1.6 CNCC1CC(=O)C1 F2147-4838 [1,0,0,1,0,0|1,0,0]=3 59 B8R1.6 NCCC1CC(=O)C1 F2147-4518 [1,0,0,1,0,0|2,0,0]=4 60 B8R1.7 CN(N)C1CCSC1 F1907-7597 [1,0,0,1,0,0|2,0,0]=4 61 B8R1.7 O=C(O)C1CCSC1 F2147-1614 [1,0,0,1,0,0|0,0,0]=2 62 B8R1.31 CC1CCC1C(=O)O F8880-6303 [1,0,0,1,0,0|1,0,0]=3 63 B8R1.34 CC(=O)CC1COC1 F2147-8624 [1,0,0,1,0,0|0,1,0]=3 64 B8R1.34 O=C(O)CC1CSC1 F2147-4270 [1,0,0,1,0,0|0,0,0]=2 65 B8R1.43 C#CC1CC1C(=O)O F1913-1035 [1,0,0,1,0,0|1,0,1]=4 66 B8R1.43 C=CC1CC1C(=O)O F1913-5193 [1,0,0,1,0,0|1,0,1]=4 67 B8R1.43 C=C[C@H]1C[C@@H]1C(=O)O F1913-7368 [1,0,0,1,0,0|1,0,1]=4 68 B8R1.43 C=C[C@H]1C[C@H]1C(=O)O F1913-7369 [1,0,0,1,0,0|1,0,1]=4 69 B10R1.14 C=C1CNC(C(=O)OC)C1 F2167-4379 [0,1,0,1,0,0|2,0,0]=4 70 B10R1.150 CNC(=O)CC1CC(=O)C1 F2147-5265 [0,1,0,1,0,0|2,0,0]=4 71 B10R1.408 COC(=O)[C@@H]1C[C@@H]1C(=O)O F1913-6669 [0,1,0,1,0,0|2,0,0]=4 72 B10R1.137 CCOC(=O)CC1CNC1 F2147-3915 [0,1,0,1,0,0|1,0,0]=3 73 B10R1.15 CNC(=O)C1CNCCO1 F1913-0332 [0,1,0,1,0,0|2,0,0]=4 74 B10R1.15 CNC(=O)C1CNCCO1 F8889-5517 [0,1,0,1,0,0|2,0,0]=4 75 B10R1.182 COC(=O)C(N)C1CCC1 F1913-3134 [0,1,0,1,0,0|1,0,0]=3 76 B10R1.182 COC(=O)C(N)C1CCC1 F8887-3419 [0,1,0,1,0,0|1,0,0]=3 77 B10R1.411 COC(=O)C1(F)CCNC1 F8881-1519 [0,1,0,1,0,0|1,0,0]=3 78 B10R1.411 COC(=O)C1(F)CCNC1 F8887-6745 [0,1,0,1,0,0|1,0,0]=3 79 B10R1.149 COC(=O)C1COCC1=O F1913-7694 [0,1,0,1,0,0|0,1,1]=4 80 B10R1.429 CNC(=O)CC1(N)COC1 F2147-8606 [0,1,0,1,0,0|1,1,0]=4 81 B10R1.1 CNCC1CNC(=O)CO1 F2147-5436 [0,1,0,1,0,0|2,0,0]=4 82 B10R1.1 NCCC1CCC(=O)NC1 F2147-8463 [0,1,0,1,0,0|2,0,0]=4 83 B10R1.1 O=C1CCC(CCO)CC1 F2147-3469 [0,1,0,1,0,0|2,0,0]=4 84 B10R1.16 [N-]=[N+]=NCC1COC(=O)C1 F2147-8761 [0,1,0,1,0,0|2,0,0]=4 85 B10R2.178 O=C1NCC2CCC1C2 F2197-2339 [0,0,0,2,0,0|2,0,0]=4 86 B10R2.335 O=C1CCC2(CC2)CN1 F2147-3576 [0,0,0,2,0,0|2,0,0]=4 87 B10R2.2 O=C1CC2COCC2C1 F2147-3764 [0,0,0,2,0,0|1,1,0]=4 88 B10R2.2 O=C1N[C@@H]2CCC[C@H]2O1 F1913-1324 [0,0,0,2,0,0|2,0,0]=4 89 B10R2.2 O=C1N[C@@H]2COC[C@H]2O1 F1913-1320 [0,0,0,2,0,0|1,1,0]=4 90 B10R2.14 O=C1NC(C2CC2)CO1 F8884-0669 [0,0,0,2,0,0|2,0,0]=4 91 B10R2.32 O=C1OCC2CNCC12 F1913-6072 [0,0,0,2,0,0|1,0,0]=3 92 B10R2.332 O=C1CC2(CCC2)CN1 F8884-9188 [0,0,0,2,0,0|2,0,0]=4 93 B10R2.332 O=C1CC2(CN1)COC2 F2147-8616 [0,0,0,2,0,0|1,1,0]=4 94 B10R2.332 O=C1CC2(CNC2)CN1 F2147-2892 [0,0,0,2,0,0|2,0,0]=4 95 B10R2.332 O=C1CC2(CNC2)CN1 F2167-8425 [0,0,0,2,0,0|2,0,0]=4