0 B8R1.4 NC1=CC(=O)CCC1 BB17-0155 [0,0,0,0,0,0|1,0,2]=3 1 B7R1.3 FC1CCCNC1 BB31-0459 [1,0,0,0,0,0|2,0,0]=3 2 B7R1.3 NN1CCOCC1 BB01-6278 [1,0,0,0,0,0|3,0,0]=4 3 B7R1.3 O=C1CCOCC1 BB53-1277 [1,0,0,0,0,0|1,0,0]=2 4 B7R1.3 O=C1CCSCC1 BB53-1260 [1,0,0,0,0,0|1,0,0]=2 5 B7R1.3 OC1CCCNC1 BB01-6209 [1,0,0,0,0,0|2,0,0]=3 6 B7R1.3 OC1CCNCC1 BB17-2908 [1,0,0,0,0,0|1,0,2]=4 7 B9R1.2 CCN1CCCC(Cl)C1 BB01-3842 [0,1,0,0,0,0|2,0,1]=4 8 B9R1.66 CC1(C)CC(=O)CCO1 BB53-1741 [0,1,0,0,0,0|1,0,0]=2 9 B7R0.2 CC(C)CC(N)CO BB20-2191 [0,0,1,0,0,0|2,0,1]=4 10 B7R0.2 CC(C)NC(=O)CCl BB01-5507 [0,0,1,0,0,0|2,0,0]=3 11 B7R0.2 CC(O)CC(=O)NN BB55-2167 [0,0,1,0,0,0|3,0,0]=4 12 B7R0.2 NCC(O)CC(=O)O BB57-4937 [0,0,1,0,0,0|3,0,0]=4 13 B7R0.4 C=C(C)CCCCC BB58-4377 [0,0,1,0,0,0|1,0,0]=2 14 B7R0.4 CC(=O)CCCCCl BB57-6752 [0,0,1,0,0,0|1,0,0]=2 15 B7R0.4 CC(=O)NCCCBr BB58-5163 [0,0,1,0,0,0|2,0,0]=3 16 B7R0.4 CC(=O)NCCCCl BB58-5165 [0,0,1,0,0,0|2,0,0]=3 17 B7R0.4 CC(C)CCN=C=S BB58-1671 [0,0,1,0,0,0|1,1,1]=4 18 B7R0.4 CC(C)NCCC#N BB01-6620 [0,0,1,0,0,0|2,0,1]=4 19 B7R0.4 CC(C)NCCCN BB01-5385 [0,0,1,0,0,0|2,0,1]=4 20 B7R0.4 CC(C)SCCCN BB01-5320 [0,0,1,0,0,0|2,0,1]=4 21 B7R0.4 CCCCOC(=S)[S-] BB55-6492 [0,0,1,0,0,0|2,1,0]=4 22 B7R0.4 CCOCCC(=O)O BB57-3742 [0,0,1,0,0,0|2,0,0]=3 23 B7R0.4 CNCCCC(=O)O BB58-0143 [0,0,1,0,0,0|2,0,0]=3 24 B7R0.7 CCNC(=O)CC#N BB57-4740 [0,0,1,0,0,0|2,0,1]=4 25 B7R0.7 CCNC(=O)CCCl BB57-1144 [0,0,1,0,0,0|2,0,0]=3 26 B7R0.7 CCOC(=O)CNN BB01-4606 [0,0,1,0,0,0|3,0,0]=4 27 B6R0.1 CCC(C)N=C=O BB01-6539 [1,0,1,0,0,0|1,0,1]=4 28 B6R0.1 CCC(O)COC BB57-6766 [1,0,1,0,0,0|2,0,0]=4 29 B6R0.1 CCCC(=O)NN BB01-6388 [1,0,1,0,0,0|2,0,0]=4 30 B6R0.1 CCNC(=O)CCl BB20-1611 [1,0,1,0,0,0|2,0,0]=4 31 B6R0.1 CNC(=O)CCN BB32-2825 [1,0,1,0,0,0|2,0,0]=4 32 B6R0.2 CC(C)CC(C)N BB01-6378 [1,0,1,0,0,0|1,0,1]=4 33 B6R0.4 CC(=O)NCCN BB20-2208 [1,0,1,0,0,0|2,0,0]=4 34 B6R0.4 CC(C)CCC=O BB58-4980 [1,0,1,0,0,0|0,0,0]=2 35 B6R0.4 CC(C)NCCN BB57-0247 [1,0,1,0,0,0|2,0,0]=4 36 B6R0.4 CC(C)OCCO BB01-5911 [1,0,1,0,0,0|1,0,1]=4 37 B6R0.4 CCNCC(=O)O BB20-0183 [1,0,1,0,0,0|2,0,0]=4 38 B8R0.2 CCN(C)C(C)C(=O)O BB58-2807 [0,1,1,0,0,0|2,0,0]=4 39 B8R0.5 CC(C)NC(=O)CCCl BB57-1148 [0,1,1,0,0,0|1,0,0]=3 40 B8R0.5 CNCC(=O)NC(C)C BB01-4844 [0,1,1,0,0,0|1,0,0]=3 41 B8R0.19 CCC(C)NC(=O)CCl BB01-5134 [0,1,1,0,0,0|1,0,0]=3 42 B8R0.23 CC(C)C(N)CC(=O)O BB01-4066 [0,1,1,0,0,0|2,0,0]=4 43 B8R0.23 CC(C)CC(=O)N(C)C BB57-2001 [0,1,1,0,0,0|1,0,0]=3 44 B8R0.23 CC(C)NC(=O)C(C)Br BB58-4930 [0,1,1,0,0,0|1,0,0]=3 45 B8R0.23 CC(C)NC(=O)C(C)Cl BB57-1146 [0,1,1,0,0,0|1,0,0]=3 46 B8R0.24 CC(C)(C)CC(=O)NN BB58-1385 [0,1,1,0,0,0|2,0,0]=4 47 B8R0.24 CC(C)(C)NC(=O)CCl BB53-1220 [0,1,1,0,0,0|2,0,0]=4 48 B8R0.6 CCCCCC(=O)NN BB55-0711 [0,1,1,0,0,0|1,0,0]=3 49 B8R0.6 CCCCNC(=O)CCl BB01-5126 [0,1,1,0,0,0|1,0,0]=3 50 B8R0.6 CCCCOC(=O)CCl BB17-2142 [0,1,1,0,0,0|1,0,0]=3 51 B8R0.6 CCCCOC(=O)CN BB01-2500 [0,1,1,0,0,0|1,0,0]=3 52 B8R0.6 COCCNC(=O)CCl BB01-5128 [0,1,1,0,0,0|2,0,0]=4 53 B8R0.7 CCCCCSC(=N)N BB58-4675 [0,1,1,0,0,0|2,0,0]=4 54 B8R0.7 CN(C)CCCCCN BB57-6433 [0,1,1,0,0,0|2,0,0]=4 55 B8R0.7 COCCOCC(=O)O BB57-6814 [0,1,1,0,0,0|2,0,0]=4 56 B8R0.7 NCCCCCC(=O)O BB57-3834 [0,1,1,0,0,0|1,0,0]=3 57 B8R0.8 CC(=O)C(C)CCC#N BB01-5869 [0,1,1,0,0,0|1,0,1]=4 58 B8R0.8 CCCCC(C)C(=O)O BB58-4619 [0,1,1,0,0,0|1,0,0]=3 59 B8R0.8 NCCCC(N)C(=O)O BB57-0193 [0,1,1,0,0,0|2,0,0]=4 60 B8R0.9 CCC(=O)COC(C)=O BB58-4502 [0,1,1,0,0,0|1,0,1]=4 61 B8R0.1 CCCNC(=O)CC#N BB57-0634 [0,1,1,0,0,0|1,0,1]=4 62 B8R0.1 CCCNC(=O)CNC BB01-4848 [0,1,1,0,0,0|1,0,0]=3 63 B8R0.1 CCCOC(=O)CCO BB58-0822 [0,1,1,0,0,0|1,0,0]=3 64 B8R0.3 CCOC(=O)C(N)CC BB57-6786 [0,1,1,0,0,0|1,0,0]=3 65 B8R0.3 CCOC(=O)C(N)CO BB20-2193 [0,1,1,0,0,0|2,0,0]=4 66 B8R0.3 CCOC(=O)[C@@H](N)CS BB01-6199 [0,1,1,0,0,0|2,0,0]=4 67 B8R1.2 COC1CCNCC1 BB01-8265 [1,1,0,0,0,0|1,0,1]=4 68 B8R1.2 N#CC1CCCCC1 BB58-4600 [1,1,0,0,0,0|0,0,2]=4 69 B8R1.2 NCC1CCNCC1 BB01-6277 [1,1,0,0,0,0|1,0,1]=4 70 B8R1.2 O=CC1CCCCC1 BB01-6149 [1,1,0,0,0,0|0,0,1]=3 71 B8R1.2 OCC1CCCCO1 BB01-4802 [1,1,0,0,0,0|1,0,1]=4 72 B8R1.2 OCC1CCNCC1 BB58-3415 [1,1,0,0,0,0|1,0,1]=4 73 B8R1.2 OCC1CCOCC1 BB55-3597 [1,1,0,0,0,0|1,0,1]=4 74 B8R1.2 OC[C@H]1COCCN1 BB31-4175 [1,1,0,0,0,0|2,0,0]=4 75 B8R1.2 ON=C1CCOCC1 BB55-3583 [1,1,0,0,0,0|1,0,1]=4 76 B8R1.3 CC1CCC(N)CC1 BB55-1073 [1,1,0,0,0,0|0,0,1]=3 77 B8R1.3 CN1CCC(N)CC1 BB55-0029 [1,1,0,0,0,0|1,0,1]=4 78 B8R1.5 CC1SCCNC1=O BB57-3772 [1,1,0,0,0,0|2,0,0]=4 79 B8R1.5 CN1CCCNC1=O BB58-3630 [1,1,0,0,0,0|2,0,0]=4 80 B8R1.5 NC1CCCNC1=O BB01-4609 [1,1,0,0,0,0|1,0,0]=3 81 B8R1.1 CNC1CCN(C)C1 BB58-0097 [0,1,0,0,1,0|2,0,0]=4 82 B8R1.51 NC1CCS(=O)(=O)C1 BB01-4664 [0,1,0,0,1,0|2,0,0]=4 83 B8R1.11 O=C1CCCN1CO BB58-4363 [0,1,0,0,1,0|1,0,0]=3 84 B10R1.2 CNC1CCCC(C)C1C BB01-5286 [0,2,0,0,0,0|1,0,1]=4 85 B10R1.10 CC1CCCN(CCN)C1 BB01-5293 [0,2,0,0,0,0|2,0,0]=4 86 B10R1.113 CC1CCCC(C(=O)O)C1 BB58-4369 [0,2,0,0,0,0|0,0,1]=3 87 B10R1.113 CN1CCC=C(C(=O)O)C1 BB58-4653 [0,2,0,0,0,0|1,0,1]=4 88 B8R1.7 O=C(O)C1CCOC1 BB58-1384 [0,0,1,1,0,0|2,0,0]=4 89 B8R1.8 O=C=NC1CCCC1 BB01-4455 [0,0,1,1,0,0|1,0,1]=4 90 B6R0.3 CC(CN)C(=O)O BB58-0275 [0,0,1,0,1,0|2,0,0]=4 91 B6R0.3 CCC(N)C(=O)O BB55-8838 [0,0,1,0,1,0|2,0,0]=4 92 B6R0.3 CN(C)C(=O)CCl BB20-1610 [0,0,1,0,1,0|2,0,0]=4 93 B6R0.3 COC(=O)C(C)N BB55-6875 [0,0,1,0,1,0|2,0,0]=4 94 B6R0.3 CON(C)C(C)=O BB20-1414 [0,0,1,0,1,0|2,0,0]=4 95 B6R1.2 NC1CCNC1 BB01-6297 [1,0,0,0,1,0|2,0,0]=4 96 B6R1.2 NN1CCCC1 BB58-5312 [1,0,0,0,1,0|2,0,0]=4 97 B6R1.2 O=C1CCSC1 BB01-8335 [1,0,0,0,1,0|1,0,0]=3