0 B8R0.28 O=C(O)CSCC(=O)O BB01-8012 [0,0,0,0,0,0|3,0,1]=4 1 B7R0.4 C=C(C)CCCCC BB58-4377 [1,0,0,0,0,0|2,0,0]=3 2 B7R0.4 CC(=O)CCCCCl BB57-6752 [1,0,0,0,0,0|2,0,0]=3 3 B7R0.4 CC(=O)NCCCBr BB58-5163 [1,0,0,0,0,0|3,0,0]=4 4 B7R0.4 CC(=O)NCCCCl BB58-5165 [1,0,0,0,0,0|3,0,0]=4 5 B7R0.4 CC(C)CCN=C=S BB58-1671 [1,0,0,0,0,0|1,1,1]=4 6 B7R0.4 CC(C)NCCC#N BB01-6620 [1,0,0,0,0,0|2,0,1]=4 7 B7R0.4 CC(C)NCCCN BB01-5385 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.4 CC(C)SCCCN BB01-5320 [1,0,0,0,0,0|2,0,1]=4 9 B7R0.4 CCCCOC(=S)[S-] BB55-6492 [1,0,0,0,0,0|1,2,0]=4 10 B7R0.4 CCOCCC(=O)O BB57-3742 [1,0,0,0,0,0|1,0,0]=2 11 B7R0.4 CNCCCC(=O)O BB58-0143 [1,0,0,0,0,0|1,0,0]=2 12 B9R0.1 CC(C)CCNC(=O)CCl BB53-1230 [0,1,0,0,0,0|2,0,0]=3 13 B9R0.1 CN(C)CCNC(=O)CCl BB20-1607 [0,1,0,0,0,0|3,0,0]=4 14 B9R0.1 COC(=O)CCCC(C)=O BB58-1963 [0,1,0,0,0,0|1,0,1]=3 15 B9R0.7 CC(=O)N(C)CCC(=O)O BB32-3040 [0,1,0,0,0,0|2,0,1]=4 16 B9R0.7 CC(C)C(=O)NCC(=O)O BB58-4050 [0,1,0,0,0,0|1,0,1]=3 17 B9R0.7 CC(C)CNC(=O)C(=O)O BB57-0815 [0,1,0,0,0,0|1,0,1]=3 18 B9R0.7 CC(N)C(=O)NCC(=O)O BB58-5125 [0,1,0,0,0,0|2,0,1]=4 19 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O BB55-8164 [0,1,0,0,0,0|1,0,0]=2 20 B9R0.53 CC(C)CC(N)CC(=O)O BB57-0289 [0,1,0,0,0,0|0,0,0]=1 21 B9R0.56 C[N+](C)(C)NCCC(=O)[O-] BB57-6001 [0,1,0,0,0,0|2,0,1]=4 22 B9R1.35 O=C(O)C1CC(O)CN1 BB57-0232 [0,0,0,1,0,0|2,0,0]=3 23 B9R1.35 O=C1CCC(C(=O)O)C1 BB01-6440 [0,0,0,1,0,0|1,0,1]=3 24 B9R1.66 CC1(C)CC(=O)CCO1 BB53-1741 [0,0,0,1,0,0|2,0,0]=3 25 B7R0.6 CC(=O)CCN(C)C BB55-6125 [0,0,0,0,1,0|2,0,0]=3 26 B7R0.6 CC(=O)NCC(=O)O BB01-2573 [0,0,0,0,1,0|2,0,1]=4 27 B7R0.6 CC(C)OCC(=O)O BB55-5141 [0,0,0,0,1,0|1,0,0]=2 28 B6R0.4 CC(C)CCC=O BB58-4980 [2,0,0,0,0,0|0,0,0]=2 29 B6R0.4 CC(C)NCCN BB57-0247 [2,0,0,0,0,0|2,0,0]=4 30 B6R0.4 CC(C)OCCO BB01-5911 [2,0,0,0,0,0|1,0,0]=3 31 B6R0.4 CCNCC(=O)O BB20-0183 [2,0,0,0,0,0|1,0,0]=3 32 B8R0.6 CCCCCC(=O)NN BB55-0711 [1,1,0,0,0,0|1,0,0]=3 33 B8R0.6 CCCCNC(=O)CCl BB01-5126 [1,1,0,0,0,0|2,0,0]=4 34 B8R0.6 CCCCOC(=O)CCl BB17-2142 [1,1,0,0,0,0|2,0,0]=4 35 B8R0.6 CCCCOC(=O)CN BB01-2500 [1,1,0,0,0,0|2,0,0]=4 36 B8R0.7 CCCCCSC(=N)N BB58-4675 [1,1,0,0,0,0|2,0,0]=4 37 B8R0.7 COCCOCC(=O)O BB57-6814 [1,1,0,0,0,0|1,0,0]=3 38 B8R0.7 NCCCCCC(=O)O BB57-3834 [1,1,0,0,0,0|0,0,0]=2 39 B8R0.8 CCCCC(C)C(=O)O BB58-4619 [1,1,0,0,0,0|0,0,0]=2 40 B8R0.8 CCCNC(=O)C(=O)O BB55-4706 [1,1,0,0,0,0|1,0,1]=4 41 B8R0.8 NCCCC(N)C(=O)O BB57-0193 [1,1,0,0,0,0|1,0,0]=3 42 B8R0.23 CC(C)C(N)CC(=O)O BB01-4066 [0,1,0,0,1,0|0,0,0]=2 43 B8R0.23 CC(C)NC(=O)C(=O)O BB55-4701 [0,1,0,0,1,0|1,0,1]=4 44 B8R0.29 CC(C)CCC(C)(C)O BB57-6758 [0,1,0,0,1,0|1,0,1]=4 45 B8R0.29 O=C(O)CCC(F)(F)F BB55-6264 [0,1,0,0,1,0|2,0,0]=4 46 B10R0.82 CNC(=O)CCC(N)C(=O)O BB58-4683 [0,2,0,0,0,0|1,0,1]=4 47 B10R0.82 COC(=O)CCC(N)C(=O)O BB17-2988 [0,2,0,0,0,0|1,0,1]=4 48 B10R0.82 COC(=O)CCN(C)C(C)C BB58-4806 [0,2,0,0,0,0|1,0,0]=3 49 B10R0.31 C[N+](C)(C)CC(O)CC(=O)O BB57-3820 [0,2,0,0,0,0|1,0,0]=3 50 B8R1.7 O=C(O)C1CC=CC1 BB01-7889 [1,0,0,1,0,0|0,0,2]=4 51 B8R1.7 O=C(O)C1CCOC1 BB58-1384 [1,0,0,1,0,0|1,0,0]=3 52 B8R1.7 O=C(O)C1CSCN1 BB57-0213 [1,0,0,1,0,0|2,0,0]=4 53 B10R1.113 CC1CCCC(C(=O)O)C1 BB58-4369 [0,0,0,1,0,1|0,0,0]=2 54 B10R1.113 CN1CCC=C(C(=O)O)C1 BB58-4653 [0,0,0,1,0,1|1,0,1]=4 55 B10R1.13 CC1CCC(C(=O)O)CC1 BB58-4355 [0,1,0,1,0,0|0,0,0]=2 56 B10R1.31 CCC1NC(C(=O)O)CS1 BB57-4293 [0,1,0,1,0,0|2,0,0]=4 57 B10R1.371 O=C(O)CC1CC(F)(F)C1 BB32-0208 [0,1,0,1,0,0|1,0,0]=3 58 B6R0.2 CC(C)CB(O)O BB01-8323 [0,0,0,0,2,0|1,0,1]=4