0 B5R0.3 CC(CCl)CCl 098443 [0,0,0,0,0,0|2,0,0]=2 1 B5R0.3 CCC(S)CC 105148 [0,0,0,0,0,0|2,0,0]=2 2 B4R0.1 [13CH](=O)N(C)C 105188 [1,0,0,0,0,0|1,0,2]=4 3 B4R0.2 CCN=C=O 386377 [1,0,0,0,0,0|1,0,2]=4 4 B4R0.2 COCC=O 105128 [1,0,0,0,0,0|1,0,2]=4 5 B4R0.2 CSCCBr 472152 [1,0,0,0,0,0|2,0,0]=3 6 B6R0.1 COCC(C)CN 105383 [0,1,0,0,0,0|1,0,0]=2 7 B6R0.3 CCC(C)C(C)N 214338 [0,1,0,0,0,0|1,0,0]=2 8 B6R0.3 CCC(C)S(=O)[O-] 070719 [0,1,0,0,0,0|1,0,1]=3 9 B6R0.3 CCC(N)C(C)C 214340 [0,1,0,0,0,0|2,0,0]=3 10 B6R0.3 CCN(Cl)C(=O)O 105234 [0,1,0,0,0,0|2,0,1]=4 11 B6R0.3 COC(C)C(=O)O 219524 [0,1,0,0,0,0|1,0,1]=3 12 B6R0.8 COC(C)(C)CBr 468927 [0,1,0,0,0,0|2,0,0]=3 13 B6R0.9 CCN(CC)CC 005055 [0,1,0,0,0,0|2,0,0]=3 14 B6R0.9 CCN(CC)CC 105227 [0,1,0,0,0,0|2,0,0]=3 15 B6R1.6 ON=C1CCC1 069003 [0,0,0,1,0,0|1,0,1]=3 16 B6R1.7 OCC1(Br)CC1 105295 [0,0,0,1,0,0|1,0,0]=2 17 B3R0.1 N[13CH2][13CH2]O 105350 [2,0,0,0,0,0|1,0,0]=3 18 B3R0.1 [C-]#[N+]CC 433365 [2,0,0,0,0,0|1,0,1]=4 19 B3R0.2 CC(=O)O 035907 [2,0,0,0,0,0|1,0,1]=4 20 B3R0.2 CC(=O)O 044721 [2,0,0,0,0,0|1,0,1]=4 21 B3R0.2 CC(C)=O 050332 [2,0,0,0,0,0|0,0,2]=4 22 B5R0.1 CNCC(F)F 436159 [1,1,0,0,0,0|2,0,0]=4 23 B5R0.4 CC(C)(C)CBr 403118 [1,1,0,0,0,0|1,0,0]=3 24 B5R0.4 CC(C)(F)C#N 062795 [1,1,0,0,0,0|1,0,1]=4 25 B5R0.4 CC(C)(F)CBr 386871 [1,1,0,0,0,0|1,0,0]=3 26 B5R0.4 CC(C)(F)CO 104410 [1,1,0,0,0,0|0,0,0]=2 27 B5R0.4 CC(C)(N)C#N 030869 [1,1,0,0,0,0|1,0,1]=4 28 B5R0.4 CC(C)(N)C#N 078649 [1,1,0,0,0,0|1,0,1]=4 29 B5R0.4 COC(C)(C)C 044713 [1,1,0,0,0,0|1,0,0]=3 30 B5R0.4 COC(C)(C)C 106403 [1,1,0,0,0,0|1,0,0]=3 31 B5R0.2 CCOCC#N 104806 [1,1,0,0,0,0|1,0,1]=4 32 B5R0.2 CSCCC#N 371092 [1,1,0,0,0,0|1,0,1]=4 33 B7R0.2 C=CC(C)CC(=O)O 229282 [0,2,0,0,0,0|0,0,2]=4 34 B7R0.3 CCC(C)CN=C=O 097761 [0,2,0,0,0,0|0,0,1]=3 35 B7R0.5 CCCC(N)C(C)C 214316 [0,2,0,0,0,0|2,0,0]=4 36 B7R0.10 COC(=O)C(C)CBr 104870 [0,2,0,0,0,0|1,0,1]=4 37 B7R0.11 C=CC(C)(C)CCBr 105163 [0,2,0,0,0,0|1,0,1]=4 38 B7R0.11 CC(C)(CO)CCBr 105090 [0,2,0,0,0,0|0,0,0]=2 39 B7R0.11 CCOC(C)(C)CN 214334 [0,2,0,0,0,0|1,0,0]=3 40 B7R0.12 CCC(COC)OC 105044 [0,2,0,0,0,0|0,0,0]=2 41 B7R0.18 CCC(C)(CN)OC 214328 [0,2,0,0,0,0|1,0,0]=3 42 B5R1.1 C1CCOC1 046883 [1,0,0,1,0,0|0,0,0]=2 43 B5R1.1 C1CCOC1 046883 [1,0,0,1,0,0|0,0,0]=2 44 B5R1.1 C1CCOC1 106169 [1,0,0,1,0,0|0,0,0]=2 45 B7R1.6 NNCC1CCC1 070613 [0,1,0,1,0,0|1,0,0]=3