0 B4R0.1 CNN(C)C 062215 [0,0,0,0,0,0|4,0,0]=4 1 B4R0.1 [2H]OC([2H])=O 102711 [0,0,0,0,0,0|3,0,0]=3 2 B3R0.1 C#CCC 009072 [1,0,0,0,0,0|1,0,1]=3 3 B3R0.1 C=CC=O 103755 [1,0,0,0,0,0|0,0,2]=3 4 B3R0.1 CNNC 371949 [1,0,0,0,0,0|3,0,0]=4 5 B3R0.1 O=CCBr 105198 [1,0,0,0,0,0|1,0,0]=2 6 B3R0.2 C[AlH3](C)C 098855 [1,0,0,0,0,0|3,0,0]=4 7 B3R0.2 O=[N+]([O-])O 102497 [1,0,0,0,0,0|2,0,0]=3 8 B3R0.2 O=[N+]([O-])[O-] 195368 [1,0,0,0,0,0|2,0,1]=4 9 B3R0.2 S=C([S-])[S-] 099620 [1,0,0,0,0,0|1,2,0]=4 10 B5R0.1 C=COC(=O)Cl 101273 [0,1,0,0,0,0|1,0,2]=4 11 B5R0.1 CCCS(=O)[O-] 035598 [0,1,0,0,0,0|1,0,1]=3 12 B5R0.1 NC(=O)NCO 101312 [0,1,0,0,0,0|2,0,0]=3 13 B5R0.1 NC(=O)\C=C\Cl 180013 [0,1,0,0,0,0|1,0,2]=4 14 B5R0.1 O=C(O)\C=C\Cl 180014 [0,1,0,0,0,0|0,0,2]=3 15 B5R0.5 C[C@H](N)C(N)=O 094668 [0,1,0,0,0,0|1,0,0]=2 16 B2R0.1 C[Zn]Cl 102551 [2,0,0,0,0,0|2,0,0]=4 17 B2R0.1 ClCCl 102413 [2,0,0,0,0,0|2,0,0]=4 18 B2R0.1 O=S=O 099645 [2,0,0,0,0,0|1,0,1]=4 19 B2R0.1 [C-]#[N+]C 477126 [2,0,0,0,0,0|1,0,1]=4 20 B4R0.2 C=CCC=C 102032 [1,1,0,0,0,0|1,0,1]=4 21 B4R0.2 CC[Zn]CC 105051 [1,1,0,0,0,0|1,0,1]=4 22 B4R0.3 OCl(=O)(=O)=O 181798 [1,1,0,0,0,0|2,0,0]=4 23 B6R0.1 CNC(=O)CCCl 310786 [0,2,0,0,0,0|1,0,0]=3 24 B6R0.3 C=CC(C)C(=O)O 103612 [0,2,0,0,0,0|0,0,0]=2 25 B6R0.3 COC(=O)[C@@H](C)Br 097700 [0,2,0,0,0,0|0,0,0]=2 26 B6R0.3 O=C(O)C(=O)CF 104062 [0,2,0,0,0,0|0,0,1]=3 27 B6R0.4 CCCCS(=O)[O-] 044582 [0,2,0,0,0,0|1,0,1]=4 28 B6R0.4 COCNC(N)=O 101307 [0,2,0,0,0,0|1,0,0]=3 29 B6R0.4 NCCCC(N)=O 373559 [0,2,0,0,0,0|1,0,0]=3 30 B6R0.5 O=P(O)(O)CCCl 104639 [0,2,0,0,0,0|1,0,0]=3 31 B6R0.7 CC(C)(Br)C(=O)Cl 102664 [0,2,0,0,0,0|1,0,0]=3 32 B6R0.7 CC(F)(Br)C(=O)O 075681 [0,2,0,0,0,0|0,0,0]=2 33 B6R0.7 O=C(O)C(F)(F)F 001271 [0,2,0,0,0,0|1,0,0]=3 34 B6R0.7 O=C(O)C(F)(F)F 001271 [0,2,0,0,0,0|1,0,0]=3 35 B6R0.7 O=C(O)C(F)(F)F 001271 [0,2,0,0,0,0|1,0,0]=3 36 B6R1.2 BrC1CCOC1 079615 [0,1,0,1,0,0|1,0,1]=4 37 B6R1.2 CC1CCCO1 105578 [0,1,0,1,0,0|1,0,1]=4 38 B6R1.2 O=C1OCCO1 075946 [0,1,0,1,0,0|0,0,0]=2