0 B5R0.1 C=COC(=O)Cl 101273 [0,0,0,0,0,0|2,0,2]=4 1 B5R0.1 CCCS(=O)[O-] 035598 [0,0,0,0,0,0|2,0,0]=2 2 B5R0.1 NC(=O)NCO 101312 [0,0,0,0,0,0|2,0,0]=2 3 B5R0.1 NC(=O)\C=C\Cl 180013 [0,0,0,0,0,0|1,0,2]=3 4 B5R0.1 O=C(O)\C=C\Cl 180014 [0,0,0,0,0,0|2,0,2]=4 5 B4R0.1 [2H]OC([2H])=O 102711 [1,0,0,0,0,0|3,0,0]=4 6 B4R0.2 C=CCC=C 102032 [1,0,0,0,0,0|1,0,2]=4 7 B4R0.2 CC[Zn]CC 105051 [1,0,0,0,0,0|2,0,1]=4 8 B6R0.1 CNC(=O)CCCl 310786 [0,1,0,0,0,0|1,0,0]=2 9 B6R0.3 C=CC(C)C(=O)O 103612 [0,1,0,0,0,0|1,0,2]=4 10 B6R0.3 O=C(O)C(=O)CF 104062 [0,1,0,0,0,0|2,0,1]=4 11 B6R0.4 CCCCS(=O)[O-] 044582 [0,1,0,0,0,0|2,0,0]=3 12 B6R0.4 COCNC(N)=O 101307 [0,1,0,0,0,0|1,0,0]=2 13 B6R0.4 NCCCC(N)=O 373559 [0,1,0,0,0,0|0,0,0]=1 14 B6R0.5 COCC(C)(C)N 044036 [0,1,0,0,0,0|2,0,1]=4 15 B6R0.5 O=P(O)(O)CCCl 104639 [0,1,0,0,0,0|3,0,0]=4 16 B6R1.2 CC1CCCO1 105578 [0,0,0,1,0,0|1,0,2]=4 17 B6R1.2 O=C1OCCO1 075946 [0,0,0,1,0,0|2,0,0]=3 18 B3R0.1 C#CCC 009072 [2,0,0,0,0,0|0,0,2]=4 19 B3R0.1 C=CC=O 103755 [2,0,0,0,0,0|0,0,2]=4 20 B3R0.1 O=CCBr 105198 [2,0,0,0,0,0|1,0,0]=3 21 B5R0.5 C[C@H](N)C(N)=O 094668 [1,1,0,0,0,0|0,0,0]=2 22 B5R0.2 C#CCCCBr 099558 [1,1,0,0,0,0|1,0,1]=4 23 B5R0.2 C=CCCCCl 097807 [1,1,0,0,0,0|1,0,0]=3 24 B5R0.2 CC\C=C\CBr 104983 [1,1,0,0,0,0|1,0,1]=4 25 B7R0.2 CNC(=O)CC(C)C 103448 [0,2,0,0,0,0|0,0,0]=2 26 B7R0.3 CCCCC(N)CC 214311 [0,2,0,0,0,0|1,0,1]=4 27 B7R0.3 CNC(=O)CCOC 091206 [0,2,0,0,0,0|0,0,0]=2 28 B7R0.3 COCC\C(N)=N\O 370225 [0,2,0,0,0,0|0,0,1]=3 29 B7R0.7 CCCC(C)N=C=O 097755 [0,2,0,0,0,0|1,0,1]=4 30 B7R0.16 CC(C)C(Br)C(=O)Cl 477377 [0,2,0,0,0,0|1,0,0]=3 31 B7R0.16 CC(C)[C@@H](Br)C(=O)O 209858 [0,2,0,0,0,0|1,0,0]=3 32 B7R0.13 CC(C)(CBr)C(=O)Cl 102665 [0,2,0,0,0,0|2,0,0]=4 33 B7R0.13 CC[C@@](C)(N)C(=O)O 048166 [0,2,0,0,0,0|1,0,0]=3 34 B7R0.4 CCCCN[N+](=O)[O-] 180041 [0,2,0,0,0,0|2,0,0]=4 35 B7R0.4 CCCCOC(C)=O 101599 [0,2,0,0,0,0|1,0,0]=3 36 B7R0.4 COCCCC(=O)O 234024 [0,2,0,0,0,0|1,0,0]=3 37 B7R0.8 CNCCS(=O)(=O)O 375127 [0,2,0,0,0,0|2,0,0]=4 38 B5R1.1 C1CCNC1 106070 [1,0,0,1,0,0|0,0,1]=3 39 B5R1.1 C1CCOC1 102404 [1,0,0,1,0,0|0,0,2]=4 40 B7R1.1 CNC1=[NH+]CCN1 181170 [0,1,0,1,0,0|2,0,0]=4 41 B7R1.2 CC1COC(=O)O1 102084 [0,1,0,1,0,0|1,0,0]=3 42 B7R1.3 C[C@@H]1CCCCN1 044539 [0,1,0,1,0,0|1,0,1]=4 43 B7R1.4 CN1CCCC1=O 105571 [0,1,0,1,0,0|0,0,0]=2 44 B7R1.12 O=C(O)[C@H]1C[C@@H]1F 037362 [0,1,0,1,0,0|1,0,0]=3 45 B7R1.20 N=C(N)NC1CC1 311609 [0,1,0,1,0,0|1,0,0]=3