0 B3R0.1 C#CC=O BCP06452 [0,0,0,0,0,0|0,0,2]=2 1 B3R0.1 C=CC=O BCP07056 [0,0,0,0,0,0|0,0,0]=0 2 B3R0.1 CCCN BCP18818 [0,0,0,0,0,0|1,0,3]=4 3 B3R0.1 COCCl BCP08223 [0,0,0,0,0,0|2,0,2]=4 4 B3R0.1 NCCS BCP15015 [0,0,0,0,0,0|1,1,2]=4 5 B3R0.1 NCCS BCP15033 [0,0,0,0,0,0|1,1,2]=4 6 B3R0.1 [*]=[N+]=N[Na] BCP05568 [0,0,0,0,0,0|4,0,0]=4 7 B2R0.1 CC#N BCP16195 [1,0,0,0,0,0|1,0,2]=4 8 B2R0.1 CNC BCP26000 [1,0,0,0,0,0|1,0,2]=4 9 B2R0.1 CNN BCP07836 [1,0,0,0,0,0|2,0,1]=4 10 B2R0.1 CSC BCP12489 [1,0,0,0,0,0|1,0,2]=4 11 B2R0.1 Cl[Pt]Cl BCP01792 [1,0,0,0,0,0|3,0,0]=4 12 B2R0.1 Cl[Pt]Cl BCP18182 [1,0,0,0,0,0|3,0,0]=4 13 B2R0.1 Cl[Sr]Cl BCP28245 [1,0,0,0,0,0|3,0,0]=4 14 B2R0.1 FCBr BCP07051 [1,0,0,0,0,0|2,0,1]=4 15 B4R0.1 C#CC(N)=O BCP15743 [0,1,0,0,0,0|0,0,2]=3 16 B4R0.1 C=CC(Cl)=O BCP06212 [0,1,0,0,0,0|0,0,0]=1 17 B4R0.1 CC(CBr)=O BCP06577 [0,1,0,0,0,0|1,0,1]=3 18 B4R0.1 NC(C=C)=O BCP25183 [0,1,0,0,0,0|0,0,0]=1 19 B4R0.1 NC(CN)=N BCP12671 [0,1,0,0,0,0|2,0,1]=4 20 B4R0.1 O=C(O)CCl BCP20585 [0,1,0,0,0,0|1,0,1]=3 21 B4R0.1 O=CC(O)=O BCP15407 [0,1,0,0,0,0|1,0,0]=2 22 B4R0.1 OC(C#C)=O BCP18740 [0,1,0,0,0,0|0,0,2]=3 23 B4R0.2 C=CCON BCP19009 [0,1,0,0,0,0|0,0,2]=3 24 B4R0.2 O=[Cr]O[Cr]=O BCP04300 [0,1,0,0,0,0|3,0,0]=4 25 B1R0.1 BrC BCP14546 [2,0,0,0,0,0|1,0,1]=4 26 B1R0.1 C[*] BCP08894 [2,0,0,0,0,0|1,0,1]=4 27 B1R0.1 C[*] BCP10590 [2,0,0,0,0,0|1,0,1]=4 28 B1R0.1 NO BCP03655 [2,0,0,0,0,0|1,0,1]=4 29 B1R0.1 NO BCP29537 [2,0,0,0,0,0|1,0,1]=4 30 B1R0.1 [Al]#P BCP11872 [2,0,0,0,0,0|2,0,0]=4 31 B3R0.2 C=C(Br)F BCP15164 [1,1,0,0,0,0|1,0,0]=3 32 B3R0.2 CC(O)=O BCP05544 [1,1,0,0,0,0|0,0,1]=3 33 B3R0.2 NC(N)=N BCP04785 [1,1,0,0,0,0|2,0,0]=4 34 B3R0.2 OC(O)=O BCP14602 [1,1,0,0,0,0|1,0,0]=3 35 B3R0.2 [O-]C(=O)C BCP05504 [1,1,0,0,0,0|0,0,1]=3 36 B5R0.1 CC(OCCl)=O BCP16170 [0,2,0,0,0,0|1,0,1]=4 37 B5R0.1 O=C(Cl)CCBr BCP20557 [0,2,0,0,0,0|0,0,2]=4 38 B5R0.1 O=C(Cl)CCCl BCP09962 [0,2,0,0,0,0|0,0,2]=4 39 B5R0.1 OC(CCO)=O BCP05902 [0,2,0,0,0,0|0,0,2]=4 40 B5R0.1 OC(CCS)=O BCP16636 [0,2,0,0,0,0|0,0,2]=4 41 B5R0.3 O=C(CBr)CC BCP08723 [0,2,0,0,0,0|0,0,2]=4 42 B5R0.3 O=C(NC)CBr BCP13174 [0,2,0,0,0,0|1,0,1]=4 43 B5R0.3 O=C(OC)CBr BCP06456 [0,2,0,0,0,0|1,0,1]=4 44 B5R0.5 C=C(Cl)C(O)=O BCP13841 [0,2,0,0,0,0|0,0,0]=2 45 B5R0.5 C[C@@H](Cl)C(O)=O BCP14313 [0,2,0,0,0,0|0,0,2]=4 46 B5R0.5 C[C](Cl)C(O)=O BCP11281 [0,2,0,0,0,0|0,0,2]=4 47 B5R0.5 O=C(C)C([O-])=O BCP13503 [0,2,0,0,0,0|0,0,1]=3 48 B5R0.2 C=CCCC=C BCP08456 [0,2,0,0,0,0|1,0,0]=3 49 B5R0.2 O=CCCC=O BCP20105 [0,2,0,0,0,0|0,0,1]=3 50 B5R1.2 O=C1CCO1 BCP07366 [0,1,0,1,0,0|0,0,2]=4 51 B5R1.2 O=C1CNC1 BCP10186 [0,1,0,1,0,0|0,0,2]=4 52 B5R1.2 O=C1COC1 BCP05482 [0,1,0,1,0,0|0,0,2]=4 53 B5R1.2 O=C1O[Mg]O1 BCP17142 [0,1,0,1,0,0|2,0,0]=4 54 B5R1.1 C1=CCNC1 BCP09734 [0,1,0,1,0,0|1,0,1]=4 55 B5R1.1 C1=NNC=N1 BCP20885 [0,1,0,1,0,0|2,0,0]=4 56 B5R1.1 N1N=NC=C1 BCP18903 [0,1,0,1,0,0|2,0,0]=4 57 B5R1.1 S1N=CC=C1 BCP05147 [0,1,0,1,0,0|0,1,0]=3