0 B4R0.1 C#CC(=O)N PI-48352 [0,0,0,0,0,0|3,0,1]=4 1 B4R0.1 C(=C(F)Cl)Cl PI-21037 [0,0,0,0,0,0|0,1,0]=1 2 B4R0.1 C(=C(F)Cl)F PI-20042 [0,0,0,0,0,0|0,2,0]=2 3 B4R0.1 C(=O)(N)NO PI-15345 [0,0,0,0,0,0|4,0,0]=4 4 B4R0.1 C(C(=N)N)N PI-44870 [0,0,0,0,0,0|3,0,1]=4 5 B4R0.1 C(C(=O)Cl)Br PI-46514 [0,0,0,0,0,0|1,1,1]=3 6 B4R0.1 C(C(=O)N)I PI-47045 [0,0,0,0,0,0|2,1,1]=4 7 B4R0.1 C(C(=O)N)N PI-14271 [0,0,0,0,0,0|3,0,1]=4 8 B4R0.1 C(C(=O)[O-])Cl PI-44622 [0,0,0,0,0,0|2,0,1]=3 9 B4R0.1 C=C(CBr)Br PI-10979 [0,0,0,0,0,0|1,2,1]=4 10 B4R0.1 CC(=C)CBr PI-46510 [0,0,0,0,0,0|2,1,1]=4 11 B4R0.1 CC(=CBr)C PI-46509 [0,0,0,0,0,0|2,1,0]=3 12 B4R0.1 CC(=O)C#C PI-15653 [0,0,0,0,0,0|3,0,1]=4 13 B4R0.1 CC(=O)CBr PI-38994 [0,0,0,0,0,0|2,1,1]=4 14 B4R0.1 CC(=O)NBr PI-47108 [0,0,0,0,0,0|3,1,0]=4 15 B4R0.1 CC(O)=NO PI-10772 [0,0,0,0,0,0|4,0,0]=4 16 B4R0.1 CCC(=N)N PI-35437 [0,0,0,0,0,0|3,0,1]=4 17 B4R0.1 CN=C(N)N PI-12937 [0,0,0,0,0,0|4,0,0]=4 18 B4R0.1 COC(=N)N PI-30686 [0,0,0,0,0,0|4,0,0]=4 19 B4R0.1 ClCC(Cl)=C PI-15434 [0,0,0,0,0,0|1,0,1]=2 20 B4R0.1 NC(=N)CCl PI-30038 [0,0,0,0,0,0|2,0,1]=3 21 B4R0.1 NC(=O)CBr PI-10963 [0,0,0,0,0,0|2,1,1]=4 22 B3R0.1 C(=CBr)Br PI-47053 [1,0,0,0,0,0|0,2,0]=3 23 B3R0.1 C(=CCl)F PI-20089 [1,0,0,0,0,0|0,1,0]=2 24 B3R0.1 C(CBr)Cl PI-44621 [1,0,0,0,0,0|0,1,2]=4 25 B3R0.1 CCC=O PI-28552 [1,0,0,0,0,0|2,0,1]=4 26 B3R0.1 C\C=N\O PI-37002 [1,0,0,0,0,0|3,0,0]=4 27 B3R0.1 NNC=O PI-38803 [1,0,0,0,0,0|3,0,0]=4 28 B3R0.2 C(=N)(N)N PI-46905 [1,0,0,0,0,0|3,0,0]=4 29 B3R0.2 C(Cl)(Br)Br PI-23709 [1,0,0,0,0,0|0,2,1]=4 30 B3R0.2 C=C(F)Br PI-14442 [1,0,0,0,0,0|0,2,0]=3 31 B3R0.2 CC(=O)O PI-11632 [1,0,0,0,0,0|2,0,1]=4 32 B3R0.2 CC(=O)O PI-38547 [1,0,0,0,0,0|2,0,1]=4 33 B3R0.2 CC(=O)[O-] PI-20290 [1,0,0,0,0,0|2,0,1]=4 34 B3R0.2 CC(=S)N PI-16528 [1,0,0,0,0,0|2,0,1]=4 35 B3R0.2 CC([O-])=S PI-36444 [1,0,0,0,0,0|2,0,1]=4 36 B3R0.2 NC(=N)Cl PI-38973 [1,0,0,0,0,0|2,0,0]=3 37 B3R0.2 NC(N)=N PI-47789 [1,0,0,0,0,0|3,0,0]=4 38 B3R0.2 NC(N)=N PI-47790 [1,0,0,0,0,0|3,0,0]=4 39 B3R0.2 [O-]C(=O)C PI-37083 [1,0,0,0,0,0|2,0,1]=4 40 B3R0.2 [O-]C(=O)C PI-41421 [1,0,0,0,0,0|2,0,1]=4 41 B5R0.1 BrCC=C(C)C PI-12725 [0,1,0,0,0,0|2,1,0]=4 42 B5R0.1 C(CBr)C(=O)Cl PI-47061 [0,1,0,0,0,0|1,1,1]=4 43 B5R0.1 C(CCl)C(=O)Cl PI-48842 [0,1,0,0,0,0|1,0,1]=3 44 B5R0.1 CC=CC(=O)C PI-45740 [0,1,0,0,0,0|3,0,0]=4 45 B5R0.1 CCSC(=O)Cl PI-38596 [0,1,0,0,0,0|2,0,1]=4 46 B5R0.1 C\C=C\C(=O)N PI-50568 [0,1,0,0,0,0|3,0,0]=4 47 B5R0.1 C\C=C\C(=O)O PI-48966 [0,1,0,0,0,0|3,0,0]=4 48 B5R0.3 C(=O)C(C=O)Cl PI-39590 [0,1,0,0,0,0|2,0,1]=4 49 B5R0.3 CCC(=C)C=O PI-44654 [0,1,0,0,0,0|3,0,0]=4 50 B5R0.3 CNC(=O)CCl PI-39443 [0,1,0,0,0,0|2,0,1]=4 51 B5R0.3 ClCC(=C)CCl PI-41237 [0,1,0,0,0,0|1,0,1]=3 52 B5R0.4 CC(CCl)(F)Cl PI-21038 [0,1,0,0,0,0|0,1,2]=4 53 B5R0.4 C[Si](C)(C=C)Cl PI-45014 [0,1,0,0,0,0|2,1,0]=4 54 B5R0.4 C[Si](C)(CCl)Cl PI-24149 [0,1,0,0,0,0|1,1,1]=4 55 B5R0.5 C(C(=O)Cl)(F)F PI-48696 [0,1,0,0,0,0|0,2,1]=4 56 B5R0.5 CC(=C)C(=O)C PI-41913 [0,1,0,0,0,0|3,0,0]=4 57 B5R0.5 CC(=O)C(=O)[O-] PI-15478 [0,1,0,0,0,0|3,0,0]=4 58 B5R0.5 CC(=O)C(=O)[O-] PI-15479 [0,1,0,0,0,0|3,0,0]=4 59 B5R0.5 CC(=O)C(=O)[O-] PI-15480 [0,1,0,0,0,0|3,0,0]=4 60 B5R0.5 CC(=O)C(=O)[O-] PI-15481 [0,1,0,0,0,0|3,0,0]=4 61 B5R0.5 CC(C(=O)Cl)Cl PI-45764 [0,1,0,0,0,0|1,0,1]=3 62 B5R0.5 CC(C(=O)Cl)Cl PI-45765 [0,1,0,0,0,0|1,0,1]=3 63 B5R0.5 CC(C(=O)Cl)Cl PI-49052 [0,1,0,0,0,0|1,0,1]=3 64 B5R0.5 CC(C(=O)O)Cl PI-28351 [0,1,0,0,0,0|2,0,1]=4 65 B5R0.5 C[N+](=C(Cl)Cl)C PI-30496 [0,1,0,0,0,0|2,0,0]=3 66 B5R0.5 ClC(C(=O)[O-])Cl PI-39489 [0,1,0,0,0,0|1,0,1]=3 67 B5R0.5 FC(C(Cl)F)Cl PI-21026 [0,1,0,0,0,0|0,1,2]=4 68 B5R0.5 NC(=S)C(=S)N PI-18908 [0,1,0,0,0,0|3,0,0]=4 69 B5R0.5 OC(=O)C(=O)C PI-15477 [0,1,0,0,0,0|3,0,0]=4 70 B2R0.1 Cl[Pt]Cl PI-35163 [2,0,0,0,0,0|1,0,0]=3 71 B2R0.1 NC=N PI-38823 [2,0,0,0,0,0|2,0,0]=4 72 B4R0.2 C(=O)[N-]C=O PI-42986 [1,1,0,0,0,0|2,0,0]=4 73 B4R0.2 CC=CCO PI-41583 [1,1,0,0,0,0|2,0,0]=4 74 B4R0.3 Cl[Au-](Cl)(Cl)Cl PI-39381 [1,1,0,0,0,0|1,0,0]=3 75 B6R0.2 CC(=CC(=O)Cl)C PI-13707 [0,2,0,0,0,0|2,0,0]=4 76 B6R0.2 CC(OC(=O)Cl)Cl PI-22740 [0,2,0,0,0,0|1,0,1]=4 77 B6R0.5 C(CCl)C(Cl)(Cl)Cl PI-48575 [0,2,0,0,0,0|0,0,2]=4 78 B6R0.7 C(=O)(C(Cl)(Cl)Cl)Cl PI-48701 [0,2,0,0,0,0|0,0,1]=3 79 B6R0.7 C(=O)(C(F)(F)Cl)Cl PI-20027 [0,2,0,0,0,0|0,1,1]=4 80 B6R0.7 C(C(F)(F)Cl)(Cl)Cl PI-48702 [0,2,0,0,0,0|0,0,2]=4 81 B6R1.2 C1=C(C=NN1)Cl PI-33036 [0,1,0,1,0,0|2,0,0]=4 82 B6R1.2 C1=NNC(=N1)Cl PI-13235 [0,1,0,1,0,0|2,0,0]=4 83 B6R1.2 ClC1=CSC=C1 PI-11160 [0,1,0,1,0,0|2,0,0]=4 84 B6R1.2 ClC1=NC=NS1 PI-31535 [0,1,0,1,0,0|2,0,0]=4 85 B6R1.2 Clc1ncc[nH]1 PI-20136 [0,1,0,1,0,0|2,0,0]=4 86 B6R1.2 Clc1nccs1 PI-39297 [0,1,0,1,0,0|2,0,0]=4