0 B3R0.2 C(=N)(N)N PI-46905 [0,0,0,0,0,0|3,0,1]=4 1 B3R0.2 C(Cl)(Br)Br PI-23709 [0,0,0,0,0,0|0,2,0]=2 2 B3R0.2 C=C(F)Br PI-14442 [0,0,0,0,0,0|1,2,1]=4 3 B3R0.2 CB(O)O PI-24088 [0,0,0,0,0,0|4,0,0]=4 4 B3R0.2 CC(=O)O PI-11632 [0,0,0,0,0,0|3,0,1]=4 5 B3R0.2 CC(=O)O PI-38547 [0,0,0,0,0,0|3,0,1]=4 6 B3R0.2 CC(=O)[O-] PI-20290 [0,0,0,0,0,0|3,0,1]=4 7 B3R0.2 CC(=S)N PI-16528 [0,0,0,0,0,0|3,0,1]=4 8 B3R0.2 CC(C)[O-] PI-47044 [0,0,0,0,0,0|3,0,0]=3 9 B3R0.2 CC([O-])=S PI-36444 [0,0,0,0,0,0|3,0,1]=4 10 B3R0.2 C[S+](C)C PI-41785 [0,0,0,0,0,0|4,0,0]=4 11 B3R0.2 NC(=N)Cl PI-38973 [0,0,0,0,0,0|2,0,1]=3 12 B3R0.2 NC(N)=N PI-47789 [0,0,0,0,0,0|3,0,1]=4 13 B3R0.2 NC(N)=N PI-47790 [0,0,0,0,0,0|3,0,1]=4 14 B3R0.2 [O-]C(=O)C PI-37083 [0,0,0,0,0,0|3,0,1]=4 15 B3R0.2 [O-]C(=O)C PI-41421 [0,0,0,0,0,0|3,0,1]=4 16 B2R0.1 C(F)I PI-46452 [1,0,0,0,0,0|0,2,0]=3 17 B2R0.1 CNO PI-24407 [1,0,0,0,0,0|3,0,0]=4 18 B2R0.1 CON PI-12344 [1,0,0,0,0,0|3,0,0]=4 19 B2R0.1 CSC PI-50002 [1,0,0,0,0,0|3,0,0]=4 20 B2R0.1 Cl[Pt]Cl PI-35163 [1,0,0,0,0,0|1,0,0]=2 21 B2R0.1 NC=N PI-38823 [1,0,0,0,0,0|2,0,1]=4 22 B2R0.1 O=[Os]=O PI-41580 [1,0,0,0,0,0|3,0,0]=4 23 B2R0.1 ON=O PI-38467 [1,0,0,0,0,0|3,0,0]=4 24 B2R0.1 S=[W]=S PI-48964 [1,0,0,0,0,0|3,0,0]=4 25 B2R0.1 [B](Br)Br PI-49994 [1,0,0,0,0,0|1,2,0]=4 26 B4R0.1 C(=C(F)Cl)Cl PI-21037 [0,1,0,0,0,0|0,1,1]=3 27 B4R0.1 C(=C(F)Cl)F PI-20042 [0,1,0,0,0,0|0,2,1]=4 28 B4R0.1 C(C(=O)Cl)Br PI-46514 [0,1,0,0,0,0|1,1,1]=4 29 B4R0.1 C(C(=O)[O-])Cl PI-44622 [0,1,0,0,0,0|2,0,1]=4 30 B4R0.1 C(C(F)F)N PI-48941 [0,1,0,0,0,0|1,2,0]=4 31 B4R0.1 CC(C#C)O PI-44141 [0,1,0,0,0,0|3,0,0]=4 32 B4R0.1 CC(C)CN PI-46903 [0,1,0,0,0,0|3,0,0]=4 33 B4R0.1 CC(C)NC PI-41120 [0,1,0,0,0,0|3,0,0]=4 34 B4R0.1 CC(CN)O PI-16659 [0,1,0,0,0,0|3,0,0]=4 35 B4R0.1 CC(CO)O PI-16674 [0,1,0,0,0,0|3,0,0]=4 36 B4R0.1 CC(O)C#C PI-43256 [0,1,0,0,0,0|3,0,0]=4 37 B4R0.1 CCC(C)O PI-15619 [0,1,0,0,0,0|3,0,0]=4 38 B4R0.1 C[C@@H](CO)N PI-12236 [0,1,0,0,0,0|3,0,0]=4 39 B4R0.1 C[C@@H](N)CO PI-16472 [0,1,0,0,0,0|3,0,0]=4 40 B4R0.1 C[C@@H](O)CN PI-12234 [0,1,0,0,0,0|3,0,0]=4 41 B4R0.1 ClCC(Cl)=C PI-15434 [0,1,0,0,0,0|1,0,1]=3 42 B4R0.1 NC(=N)CCl PI-30038 [0,1,0,0,0,0|2,0,1]=4 43 B4R0.1 NC[C@@H](N)C PI-39121 [0,1,0,0,0,0|3,0,0]=4 44 B4R0.1 NNC(C)C PI-37110 [0,1,0,0,0,0|3,0,0]=4 45 B4R0.1 OCC(F)F PI-21165 [0,1,0,0,0,0|1,2,0]=4 46 B4R0.1 OC[C@H](O)C PI-16673 [0,1,0,0,0,0|3,0,0]=4 47 B4R0.3 C(F)(F)(F)[S-] PI-48897 [0,1,0,0,0,0|0,3,0]=4 48 B4R0.3 C(F)(F)(F)[S-] PI-48899 [0,1,0,0,0,0|0,3,0]=4 49 B4R0.3 CC(C)(C)N PI-49998 [0,1,0,0,0,0|3,0,0]=4 50 B4R0.3 CC(C)(F)F PI-21237 [0,1,0,0,0,0|1,2,0]=4 51 B4R0.3 C[Si](C)(C)Cl PI-44933 [0,1,0,0,0,0|2,1,0]=4 52 B4R0.3 Cl[Au-](Cl)(Cl)Cl PI-39381 [0,1,0,0,0,0|1,0,0]=2 53 B4R0.3 FC(I)(F)F PI-40186 [0,1,0,0,0,0|0,3,0]=4 54 B4R0.3 NS(=O)(=O)Cl PI-36528 [0,1,0,0,0,0|3,0,0]=4 55 B4R1.2 C1CC1Br PI-20927 [0,0,0,1,0,0|2,1,0]=4 56 B4R1.2 C[C@@H]1CO1 PI-10840 [0,0,0,1,0,0|3,0,0]=4 57 B4R1.2 C[C@H]1CO1 PI-10843 [0,0,0,1,0,0|3,0,0]=4 58 B4R1.2 NC1CC1 PI-10868 [0,0,0,1,0,0|3,0,0]=4 59 B1R0.1 CC PI-12250 [2,0,0,0,0,0|1,0,0]=3 60 B3R0.1 BrCC#N PI-20513 [1,1,0,0,0,0|1,1,0]=4 61 B3R0.1 C(=CCl)F PI-20089 [1,1,0,0,0,0|0,1,1]=4 62 B3R0.1 C(CBr)Cl PI-44621 [1,1,0,0,0,0|0,1,0]=3 63 B3R0.1 C(CF)F PI-21164 [1,1,0,0,0,0|0,2,0]=4 64 B3R0.1 C(CS)N PI-39848 [1,1,0,0,0,0|2,0,0]=4 65 B3R0.1 C(F)CN PI-41615 [1,1,0,0,0,0|1,1,0]=4 66 B3R0.1 CCC=O PI-28552 [1,1,0,0,0,0|2,0,0]=4 67 B3R0.1 CCCN PI-46904 [1,1,0,0,0,0|2,0,0]=4 68 B3R0.1 CCCN PI-46913 [1,1,0,0,0,0|2,0,0]=4 69 B3R0.1 CNCC PI-40147 [1,1,0,0,0,0|2,0,0]=4 70 B3R0.1 COCBr PI-22152 [1,1,0,0,0,0|1,1,0]=4 71 B3R0.1 NCC#C PI-38458 [1,1,0,0,0,0|2,0,0]=4 72 B3R0.1 NCC#N PI-38793 [1,1,0,0,0,0|2,0,0]=4 73 B3R0.1 NCCN PI-38127 [1,1,0,0,0,0|2,0,0]=4 74 B3R0.1 NCCN PI-38389 [1,1,0,0,0,0|2,0,0]=4 75 B3R0.1 OCCBr PI-37291 [1,1,0,0,0,0|1,1,0]=4 76 B3R0.1 [CH2-]CCC PI-37346 [1,1,0,0,0,0|2,0,0]=4 77 B5R0.1 C(CCl)C(=O)Cl PI-48842 [0,2,0,0,0,0|1,0,1]=4 78 B5R0.3 C(=O)C(C=O)Cl PI-39590 [0,2,0,0,0,0|2,0,0]=4 79 B5R0.3 C(C(CCl)O)F PI-20093 [0,2,0,0,0,0|1,1,0]=4 80 B5R0.3 C(C(CCl)O)O PI-16668 [0,2,0,0,0,0|2,0,0]=4 81 B5R0.3 C([C@@H](CCl)O)N PI-48662 [0,2,0,0,0,0|2,0,0]=4 82 B5R0.3 ClCC(=C)CCl PI-41237 [0,2,0,0,0,0|1,0,1]=4 83 B5R0.3 OC[C@H](O)CCl PI-16667 [0,2,0,0,0,0|2,0,0]=4 84 B5R0.4 CC(CCl)(F)Cl PI-21038 [0,2,0,0,0,0|0,1,0]=3 85 B5R0.4 C[Si](C)(CCl)Cl PI-24149 [0,2,0,0,0,0|1,1,0]=4 86 B5R0.5 C(C(=O)Cl)(F)F PI-48696 [0,2,0,0,0,0|0,2,0]=4 87 B5R0.5 CC(C(=O)Cl)Cl PI-45764 [0,2,0,0,0,0|1,0,0]=3 88 B5R0.5 CC(C(=O)Cl)Cl PI-45765 [0,2,0,0,0,0|1,0,0]=3 89 B5R0.5 CC(C(=O)Cl)Cl PI-49052 [0,2,0,0,0,0|1,0,0]=3 90 B5R0.5 CC(C(=O)O)Cl PI-28351 [0,2,0,0,0,0|2,0,0]=4 91 B5R0.5 C[N+](=C(Cl)Cl)C PI-30496 [0,2,0,0,0,0|1,0,1]=4 92 B5R0.5 ClC(C(=O)[O-])Cl PI-39489 [0,2,0,0,0,0|1,0,0]=3 93 B5R0.5 FC(C(Cl)F)Cl PI-21026 [0,2,0,0,0,0|0,1,0]=3 94 B5R1.3 ClCC1OC1 PI-37744 [0,1,0,1,0,0|2,0,0]=4 95 B5R1.3 ClC[C@@H]1CO1 PI-16630 [0,1,0,1,0,0|2,0,0]=4 96 B5R1.3 ClC[C@H]1CO1 PI-16629 [0,1,0,1,0,0|2,0,0]=4