0 B2R0.1 C(F)I PI-46452 [0,0,0,0,0,0|3,0,0]=3 1 B2R0.1 CNO PI-24407 [0,0,0,0,0,0|1,0,1]=2 2 B2R0.1 CON PI-12344 [0,0,0,0,0,0|3,0,0]=3 3 B2R0.1 CSC PI-50002 [0,0,0,0,0,0|3,0,0]=3 4 B2R0.1 Cl[Pt]Cl PI-35163 [0,0,0,0,0,0|3,0,0]=3 5 B2R0.1 NC=N PI-38823 [0,0,0,0,0,0|3,0,0]=3 6 B2R0.1 O=[Os]=O PI-41580 [0,0,0,0,0,0|1,0,1]=2 7 B2R0.1 ON=O PI-38467 [0,0,0,0,0,0|0,0,0]=0 8 B2R0.1 S=[W]=S PI-48964 [0,0,0,0,0,0|1,2,0]=3 9 B2R0.1 [B](Br)Br PI-49994 [0,0,0,0,0,0|3,0,0]=3 10 B1R0.1 CC PI-12250 [1,0,0,0,0,0|2,0,0]=3 11 B3R0.1 BrCC#N PI-20513 [0,1,0,0,0,0|3,0,0]=4 12 B3R0.1 C(=CBr)Br PI-47053 [0,1,0,0,0,0|3,0,0]=4 13 B3R0.1 C(=CCl)F PI-20089 [0,1,0,0,0,0|3,0,0]=4 14 B3R0.1 C(CBr)Cl PI-44621 [0,1,0,0,0,0|3,0,0]=4 15 B3R0.1 C(CF)F PI-21164 [0,1,0,0,0,0|3,0,0]=4 16 B3R0.1 C(CS)N PI-39848 [0,1,0,0,0,0|2,1,0]=4 17 B3R0.1 C(F)CN PI-41615 [0,1,0,0,0,0|3,0,0]=4 18 B3R0.1 CCC=O PI-28552 [0,1,0,0,0,0|2,0,0]=3 19 B3R0.1 CCCN PI-46904 [0,1,0,0,0,0|3,0,0]=4 20 B3R0.1 CCCN PI-46913 [0,1,0,0,0,0|3,0,0]=4 21 B3R0.1 CNCC PI-40147 [0,1,0,0,0,0|2,0,1]=4 22 B3R0.1 COCBr PI-22152 [0,1,0,0,0,0|2,0,0]=3 23 B3R0.1 CONC PI-16632 [0,1,0,0,0,0|1,0,1]=3 24 B3R0.1 C\C=N\O PI-37002 [0,1,0,0,0,0|1,0,0]=2 25 B3R0.1 NCC#C PI-38458 [0,1,0,0,0,0|3,0,0]=4 26 B3R0.1 NCC#N PI-38793 [0,1,0,0,0,0|3,0,0]=4 27 B3R0.1 NCCN PI-38127 [0,1,0,0,0,0|3,0,0]=4 28 B3R0.1 NCCN PI-38389 [0,1,0,0,0,0|3,0,0]=4 29 B3R0.1 NNC=O PI-38803 [0,1,0,0,0,0|1,0,1]=3 30 B3R0.1 OCCBr PI-37291 [0,1,0,0,0,0|2,0,0]=3 31 B3R0.1 [CH2-]CCC PI-37346 [0,1,0,0,0,0|3,0,0]=4 32 B3R0.2 C(=N)(N)N PI-46905 [0,1,0,0,0,0|3,0,0]=4 33 B3R0.2 C(Cl)(Br)Br PI-23709 [0,1,0,0,0,0|3,0,0]=4 34 B3R0.2 C=C(F)Br PI-14442 [0,1,0,0,0,0|3,0,0]=4 35 B3R0.2 CB(O)O PI-24088 [0,1,0,0,0,0|1,0,1]=3 36 B3R0.2 CC(=O)O PI-11632 [0,1,0,0,0,0|1,0,0]=2 37 B3R0.2 CC(=O)O PI-38547 [0,1,0,0,0,0|1,0,0]=2 38 B3R0.2 CC(=O)[O-] PI-20290 [0,1,0,0,0,0|1,0,1]=3 39 B3R0.2 CC(=S)N PI-16528 [0,1,0,0,0,0|2,1,0]=4 40 B3R0.2 CC(C)[O-] PI-47044 [0,1,0,0,0,0|2,0,1]=4 41 B3R0.2 CC([O-])=S PI-36444 [0,1,0,0,0,0|1,1,1]=4 42 B3R0.2 C[S+](C)C PI-41785 [0,1,0,0,0,0|3,0,0]=4 43 B3R0.2 NC(=N)Cl PI-38973 [0,1,0,0,0,0|3,0,0]=4 44 B3R0.2 NC(N)=N PI-47789 [0,1,0,0,0,0|3,0,0]=4 45 B3R0.2 NC(N)=N PI-47790 [0,1,0,0,0,0|3,0,0]=4 46 B3R0.2 [O-]C(=O)C PI-37083 [0,1,0,0,0,0|1,0,1]=3 47 B3R0.2 [O-]C(=O)C PI-41421 [0,1,0,0,0,0|1,0,1]=3 48 B0R0.1 [B] PI-49996 [2,0,0,0,0,0|0,0,0]=2 49 B0R0.1 [Cl-] PI-37978 [2,0,0,0,0,0|0,0,0]=2 50 B0R0.1 [Li+] PI-39402 [2,0,0,0,0,0|0,0,0]=2 51 B0R0.1 [NH4+] PI-44240 [2,0,0,0,0,0|0,0,0]=2 52 B4R0.1 C#CC(=O)N PI-48352 [0,2,0,0,0,0|2,0,0]=4 53 B4R0.1 C(=O)(N)NO PI-15345 [0,2,0,0,0,0|0,0,1]=3 54 B4R0.1 C(C(=O)Cl)Br PI-46514 [0,2,0,0,0,0|2,0,0]=4 55 B4R0.1 C(C(=O)N)I PI-47045 [0,2,0,0,0,0|2,0,0]=4 56 B4R0.1 C(C(=O)N)N PI-14271 [0,2,0,0,0,0|2,0,0]=4 57 B4R0.1 C(C(=O)[O-])Cl PI-44622 [0,2,0,0,0,0|1,0,1]=4 58 B4R0.1 CC(=O)C#C PI-15653 [0,2,0,0,0,0|2,0,0]=4 59 B4R0.1 CC(=O)CBr PI-38994 [0,2,0,0,0,0|2,0,0]=4 60 B4R0.1 CC(=O)NBr PI-47108 [0,2,0,0,0,0|1,0,1]=4 61 B4R0.1 CC(C#C)O PI-44141 [0,2,0,0,0,0|2,0,0]=4 62 B4R0.1 CC(CN)O PI-16659 [0,2,0,0,0,0|2,0,0]=4 63 B4R0.1 CC(CO)O PI-16674 [0,2,0,0,0,0|1,0,1]=4 64 B4R0.1 CC(O)=NO PI-10772 [0,2,0,0,0,0|0,0,1]=3 65 B4R0.1 CC(O)C#C PI-43256 [0,2,0,0,0,0|2,0,0]=4 66 B4R0.1 CCB(O)O PI-25578 [0,2,0,0,0,0|1,0,1]=4 67 B4R0.1 CCC(C)O PI-15619 [0,2,0,0,0,0|2,0,0]=4 68 B4R0.1 CN=C(N)N PI-12937 [0,2,0,0,0,0|2,0,0]=4 69 B4R0.1 COC(=N)N PI-30686 [0,2,0,0,0,0|2,0,0]=4 70 B4R0.1 C[C@@H](CO)N PI-12236 [0,2,0,0,0,0|2,0,0]=4 71 B4R0.1 C[C@@H](N)CO PI-16472 [0,2,0,0,0,0|2,0,0]=4 72 B4R0.1 C[C@@H](O)CN PI-12234 [0,2,0,0,0,0|2,0,0]=4 73 B4R0.1 NC(=O)CBr PI-10963 [0,2,0,0,0,0|2,0,0]=4 74 B4R0.1 OCC(F)F PI-21165 [0,2,0,0,0,0|2,0,0]=4 75 B4R0.1 OC[C@H](O)C PI-16673 [0,2,0,0,0,0|1,0,1]=4 76 B4R0.2 C#CCCO PI-16501 [0,2,0,0,0,0|2,0,0]=4 77 B4R0.2 C(=O)[N-]C=O PI-42986 [0,2,0,0,0,0|0,0,2]=4 78 B4R0.2 C(CO)CBr PI-15814 [0,2,0,0,0,0|2,0,0]=4 79 B4R0.2 C(CO)CI PI-50488 [0,2,0,0,0,0|2,0,0]=4 80 B4R0.2 C=CCON PI-47075 [0,2,0,0,0,0|2,0,0]=4 81 B4R0.2 CC#CCO PI-15652 [0,2,0,0,0,0|2,0,0]=4 82 B4R0.2 CC=CCO PI-41583 [0,2,0,0,0,0|2,0,0]=4 83 B4R0.2 CCOC=C PI-12733 [0,2,0,0,0,0|2,0,0]=4 84 B4R0.2 COCCBr PI-21426 [0,2,0,0,0,0|2,0,0]=4 85 B4R0.2 OCCCS PI-39546 [0,2,0,0,0,0|1,1,0]=4 86 B4R0.3 BrP(=O)(Br)Br PI-13216 [0,2,0,0,0,0|1,1,0]=4 87 B4R0.3 C[S+](=O)(C)C PI-35968 [0,2,0,0,0,0|2,0,0]=4 88 B4R0.3 NS(=O)(=O)Cl PI-36528 [0,2,0,0,0,0|1,0,1]=4 89 B4R0.3 NS(=O)(=O)N PI-12145 [0,2,0,0,0,0|1,0,1]=4 90 B4R0.3 [O-]S(=O)(=O)C PI-38597 [0,2,0,0,0,0|1,0,1]=4 91 B4R1.2 C[C@@H]1CO1 PI-10840 [0,1,0,1,0,0|2,0,0]=4 92 B4R1.2 C[C@H]1CO1 PI-10843 [0,1,0,1,0,0|2,0,0]=4