0 B1R0.1 C=O D00017 [0,0,0,0,0,0|2,0,0]=2 1 B1R0.1 C=O D01494 [0,0,0,0,0,0|2,0,0]=2 2 B1R0.1 C=O D06525 [0,0,0,0,0,0|2,0,0]=2 3 B1R0.1 CO D02309 [0,0,0,0,0,0|2,0,0]=2 4 B1R0.1 Cl[82Rb] D05773 [0,0,0,0,0,0|2,0,0]=2 5 B1R0.1 Cl[86Rb] D05774 [0,0,0,0,0,0|2,0,0]=2 6 B1R0.1 II D00108 [0,0,0,0,0,0|2,0,0]=2 7 B1R0.1 N#N D00083 [0,0,0,0,0,0|0,0,0]=0 8 B1R0.1 O=O D00003 [0,0,0,0,0,0|2,0,0]=2 9 B1R0.1 O=[Ca] D01679 [0,0,0,0,0,0|2,0,0]=2 10 B1R0.1 O=[Mg] D01167 [0,0,0,0,0,0|2,0,0]=2 11 B1R0.1 O=[Zn] D01170 [0,0,0,0,0,0|2,0,0]=2 12 B1R0.1 OO D00008 [0,0,0,0,0,0|2,0,0]=2 13 B1R0.1 O[K] D01168 [0,0,0,0,0,0|2,0,0]=2 14 B1R0.1 S=[Zn] D09034 [0,0,0,0,0,0|2,0,0]=2 15 B1R0.1 [11C-]#[O+] D03398 [0,0,0,0,0,0|2,0,0]=2 16 B1R0.1 [C-]#N D05647 [0,0,0,0,0,0|1,0,0]=1 17 B1R0.1 [C-]#[O+] D09706 [0,0,0,0,0,0|2,0,0]=2 18 B1R0.1 [Li]Br D08135 [0,0,0,0,0,0|2,0,0]=2 19 B1R0.1 [Li]O D04750 [0,0,0,0,0,0|2,0,0]=2 20 B1R0.1 [N]=O D00074 [0,0,0,0,0,0|1,0,1]=2 21 B1R0.1 [Na]I D04874 [0,0,0,0,0,0|2,0,0]=2 22 B1R0.1 [Na][123I] D05328 [0,0,0,0,0,0|2,0,0]=2 23 B1R0.1 [Na][125I] D05863 [0,0,0,0,0,0|2,0,0]=2 24 B1R0.1 [Na][131I] D02259 [0,0,0,0,0,0|2,0,0]=2 25 B1R0.1 [O-]Cl D01711 [0,0,0,0,0,0|2,0,0]=2 26 B1R0.1 [O-]Cl D01727 [0,0,0,0,0,0|2,0,0]=2 27 B0R0.1 Cl D02057 [1,0,0,0,0,0|0,0,0]=1 28 B0R0.1 N D01502 [1,0,0,0,0,0|0,0,0]=1 29 B0R0.1 N D02916 [1,0,0,0,0,0|0,0,0]=1 30 B0R0.1 O D00001 [1,0,0,0,0,0|0,0,0]=1 31 B0R0.1 O D03271 [1,0,0,0,0,0|0,0,0]=1 32 B0R0.1 S D00024 [1,0,0,0,0,0|0,0,0]=1 33 B0R0.1 [127Xe] D06338 [1,0,0,0,0,0|0,0,0]=1 34 B0R0.1 [131Cs+] D03446 [1,0,0,0,0,0|0,0,0]=1 35 B0R0.1 [133Xe] D06339 [1,0,0,0,0,0|0,0,0]=1 36 B0R0.1 [13NH3] D02915 [1,0,0,0,0,0|0,0,0]=1 37 B0R0.1 [15OH2] D06322 [1,0,0,0,0,0|0,0,0]=1 38 B0R0.1 [177Lu+3] D10828 [1,0,0,0,0,0|0,0,0]=1 39 B0R0.1 [18F-] D05860 [1,0,0,0,0,0|0,0,0]=1 40 B0R0.1 [192Ir] D04613 [1,0,0,0,0,0|0,0,0]=1 41 B0R0.1 [198Au] D04357 [1,0,0,0,0,0|0,0,0]=1 42 B0R0.1 [201TlH2+] D02402 [1,0,0,0,0,0|0,0,0]=1 43 B0R0.1 [22Na+] D05854 [1,0,0,0,0,0|0,0,0]=1 44 B0R0.1 [42K+] D05577 [1,0,0,0,0,0|0,0,0]=1 45 B0R0.1 [81Kr] D04656 [1,0,0,0,0,0|0,0,0]=1 46 B0R0.1 [Ba+2] D03055 [1,0,0,0,0,0|0,0,0]=1 47 B0R0.1 [Br-] D01731 [1,0,0,0,0,0|0,0,0]=1 48 B0R0.1 [Br-] D02055 [1,0,0,0,0,0|0,0,0]=1 49 B0R0.1 [Cl-] D01139 [1,0,0,0,0,0|0,0,0]=1 50 B0R0.1 [Cl-] D02056 [1,0,0,0,0,0|0,0,0]=1 51 B0R0.1 [Cl-] D02060 [1,0,0,0,0,0|0,0,0]=1 52 B0R0.1 [F-] D00943 [1,0,0,0,0,0|0,0,0]=1 53 B0R0.1 [He] D04420 [1,0,0,0,0,0|0,0,0]=1 54 B0R0.1 [I-] D01016 [1,0,0,0,0,0|0,0,0]=1 55 B0R0.1 [K+] D08403 [1,0,0,0,0,0|0,0,0]=1 56 B0R0.1 [Li] D08133 [1,0,0,0,0,0|0,0,0]=1 57 B0R0.1 [NH4+] D04594 [1,0,0,0,0,0|0,0,0]=1 58 B0R0.1 [Na+] D01169 [1,0,0,0,0,0|0,0,0]=1 59 B0R0.1 [Xe] D01901 [1,0,0,0,0,0|0,0,0]=1 60 B2R0.1 Br[Ca]Br D01723 [0,1,0,0,0,0|2,0,0]=3 61 B2R0.1 CCC D05625 [0,1,0,0,0,0|2,0,0]=3 62 B2R0.1 CCCl D04088 [0,1,0,0,0,0|2,0,0]=3 63 B2R0.1 CCO D00068 [0,1,0,0,0,0|2,0,0]=3 64 B2R0.1 ClCCl D02330 [0,1,0,0,0,0|2,0,0]=3 65 B2R0.1 Cl[223Ra]Cl D10398 [0,1,0,0,0,0|2,0,0]=3 66 B2R0.1 Cl[45Ca]Cl D03289 [0,1,0,0,0,0|2,0,0]=3 67 B2R0.1 Cl[47Ca]Cl D03291 [0,1,0,0,0,0|2,0,0]=3 68 B2R0.1 Cl[57Co]Cl D03574 [0,1,0,0,0,0|2,0,0]=3 69 B2R0.1 Cl[60Co]Cl D03575 [0,1,0,0,0,0|2,0,0]=3 70 B2R0.1 Cl[65Zn]Cl D06369 [0,1,0,0,0,0|2,0,0]=3 71 B2R0.1 Cl[85Sr]Cl D05933 [0,1,0,0,0,0|2,0,0]=3 72 B2R0.1 Cl[89Sr]Cl D02006 [0,1,0,0,0,0|2,0,0]=3 73 B2R0.1 Cl[Ca]Cl D02256 [0,1,0,0,0,0|2,0,0]=3 74 B2R0.1 Cl[Cu]Cl D03612 [0,1,0,0,0,0|2,0,0]=3 75 B2R0.1 Cl[Hg]Cl D01905 [0,1,0,0,0,0|2,0,0]=3 76 B2R0.1 Cl[Mg]Cl D04834 [0,1,0,0,0,0|2,0,0]=3 77 B2R0.1 Cl[Mn]Cl D04852 [0,1,0,0,0,0|2,0,0]=3 78 B2R0.1 Cl[Pt]Cl D00275 [0,1,0,0,0,0|2,0,0]=3 79 B2R0.1 Cl[SnH2]Cl D05918 [0,1,0,0,0,0|2,0,0]=3 80 B2R0.1 Cl[Zn]Cl D02058 [0,1,0,0,0,0|2,0,0]=3 81 B2R0.1 F[SnH2]F D05919 [0,1,0,0,0,0|2,0,0]=3 82 B2R0.1 I[Zn]I D04837 [0,1,0,0,0,0|2,0,0]=3 83 B2R0.1 N#CN D00123 [0,1,0,0,0,0|0,0,1]=2 84 B2R0.1 N#C[N-2] D03288 [0,1,0,0,0,0|0,0,1]=2 85 B2R0.1 N[Hg]Cl D04934 [0,1,0,0,0,0|1,0,1]=3 86 B2R0.1 O=C=O D00004 [0,1,0,0,0,0|2,0,0]=3 87 B2R0.1 O=N[O-] D05865 [0,1,0,0,0,0|1,0,1]=3 88 B2R0.1 O=S=O D05961 [0,1,0,0,0,0|2,0,0]=3 89 B2R0.1 O=[Si]=O D05839 [0,1,0,0,0,0|2,0,0]=3 90 B2R0.1 O=[Si]=O D06521 [0,1,0,0,0,0|2,0,0]=3 91 B2R0.1 O=[Si]=O D06522 [0,1,0,0,0,0|2,0,0]=3 92 B2R0.1 O=[Ti]=O D01931 [0,1,0,0,0,0|2,0,0]=3 93 B2R0.1 O[Ca]O D01083 [0,1,0,0,0,0|2,0,0]=3 94 B2R0.1 O[Mg]O D00731 [0,1,0,0,0,0|2,0,0]=3 95 B2R0.1 P(=O)O D02334 [0,1,0,0,0,0|1,1,0]=3 96 B2R0.1 S=[Se]=S D05815 [0,1,0,0,0,0|2,0,0]=3 97 B2R0.1 [2H]O[2H] D03703 [0,1,0,0,0,0|2,0,0]=3 98 B2R0.1 [N-]=[N+]=O D00102 [0,1,0,0,0,0|0,0,2]=3 99 B2R0.1 [Na]S[Na] D09001 [0,1,0,0,0,0|2,0,0]=3 100 B3R0.1 CCCC D03186 [0,2,0,0,0,0|2,0,0]=4 101 B3R0.1 NCCN D01114 [0,2,0,0,0,0|0,0,2]=4 102 B3R0.1 NCCO D05074 [0,2,0,0,0,0|1,0,1]=4 103 B3R0.1 NCCS D03634 [0,2,0,0,0,0|1,0,1]=4 104 B3R0.1 NCCS D03635 [0,2,0,0,0,0|1,0,1]=4 105 B3R0.1 O=BO[O-] D07066 [0,2,0,0,0,0|2,0,0]=4 106 B3R0.1 OCCO D03370 [0,2,0,0,0,0|2,0,0]=4 107 B3R0.1 OCCO D06418 [0,2,0,0,0,0|2,0,0]=4 108 B3R0.1 OCCO D06419 [0,2,0,0,0,0|2,0,0]=4 109 B3R0.1 OCCO D06420 [0,2,0,0,0,0|2,0,0]=4 110 B3R0.1 OCCO D06421 [0,2,0,0,0,0|2,0,0]=4 111 B3R0.1 OCCO D06422 [0,2,0,0,0,0|2,0,0]=4 112 B3R0.1 OCCO D06423 [0,2,0,0,0,0|2,0,0]=4 113 B3R0.2 CC(=O)O D00010 [0,2,0,0,0,0|2,0,0]=4 114 B3R0.2 CC(=O)[O-] D00931 [0,2,0,0,0,0|2,0,0]=4 115 B3R0.2 CC(=O)[O-] D01154 [0,2,0,0,0,0|2,0,0]=4 116 B3R0.2 CC(=O)[O-] D01779 [0,2,0,0,0,0|2,0,0]=4 117 B3R0.2 CC(=O)[O-] D01945 [0,2,0,0,0,0|2,0,0]=4 118 B3R0.2 CC(=O)[O-] D02257 [0,2,0,0,0,0|2,0,0]=4 119 B3R0.2 CC(=O)[O-] D03611 [0,2,0,0,0,0|2,0,0]=4 120 B3R0.2 CC(=O)[O-] D06408 [0,2,0,0,0,0|2,0,0]=4 121 B3R0.2 CC(=O)[O-] D08134 [0,2,0,0,0,0|2,0,0]=4 122 B3R0.2 CC(C)=O D02311 [0,2,0,0,0,0|2,0,0]=4 123 B3R0.2 CC(C)C D04623 [0,2,0,0,0,0|2,0,0]=4 124 B3R0.2 CC(C)N D04609 [0,2,0,0,0,0|1,0,1]=4 125 B3R0.2 CC(C)O D00137 [0,2,0,0,0,0|2,0,0]=4 126 B3R0.2 CS(C)=O D01043 [0,2,0,0,0,0|2,0,0]=4 127 B3R0.2 C[11C](=O)[O-] D05850 [0,2,0,0,0,0|2,0,0]=4 128 B3R0.2 Cl[51Cr](Cl)Cl D03480 [0,2,0,0,0,0|2,0,0]=4 129 B3R0.2 Cl[59Fe](Cl)Cl D04166 [0,2,0,0,0,0|2,0,0]=4 130 B3R0.2 Cl[AlH3](Cl)Cl D02845 [0,2,0,0,0,0|2,0,0]=4 131 B3R0.2 Cl[Cr](Cl)Cl D03479 [0,2,0,0,0,0|2,0,0]=4 132 B3R0.2 Cl[In](Cl)Cl D02107 [0,2,0,0,0,0|2,0,0]=4 133 B3R0.2 IC(I)I D01910 [0,2,0,0,0,0|2,0,0]=4 134 B3R0.2 NC(=O)[O-] D02919 [0,2,0,0,0,0|1,0,1]=4 135 B3R0.2 NC(N)=O D00023 [0,2,0,0,0,0|0,0,2]=4 136 B3R0.2 NC(N)=O D03383 [0,2,0,0,0,0|0,0,2]=4 137 B3R0.2 N[13C](N)=O D01749 [0,2,0,0,0,0|0,0,2]=4 138 B3R0.2 N[14C](N)=O D10496 [0,2,0,0,0,0|0,0,2]=4 139 B3R0.2 O=C([O-])O D01203 [0,2,0,0,0,0|2,0,0]=4 140 B3R0.2 O=C([O-])O D02077 [0,2,0,0,0,0|2,0,0]=4 141 B3R0.2 O=C([O-])[O-] D00801 [0,2,0,0,0,0|2,0,0]=4 142 B3R0.2 O=C([O-])[O-] D00932 [0,2,0,0,0,0|2,0,0]=4 143 B3R0.2 O=C([O-])[O-] D01446 [0,2,0,0,0,0|2,0,0]=4 144 B3R0.2 O=C([O-])[O-] D01780 [0,2,0,0,0,0|2,0,0]=4 145 B3R0.2 O=C([O-])[O-] D02038 [0,2,0,0,0,0|2,0,0]=4 146 B3R0.2 O=C([O-])[O-] D02821 [0,2,0,0,0,0|2,0,0]=4 147 B3R0.2 O=C([O-])[O-] D02844 [0,2,0,0,0,0|2,0,0]=4 148 B3R0.2 O=C([O-])[O-] D04667 [0,2,0,0,0,0|2,0,0]=4 149 B3R0.2 O=C([O-])[O-] D05283 [0,2,0,0,0,0|2,0,0]=4 150 B3R0.2 O=P(=O)[O-] D05582 [0,2,0,0,0,0|1,1,0]=4 151 B3R0.2 O=S([O-])O D02059 [0,2,0,0,0,0|2,0,0]=4 152 B3R0.2 O=S([O-])[O-] D09002 [0,2,0,0,0,0|2,0,0]=4 153 B3R0.2 O=[13C]([O-])[O-] D10802 [0,2,0,0,0,0|2,0,0]=4 154 B3R0.2 O=[N+]([O-])O D02313 [0,2,0,0,0,0|1,0,1]=4 155 B3R0.2 O=[N+]([O-])[O-] D00940 [0,2,0,0,0,0|1,0,1]=4 156 B3R0.2 O=[N+]([O-])[O-] D01730 [0,2,0,0,0,0|1,0,1]=4 157 B3R0.2 O=[N+]([O-])[O-] D02051 [0,2,0,0,0,0|1,0,1]=4 158 B3R0.2 O=[N+]([O-])[O-] D05840 [0,2,0,0,0,0|1,0,1]=4 159 B3R0.2 O=[N+]([O-])[O-] D05934 [0,2,0,0,0,0|1,0,1]=4 160 B3R0.2 O=[Se](O)O D05814 [0,2,0,0,0,0|2,0,0]=4 161 B3R0.2 O=[Se]([O-])[O-] D10530 [0,2,0,0,0,0|2,0,0]=4 162 B3R0.2 OB(O)O D01089 [0,2,0,0,0,0|2,0,0]=4 163 B3R0.2 O[AlH3](O)O D02416 [0,2,0,0,0,0|2,0,0]=4 164 B3R0.2 O[AlH3](O)O D02807 [0,2,0,0,0,0|2,0,0]=4 165 B3R0.2 [K][IH2](I)I D00860 [0,2,0,0,0,0|2,0,0]=4 166 B3R1.1 C1CC1 D03627 [0,1,0,1,0,0|2,0,0]=4 167 B3R1.1 C1CO1 D03474 [0,1,0,1,0,0|2,0,0]=4