0 B3R0.2 Br[Ce](Br)Br 5625AF [0,0,0,0,0,0|4,0,0]=4 1 B3R0.2 CC(=O)[Cl] O182 [0,0,0,0,0,0|1,0,0]=1 2 B3R0.2 CC(=O)[O-] E849 [0,0,0,0,0,0|0,0,1]=1 3 B3R0.2 CC(=O)[O-] Y2043 [0,0,0,0,0,0|0,0,1]=1 4 B3R0.2 CC(=O)[O-] Y2049 [0,0,0,0,0,0|0,0,1]=1 5 B3R0.2 CN(C)N 3031AH [0,0,0,0,0,0|3,0,0]=3 6 B3R0.2 C[PH](C)=O 3279AL [0,0,0,0,0,0|2,0,0]=2 7 B3R0.2 C[S+](C)C 9165AJ [0,0,0,0,0,0|3,0,0]=3 8 B3R0.2 C[Sn](C)=O 6872AF [0,0,0,0,0,0|2,0,0]=2 9 B3R0.2 ClC(Cl)Br 8444AJ [0,0,0,0,0,0|3,0,1]=4 10 B3R0.2 Cl[AlH3](Cl)Cl 5469AF [0,0,0,0,0,0|4,0,0]=4 11 B3R0.2 Cl[Os](Cl)Cl 8362AF [0,0,0,0,0,0|4,0,0]=4 12 B3R0.2 Cl[Pt-](Cl)Cl 6663AA [0,0,0,0,0,0|4,0,0]=4 13 B3R0.2 Cl[Rh](Cl)Cl 0627AB [0,0,0,0,0,0|4,0,0]=4 14 B3R0.2 Cl[Tm](Cl)Cl 8377AF [0,0,0,0,0,0|4,0,0]=4 15 B3R0.2 F[Sb](F)F 8606AF [0,0,0,0,0,0|4,0,0]=4 16 B3R0.2 O=C([O-])O 6221AA [0,0,0,0,0,0|1,0,0]=1 17 B3R0.2 O=I(=O)[O-] Y1930 [0,0,0,0,0,0|2,0,1]=3 18 B3R0.2 O=S(O)O 8693AF [0,0,0,0,0,0|2,0,0]=2 19 B3R0.2 O=S(O)O S352 [0,0,0,0,0,0|2,0,0]=2 20 B3R0.2 O=S([O-])[O-] 9209AB [0,0,0,0,0,0|2,0,1]=3 21 B3R0.2 O=[N+]([O-])[O-] 8572AF [0,0,0,0,0,0|2,0,1]=3 22 B3R0.2 O=[N+]([O-])[O-] 8673AF [0,0,0,0,0,0|2,0,1]=3 23 B3R0.2 O=[N+]([O-])[O-] 8722AF [0,0,0,0,0,0|2,0,1]=3 24 B3R0.2 O=[Te]([O-])[O-] 5213AF [0,0,0,0,0,0|2,0,1]=3 25 B3R0.2 O[Au](O)O 7031AH [0,0,0,0,0,0|2,0,1]=3 26 B2R0.1 Br[Hg]Br 5609AF [1,0,0,0,0,0|3,0,0]=4 27 B2R0.1 C=NO 8435AF [1,0,0,0,0,0|1,0,1]=3 28 B2R0.1 Cl[PbH2]Cl 8325AF [1,0,0,0,0,0|3,0,0]=4 29 B2R0.1 Cl[Pd]Cl 7776AH [1,0,0,0,0,0|3,0,0]=4 30 B2R0.1 Cl[Pt]Cl 6761AA [1,0,0,0,0,0|3,0,0]=4 31 B2R0.1 I[Ba]I 5557AF [1,0,0,0,0,0|3,0,0]=4 32 B2R0.1 I[Hg]I X5988 [1,0,0,0,0,0|3,0,0]=4 33 B2R0.1 I[Pt]I X6027 [1,0,0,0,0,0|3,0,0]=4 34 B2R0.1 N=CN 7945AL [1,0,0,0,0,0|2,0,0]=3 35 B2R0.1 O=C[O-] 7946AL [1,0,0,0,0,0|0,0,1]=2 36 B2R0.1 O=C[O-] 8928AL [1,0,0,0,0,0|0,0,1]=2 37 B2R0.1 O=[Ir]=O 8780AF [1,0,0,0,0,0|1,0,1]=3 38 B2R0.1 O[Pt]O 4927AB [1,0,0,0,0,0|1,0,1]=3 39 B4R0.1 BrCC(Br)Br X2956 [0,1,0,0,0,0|2,0,1]=4 40 B4R0.1 C#CC(C)Cl 6017AL [0,1,0,0,0,0|2,0,1]=4 41 B4R0.1 C=C(F)CCl 6785AE [0,1,0,0,0,0|2,0,0]=3 42 B4R0.1 C=C=C(C)C 6086AL [0,1,0,0,0,0|2,0,0]=3 43 B4R0.1 C=CC(C)C 7308AF [0,1,0,0,0,0|2,0,1]=4 44 B4R0.1 C=NN(C)C 7943AL [0,1,0,0,0,0|3,0,0]=4 45 B4R0.1 CC(=O)NBr 6847AF [0,1,0,0,0,0|1,0,0]=2 46 B4R0.1 CC(=O)NBr 6848AF [0,1,0,0,0,0|1,0,0]=2 47 B4R0.1 CC(N)C#N V7482 [0,1,0,0,0,0|2,0,1]=4 48 B4R0.1 CC(S)CS 4476AL [0,1,0,0,0,0|0,2,1]=4 49 B4R0.1 CCC(=O)Br C859 [0,1,0,0,0,0|1,0,0]=2 50 B4R0.1 CC[SiH](Cl)Cl 7902AL [0,1,0,0,0,0|2,1,0]=4 51 B4R0.1 COP(Cl)Cl X7327 [0,1,0,0,0,0|3,0,0]=4 52 B4R0.1 CSC(=N)N 4399AD [0,1,0,0,0,0|2,0,0]=3 53 B4R0.1 CSC(C)=O 9061AJ [0,1,0,0,0,0|0,1,0]=2 54 B4R0.1 CSC(C)C 8107AL [0,1,0,0,0,0|1,1,1]=4 55 B4R0.1 CS[S+](C)C 7703AL [0,1,0,0,0,0|2,1,0]=4 56 B4R0.1 C\C(N)=N/O 5291AE [0,1,0,0,0,0|1,0,0]=2 57 B4R0.1 C\C=C(/C)Cl 5560AL [0,1,0,0,0,0|2,0,0]=3 58 B4R0.1 C\C=C(\C)Cl 4247AL [0,1,0,0,0,0|2,0,0]=3 59 B4R0.1 FC(Cl)CCl 3256AE [0,1,0,0,0,0|2,0,1]=4 60 B4R0.1 N=C(N)CO 6468AB [0,1,0,0,0,0|2,0,0]=3 61 B4R0.1 NCC(=O)O 7986AL [0,1,0,0,0,0|0,0,0]=1 62 B4R0.1 NCC(=O)[O-] P522 [0,1,0,0,0,0|0,0,1]=2 63 B4R0.1 NNC(N)=S I585 [0,1,0,0,0,0|2,1,0]=4 64 B4R0.3 CC(C)(C)N 9036AL [0,1,0,0,0,0|2,0,1]=4 65 B4R0.3 CP(C)(=S)Cl 7720AL [0,1,0,0,0,0|2,1,0]=4 66 B4R0.3 C[Ge](C)(C)Cl Y1383 [0,1,0,0,0,0|2,1,0]=4 67 B4R0.3 C[N+](C)(C)N Y0552 [0,1,0,0,0,0|3,0,0]=4 68 B4R0.3 C[Sn](C)(Cl)Cl 6867AF [0,1,0,0,0,0|3,0,0]=4 69 B4R0.3 O=Cl(=O)(=O)[O-] 5524AF [0,1,0,0,0,0|2,0,1]=4 70 B4R0.3 O=Cl(=O)(=O)[O-] 7311AH [0,1,0,0,0,0|2,0,1]=4 71 B4R0.3 O=Cl(=O)(=O)[O-] 8423AF [0,1,0,0,0,0|2,0,1]=4 72 B4R0.3 O=P([O-])(O)O 5366AA [0,1,0,0,0,0|2,0,0]=3 73 B4R0.3 O=P([O-])([O-])[O-] 0455AC [0,1,0,0,0,0|2,0,1]=4 74 B4R0.3 O=P([O-])([O-])[O-] 8497AF [0,1,0,0,0,0|2,0,1]=4 75 B4R0.3 O=S(=O)(O)O 8257AL [0,1,0,0,0,0|2,0,0]=3 76 B4R0.3 O=S(=O)(O)O K629 [0,1,0,0,0,0|2,0,0]=3 77 B4R0.3 O=S(=O)([O-])[O-] 5193AF [0,1,0,0,0,0|2,0,1]=4 78 B4R0.3 O=S(=O)([O-])[O-] 5389AF [0,1,0,0,0,0|2,0,1]=4 79 B4R0.3 O=S(=O)([O-])[O-] 5390AF [0,1,0,0,0,0|2,0,1]=4 80 B4R0.3 O=S(=O)([O-])[O-] 5394AF [0,1,0,0,0,0|2,0,1]=4 81 B4R0.3 O=S(=O)([O-])[O-] 8944AF [0,1,0,0,0,0|2,0,1]=4 82 B4R0.3 O=S(=O)([O-])[O-] Z3641 [0,1,0,0,0,0|2,0,1]=4 83 B4R0.3 O=[Cr](=O)([O-])[O-] 8532AF [0,1,0,0,0,0|2,0,1]=4 84 B4R0.3 O=[Cr](=O)([O-])[O-] S426 [0,1,0,0,0,0|2,0,1]=4 85 B4R0.3 O=[Mo](=O)(Cl)Cl 8322AF [0,1,0,0,0,0|2,0,1]=4 86 B4R0.3 O=[Re](=O)(=O)O 8740AF [0,1,0,0,0,0|2,0,0]=3 87 B4R0.3 O=[Re](=O)(=O)[O-] 8795AF [0,1,0,0,0,0|2,0,1]=4 88 B4R1.2 C[C@H]1CN1 1289AL [0,0,0,1,0,0|2,0,1]=4 89 B1R0.1 C=C G764 [2,0,0,0,0,0|0,0,1]=3 90 B1R0.1 Cl[Re] 7674AH [2,0,0,0,0,0|2,0,0]=4 91 B1R0.1 O=[Ag] 7691AH [2,0,0,0,0,0|1,0,0]=3 92 B1R0.1 [C-]#[O+] Y1394 [2,0,0,0,0,0|0,0,2]=4 93 B1R0.1 [Se]=[Cd] 8261AF [2,0,0,0,0,0|1,1,0]=4 94 B3R0.1 Br\C=C\Br 6810AF [1,1,0,0,0,0|1,0,1]=4 95 B3R0.1 CCCF 3973AE [1,1,0,0,0,0|1,0,1]=4 96 B3R0.1 C\C=C\Br 4765AL [1,1,0,0,0,0|1,0,0]=3 97 B3R0.1 NCCN 6791AA [1,1,0,0,0,0|1,0,1]=4 98 B3R0.1 NCCN 6876AF [1,1,0,0,0,0|1,0,1]=4 99 B3R0.1 NCCN 9393AJ [1,1,0,0,0,0|1,0,1]=4 100 B3R0.1 NCCN E395 [1,1,0,0,0,0|1,0,1]=4 101 B5R0.1 C#CCC(C)O 6664AL [0,2,0,0,0,0|1,0,1]=4 102 B5R0.1 C=C(C)CON 4430AJ [0,2,0,0,0,0|1,0,0]=3 103 B5R0.1 C=CCC(=C)C 5694AL [0,2,0,0,0,0|2,0,0]=4 104 B5R0.1 C=CCC(C)O 7318AF [0,2,0,0,0,0|1,0,1]=4 105 B5R0.1 C=CCC(N)=O Y1568 [0,2,0,0,0,0|1,0,0]=3 106 B5R0.1 C=COC(C)C 3476AL [0,2,0,0,0,0|1,0,1]=4 107 B5R0.1 CC(C)=CCCl 7671AJ [0,2,0,0,0,0|2,0,0]=4 108 B5R0.1 CC(O)CON 3604AB [0,2,0,0,0,0|0,0,2]=4 109 B5R0.1 CCC=C(C)C 7499AF [0,2,0,0,0,0|2,0,0]=4 110 B5R0.1 CCOC(C)C 7879AL [0,2,0,0,0,0|1,0,1]=4 111 B5R0.1 CCSC(=N)N 2034AH [0,2,0,0,0,0|2,0,0]=4 112 B5R0.1 CNCC(C)=O 4565AF [0,2,0,0,0,0|1,0,0]=3 113 B5R0.1 COCC(=N)N 1769AJ [0,2,0,0,0,0|2,0,0]=4 114 B5R0.1 COC[C@H](C)O W4988 [0,2,0,0,0,0|0,0,2]=4 115 B5R0.1 CSCC(=N)N 1816AJ [0,2,0,0,0,0|2,0,0]=4 116 B5R0.1 C[C@H](N)CCO 3502AC [0,2,0,0,0,0|1,0,1]=4 117 B5R0.1 C\C(Cl)=C\CN 9653AD [0,2,0,0,0,0|2,0,0]=4 118 B5R0.1 C\C(Cl)=C\CO X6578 [0,2,0,0,0,0|1,0,0]=3 119 B5R0.1 C\C=C\B(O)O X4905 [0,2,0,0,0,0|1,0,1]=4 120 B5R0.1 C\C=C\C(N)=O 7909AD [0,2,0,0,0,0|1,0,0]=3 121 B5R0.1 N#CCC(=O)[O-] 7007AF [0,2,0,0,0,0|0,0,1]=3 122 B5R0.1 NC(=O)CCO 8063AJ [0,2,0,0,0,0|1,0,0]=3 123 B5R0.1 O=C(O)CCF 6350AB [0,2,0,0,0,0|0,0,0]=2 124 B5R0.1 O=C(O)\C=C/Br V3608 [0,2,0,0,0,0|0,0,1]=3 125 B5R0.1 O=C(O)\C=C/I 9333AB [0,2,0,0,0,0|0,0,1]=3 126 B5R0.1 O=C(O)\C=C\I V7047 [0,2,0,0,0,0|0,0,1]=3 127 B5R0.3 C=C(SC)SC 4356AL [0,2,0,0,0,0|1,1,0]=4 128 B5R0.3 C=C[C@H](O)CO 1303AL [0,2,0,0,0,0|1,0,1]=4 129 B5R0.3 CC(CN)CO 0163AC [0,2,0,0,0,0|1,0,1]=4 130 B5R0.3 CCC(=O)CN X8894 [0,2,0,0,0,0|1,0,0]=3 131 B5R0.3 CCC(=O)CO X5132 [0,2,0,0,0,0|0,0,0]=2 132 B5R0.3 CCC(=S)OC R571 [0,2,0,0,0,0|0,1,0]=3 133 B5R0.3 CCC(O)C#N 7246AF [0,2,0,0,0,0|1,0,1]=4 134 B5R0.3 CCC(O)CBr 4766AL [0,2,0,0,0,0|1,0,1]=4 135 B5R0.3 CNC(=O)CN X2965 [0,2,0,0,0,0|1,0,0]=3 136 B5R0.3 CNC(=O)NN 9285AA [0,2,0,0,0,0|1,0,0]=3 137 B5R0.3 COC(C)C#N 0627AE [0,2,0,0,0,0|1,0,1]=4 138 B5R0.3 CO[SiH](C)OC I516 [0,2,0,0,0,0|0,1,1]=4 139 B5R0.3 C\C(C=O)=C/N 3293AB [0,2,0,0,0,0|1,0,0]=3 140 B5R0.3 C\C=C(/C)CC 0241AQ [0,2,0,0,0,0|2,0,0]=4 141 B5R0.3 C\C=C(/C)CC 9220AL [0,2,0,0,0,0|2,0,0]=4 142 B5R0.3 C\C=C(\C)CC 7440AL [0,2,0,0,0,0|2,0,0]=4 143 B5R0.3 N\C(CCl)=N/O 0296AE [0,2,0,0,0,0|1,0,0]=3 144 B5R0.3 N\C(CO)=N\O 9010AE [0,2,0,0,0,0|1,0,0]=3 145 B5R0.4 C=CP(=O)(O)O 9407AL [0,2,0,0,0,0|1,0,1]=4 146 B5R0.4 CCS(=O)(=O)F 0529AQ [0,2,0,0,0,0|1,0,1]=4 147 B5R0.4 CNS(=O)(=O)O 5637AB [0,2,0,0,0,0|1,0,0]=3 148 B5R0.4 C[Si](C)(C)ON 1405AB [0,2,0,0,0,0|1,1,0]=4 149 B5R0.5 C=C(Br)C(N)=O 0896AC [0,2,0,0,0,0|1,0,1]=4 150 B5R0.5 C=C(C)B(O)O X6995 [0,2,0,0,0,0|1,0,0]=3 151 B5R0.5 C=C(C)C(C)C 5230AL [0,2,0,0,0,0|2,0,0]=4 152 B5R0.5 C=C(F)C(=O)[O-] 0621AP [0,2,0,0,0,0|0,0,2]=4 153 B5R0.5 CC(=O)C(=O)[O-] 7017AF [0,2,0,0,0,0|0,0,1]=3 154 B5R0.5 CC(=O)C(=O)[O-] 7018AF [0,2,0,0,0,0|0,0,1]=3 155 B5R0.5 CC(=O)C(C)F 0085AF [0,2,0,0,0,0|1,0,0]=3 156 B5R0.5 CC(=S)N(C)C 3685AL [0,2,0,0,0,0|1,1,0]=4 157 B5R0.5 CC(N)C(C)O 7117AF [0,2,0,0,0,0|1,0,1]=4 158 B5R0.5 CC(O)C(=N)N 2094AL [0,2,0,0,0,0|1,0,1]=4 159 B5R0.5 CC(O)C(=O)O Y1768 [0,2,0,0,0,0|0,0,0]=2 160 B5R0.5 CN(C)C(=N)N 3681AL [0,2,0,0,0,0|2,0,0]=4 161 B5R0.5 CN(C)C(N)=S 8335AE [0,2,0,0,0,0|1,1,0]=4 162 B5R0.5 C[C@H](N)C(N)=O 7048AH [0,2,0,0,0,0|1,0,0]=3 163 B5R0.5 NC(=O)C(F)Br 3265AE [0,2,0,0,0,0|1,0,0]=3 164 B5R0.5 NC(=O)C(F)I 3275AE [0,2,0,0,0,0|1,0,0]=3 165 B5R0.5 O=C(O)C(=O)O 7001AF [0,2,0,0,0,0|0,0,1]=3 166 B5R0.5 O=C(O)C(Cl)Br 8168AB [0,2,0,0,0,0|0,0,0]=2 167 B5R0.5 O=C(O)C(F)Br 8446AJ [0,2,0,0,0,0|0,0,0]=2 168 B5R0.5 O=C(O)C(F)Cl 4068AE [0,2,0,0,0,0|0,0,0]=2 169 B5R0.5 O=C([O-])C(=O)[O-] 6503AJ [0,2,0,0,0,0|0,0,2]=4 170 B5R0.5 O=C([O-])C(F)Br 8443AE [0,2,0,0,0,0|0,0,1]=3 171 B5R0.5 O=C([O-])C(F)Cl 8442AE [0,2,0,0,0,0|0,0,1]=3 172 B5R0.5 O=C([O-])C(F)I 0009AD [0,2,0,0,0,0|0,0,1]=3 173 B3R1.1 C1CS1 6858AF [1,0,0,1,0,0|0,1,1]=4 174 B5R1.2 C=C1CCC1 3599AL [0,1,0,1,0,0|2,0,0]=4 175 B5R1.2 OC1CSC1 Z6583 [0,1,0,1,0,0|0,1,1]=4 176 B5R1.3 FCC1CO1 1377AQ [0,1,0,1,0,0|1,0,1]=4 177 B5R1.3 OCC1CO1 Y6562 [0,1,0,1,0,0|0,0,2]=4