0 B4R0.1 C=C(C)[Mg]Br OR320150 [0,0,0,0,0,0|3,0,0]=3 1 B4R0.1 C=C(Cl)CBr OR53069 [0,0,0,0,0,0|2,0,2]=4 2 B4R0.1 C=C(Cl)CF PC1025 [0,0,0,0,0,0|2,0,2]=4 3 B4R0.1 C=C(F)CBr PC450149 [0,0,0,0,0,0|2,0,2]=4 4 B4R0.1 C=C(F)CCl PC3775 [0,0,0,0,0,0|2,0,2]=4 5 B4R0.1 C=C(F)CO PC49591 [0,0,0,0,0,0|2,0,2]=4 6 B4R0.1 CC(=O)CF PC3356 [0,0,0,0,0,0|1,0,1]=2 7 B4R0.1 CC(=O)NO BIA1030 [0,0,0,0,0,0|2,0,0]=2 8 B4R0.1 CC(C)[Mg]Br OR320104 [0,0,0,0,0,0|3,0,1]=4 9 B4R0.1 CC(C)[Mg]Cl OR320108 [0,0,0,0,0,0|3,0,1]=4 10 B4R0.1 CC(F)CF PC7149 [0,0,0,0,0,0|2,0,2]=4 11 B4R0.1 CC(F)CO PC1014 [0,0,0,0,0,0|2,0,2]=4 12 B4R0.1 CC(O)CF PC7229 [0,0,0,0,0,0|1,0,3]=4 13 B4R0.1 CC(O)CO OR5249 [0,0,0,0,0,0|1,0,3]=4 14 B4R0.1 CC=C(F)F PC5668 [0,0,0,0,0,0|3,0,1]=4 15 B4R0.1 CCC(=O)F PC3875 [0,0,0,0,0,0|2,0,1]=3 16 B4R0.1 CCC(C)F PC408041 [0,0,0,0,0,0|2,0,2]=4 17 B4R0.1 CCC(C)N OR5233 [0,0,0,0,0,0|2,0,2]=4 18 B4R0.1 CNC(C)=S OR322821 [0,0,0,0,0,0|2,1,0]=3 19 B4R0.1 CS[S+](C)C PC7613 [0,0,0,0,0,0|4,0,0]=4 20 B4R0.1 C[C@@H](F)CO PC6608 [0,0,0,0,0,0|2,0,2]=4 21 B4R0.1 C[C@@H](O)CO OR307150 [0,0,0,0,0,0|1,0,3]=4 22 B4R0.1 C[C@H](F)CO PC6609 [0,0,0,0,0,0|2,0,2]=4 23 B4R0.1 C[C@H](O)CO OR307151 [0,0,0,0,0,0|1,0,3]=4 24 B4R0.1 C\C(Br)=C/F PC52100 [0,0,0,0,0,0|2,0,1]=3 25 B4R0.1 C\C(F)=C\Cl PC1026 [0,0,0,0,0,0|2,0,1]=3 26 B4R0.1 FC(Cl)=CCl PC2420 [0,0,0,0,0,0|3,0,1]=4 27 B4R0.1 FC(F)=CBr PC1390 [0,0,0,0,0,0|3,0,1]=4 28 B4R0.1 FC(F)=CCl PC1780 [0,0,0,0,0,0|3,0,1]=4 29 B4R0.1 FC=C(Br)Br PC4362 [0,0,0,0,0,0|3,0,1]=4 30 B4R0.1 FC=C(F)Br PC1243 [0,0,0,0,0,0|3,0,1]=4 31 B4R0.1 FC=C(F)Cl PC3774 [0,0,0,0,0,0|3,0,1]=4 32 B4R0.1 FC=C(F)F PC7360 [0,0,0,0,0,0|3,0,1]=4 33 B4R0.1 F\C(Br)=C/Br PC4364 [0,0,0,0,0,0|3,0,1]=4 34 B4R0.1 N#CC(F)F PC4811 [0,0,0,0,0,0|2,0,1]=3 35 B4R0.1 N#CC(F)I PC3637 [0,0,0,0,0,0|2,0,1]=3 36 B4R0.1 NNC(=S)S OR25446 [0,0,0,0,0,0|2,1,1]=4 37 B4R0.1 NNC(N)=O OR1894 [0,0,0,0,0,0|2,0,1]=3 38 B4R0.1 O=C(F)CCl PC2527 [0,0,0,0,0,0|2,0,1]=3 39 B3R0.1 C#CCF PC53334 [1,0,0,0,0,0|2,0,1]=4 40 B3R0.1 C#CC[NH3+] OR27447 [1,0,0,0,0,0|2,0,1]=4 41 B3R0.1 C=CCF PC4179Y [1,0,0,0,0,0|1,0,2]=4 42 B3R0.1 C=C[Mg]Br OR320072 [1,0,0,0,0,0|2,0,1]=4 43 B3R0.1 C=C[Mg]Br OR320073 [1,0,0,0,0,0|2,0,1]=4 44 B3R0.1 CCCF PC0911 [1,0,0,0,0,0|1,0,2]=4 45 B3R0.1 CC[Mg]Br OR320087 [1,0,0,0,0,0|2,0,1]=4 46 B3R0.1 CC[Mg]Br OR320088 [1,0,0,0,0,0|2,0,1]=4 47 B3R0.1 CC[Mg]Br OR320089 [1,0,0,0,0,0|2,0,1]=4 48 B3R0.1 CC[Mg]Br OR320090 [1,0,0,0,0,0|2,0,1]=4 49 B3R0.1 CC[Mg]Br OR320092 [1,0,0,0,0,0|2,0,1]=4 50 B3R0.1 CC[Mg]Br OR320093 [1,0,0,0,0,0|2,0,1]=4 51 B3R0.1 CC[Mg]Cl OR320095 [1,0,0,0,0,0|2,0,1]=4 52 B3R0.1 CC[Mg]Cl OR320096 [1,0,0,0,0,0|2,0,1]=4 53 B3R0.1 CC[Mg]Cl OR320097 [1,0,0,0,0,0|2,0,1]=4 54 B3R0.1 CC[Mg]Cl OR320098 [1,0,0,0,0,0|2,0,1]=4 55 B3R0.1 CC[Mg]Cl OR320099 [1,0,0,0,0,0|2,0,1]=4 56 B3R0.1 C\C=C\F PC52099 [1,0,0,0,0,0|1,0,1]=3 57 B3R0.1 FC=CCl PC1866 [1,0,0,0,0,0|2,0,1]=4 58 B3R0.1 FC=CF PC0287 [1,0,0,0,0,0|2,0,1]=4 59 B3R0.1 F\C=C/Br PC6672 [1,0,0,0,0,0|2,0,1]=4 60 B3R0.1 F\C=C/Cl PC49016 [1,0,0,0,0,0|2,0,1]=4 61 B3R0.1 F\C=C/F PC3792 [1,0,0,0,0,0|2,0,1]=4 62 B3R0.1 F\C=C\Cl PC49015 [1,0,0,0,0,0|2,0,1]=4 63 B3R0.1 F\C=C\F PC52111 [1,0,0,0,0,0|2,0,1]=4 64 B3R0.1 N#CCF PC1550 [1,0,0,0,0,0|1,0,1]=3 65 B3R0.2 C=C(C)F PC2703 [1,0,0,0,0,0|1,0,1]=3 66 B3R0.2 C=C(F)Br PC9606 [1,0,0,0,0,0|2,0,1]=4 67 B3R0.2 C=C(F)Cl PC1865 [1,0,0,0,0,0|2,0,1]=4 68 B3R0.2 C=C(F)F PC2810 [1,0,0,0,0,0|2,0,1]=4 69 B3R0.2 CC(C)F PC4179T [1,0,0,0,0,0|1,0,2]=4 70 B3R0.2 CC(F)F PC2800 [1,0,0,0,0,0|2,0,1]=4 71 B5R0.1 CC(Br)CC#N OR322122 [0,1,0,0,0,0|1,0,1]=3 72 B5R0.1 CC(C)=CC=O OR315230 [0,1,0,0,0,0|2,0,1]=4 73 B5R0.1 CSCS(C)=O OR322205 [0,1,0,0,0,0|2,0,1]=4 74 B5R0.1 C[C@@H](O)CC#N OR304062 [0,1,0,0,0,0|0,0,2]=3 75 B5R0.1 C[C@H](O)CC#N OR304063 [0,1,0,0,0,0|0,0,2]=3 76 B5R0.1 N#CC=C(N)N OR470720 [0,1,0,0,0,0|2,0,0]=3 77 B5R0.3 C#CC(O)CC OR2042 [0,1,0,0,0,0|1,0,2]=4 78 B5R0.3 CC\C(N)=N\O OR346280 [0,1,0,0,0,0|3,0,0]=4 79 B5R0.3 COC(=O)NN OR4850 [0,1,0,0,0,0|1,0,1]=3 80 B5R0.3 C\C=C(\C)[Mg]Br OR320152 [0,1,0,0,0,0|2,0,1]=4 81 B5R0.3 FC=C(F)CF PC6245 [0,1,0,0,0,0|2,0,1]=4 82 B5R0.3 N#CC(Br)CBr OR4898 [0,1,0,0,0,0|1,0,1]=3 83 B5R0.3 NNC(=O)NN OR25882 [0,1,0,0,0,0|2,0,1]=4 84 B5R0.3 N\C(CCl)=N/O OR300912 [0,1,0,0,0,0|3,0,0]=4 85 B5R0.3 O=C(CF)CF PC066 [0,1,0,0,0,0|1,0,1]=3 86 B5R0.3 O=C\C(F)=C\[O-] PC51104 [0,1,0,0,0,0|2,0,1]=4 87 B5R0.4 CC(F)(F)C#N PC56045 [0,1,0,0,0,0|1,0,1]=3 88 B5R0.5 C=C(Cl)C(=O)[O-] OR2895 [0,1,0,0,0,0|2,0,1]=4 89 B5R0.5 C=C(F)C(=O)O PC4962 [0,1,0,0,0,0|2,0,1]=4 90 B5R0.5 CC(=O)C(C)F PC9588 [0,1,0,0,0,0|1,0,1]=3 91 B5R0.5 CC(=O)C(F)F PC1013 [0,1,0,0,0,0|1,0,1]=3 92 B5R0.5 CC(F)C(=O)O PC1057 [0,1,0,0,0,0|2,0,1]=4 93 B5R0.5 NC(=O)C(F)Br PC9604 [0,1,0,0,0,0|2,0,1]=4 94 B5R0.5 NC(=O)C(F)Cl PC4293 [0,1,0,0,0,0|2,0,1]=4 95 B5R0.5 NC(=O)C(F)F PC4051 [0,1,0,0,0,0|2,0,1]=4 96 B5R0.5 NC(=O)C(F)I PC5583 [0,1,0,0,0,0|2,0,1]=4 97 B5R0.5 O=C(Cl)C(F)Cl PC4216 [0,1,0,0,0,0|2,0,1]=4 98 B5R0.5 O=C(Cl)C(F)F PC9051 [0,1,0,0,0,0|2,0,1]=4 99 B5R0.5 O=C(F)C(=O)F PC5364 [0,1,0,0,0,0|2,0,1]=4 100 B5R0.5 O=C(O)C(F)Br PC6862 [0,1,0,0,0,0|2,0,1]=4 101 B5R0.5 O=C(O)C(F)Cl PC1148 [0,1,0,0,0,0|2,0,1]=4 102 B5R0.5 O=C(O)C(F)F PC2570 [0,1,0,0,0,0|2,0,1]=4 103 B5R0.5 O=C(O)C(F)I PC0992 [0,1,0,0,0,0|2,0,1]=4 104 B5R0.5 O=C([O-])C(F)Br PC3375 [0,1,0,0,0,0|2,0,1]=4 105 B5R0.5 O=C([O-])C(F)Cl PC3376 [0,1,0,0,0,0|2,0,1]=4 106 B5R0.5 O=C([O-])C(F)F PC408095 [0,1,0,0,0,0|2,0,1]=4 107 B5R0.5 O=C([O-])C(F)F PC5514 [0,1,0,0,0,0|2,0,1]=4 108 B5R0.5 O=C([O-])C(F)I PC3377 [0,1,0,0,0,0|2,0,1]=4 109 B5R1.2 C=C1CCO1 OR309087 [0,0,0,1,0,0|3,0,0]=4 110 B5R1.2 O=C1CSC1 OR312059 [0,0,0,1,0,0|1,0,1]=3 111 B2R0.1 C=CF PC8000 [2,0,0,0,0,0|1,0,1]=4 112 B2R0.1 CCF PC3206 [2,0,0,0,0,0|1,0,1]=4 113 B2R0.1 COC PC48443 [2,0,0,0,0,0|1,0,1]=4 114 B2R0.1 C[Mg]Br OR320079 [2,0,0,0,0,0|2,0,0]=4 115 B2R0.1 C[Mg]Br OR320080 [2,0,0,0,0,0|2,0,0]=4 116 B2R0.1 C[Mg]Br OR320081 [2,0,0,0,0,0|2,0,0]=4 117 B2R0.1 C[Mg]Br OR320082 [2,0,0,0,0,0|2,0,0]=4 118 B2R0.1 C[Mg]Cl OR320083 [2,0,0,0,0,0|2,0,0]=4 119 B2R0.1 C[Mg]Cl OR320085 [2,0,0,0,0,0|2,0,0]=4 120 B2R0.1 C[Mg]I OR320076 [2,0,0,0,0,0|2,0,0]=4 121 B4R0.2 CNCC#N OR322050 [1,1,0,0,0,0|0,0,1]=3 122 B4R0.2 C\C=C\CC OR8524 [1,1,0,0,0,0|1,0,1]=4 123 B4R0.2 C\C=C\[Mg]Br OR320151 [1,1,0,0,0,0|1,0,1]=4 124 B4R0.2 ClC=CCCl OR1948 [1,1,0,0,0,0|1,0,1]=4 125 B4R0.2 F\C=C\CF PC5737 [1,1,0,0,0,0|1,0,1]=4 126 B4R0.2 OCC#CBr OR52343 [1,1,0,0,0,0|1,0,1]=4 127 B6R0.1 C#CC(=O)NCC OR315229 [0,2,0,0,0,0|1,0,0]=3 128 B6R0.1 CCC(C)SC#N OR1959 [0,2,0,0,0,0|1,0,1]=4 129 B6R0.1 CCCC(N)C#N OR322614 [0,2,0,0,0,0|1,0,1]=4 130 B6R0.1 CCOC(=O)CCl OR322004 [0,2,0,0,0,0|1,0,1]=4 131 B6R0.2 CC(=O)OC(C)Cl OR311234 [0,2,0,0,0,0|1,0,1]=4 132 B6R0.3 C=C(F)C(=O)OC PC4967 [0,2,0,0,0,0|1,0,1]=4 133 B6R0.3 CCC(=O)C(F)F PC450496 [0,2,0,0,0,0|1,0,1]=4 134 B6R0.3 CN(C)C(=O)CCl OR49017 [0,2,0,0,0,0|1,0,1]=4 135 B6R0.3 CNC(=O)C(F)Br PC5594 [0,2,0,0,0,0|1,0,1]=4 136 B6R0.3 CNC(=O)C(F)Cl PC5596 [0,2,0,0,0,0|1,0,1]=4 137 B6R0.3 CNC(=O)C(F)I PC5599 [0,2,0,0,0,0|1,0,1]=4 138 B6R0.3 COC(=O)C(C)C OR323296 [0,2,0,0,0,0|1,0,1]=4 139 B6R0.3 COC(=O)C(C)F PC19689 [0,2,0,0,0,0|1,0,1]=4 140 B6R0.3 COC(=O)C(F)F PC5075 [0,2,0,0,0,0|1,0,1]=4 141 B6R0.3 COC(=O)[C@@H](C)Cl OR322358 [0,2,0,0,0,0|1,0,1]=4 142 B6R0.3 COC(=O)[C@@H](C)F PC450159 [0,2,0,0,0,0|1,0,1]=4 143 B6R0.3 COC(=O)[C@H](C)F PC450044 [0,2,0,0,0,0|1,0,1]=4 144 B6R0.3 O=C([O-])C(=O)CF PC4205 [0,2,0,0,0,0|1,0,1]=4 145 B6R0.4 CC(=O)OCC=O OR30432 [0,2,0,0,0,0|1,0,1]=4 146 B6R0.4 CC(C)NCC#N OR25099 [0,2,0,0,0,0|1,0,1]=4 147 B6R0.7 CC(=O)C(F)(F)Cl PC450267 [0,2,0,0,0,0|1,0,1]=4 148 B6R0.7 CC(=O)C(F)(F)F PC7180 [0,2,0,0,0,0|1,0,1]=4 149 B6R1.2 O=C1C=CSC1 OR200106 [0,1,0,1,0,0|1,0,1]=4 150 B6R1.5 O=C1CC(Br)C1 OR317105 [0,1,0,1,0,0|1,0,1]=4