0 B4R0.1 C#CC(=C)C 1500-1-08 [0,0,0,0,0,0|3,0,1]=4 1 B4R0.1 C#CC(C)=O 2517-1-09 [0,0,0,0,0,0|2,0,1]=3 2 B4R0.1 C#C[C@H](C)O 2502-1-S1 [0,0,0,0,0,0|2,0,2]=4 3 B4R0.1 C=C(Br)C#N 3337-9-01 [0,0,0,0,0,0|3,0,1]=4 4 B4R0.1 C=C(C)C=O 2315-1-10 [0,0,0,0,0,0|3,0,1]=4 5 B4R0.1 C=C(C)CCl 1300-5-37 [0,0,0,0,0,0|2,0,0]=2 6 B4R0.1 C=C(C)CO 2301-1-02 [0,0,0,0,0,0|3,0,0]=3 7 B4R0.1 C=C(C)[Mg]Br 9612-9-08 [0,0,0,0,0,0|3,1,0]=4 8 B4R0.1 C=C(Cl)CBr 1300-D-00 [0,0,0,0,0,0|2,1,0]=3 9 B4R0.1 C=CC(C)O 2302-1-03 [0,0,0,0,0,0|2,0,2]=4 10 B4R0.1 CC(=O)CBr 2117-9-06 [0,0,0,0,0,0|1,1,0]=2 11 B4R0.1 CC(=O)CCl 2117-5-01 [0,0,0,0,0,0|1,0,0]=1 12 B4R0.1 CC(C)=CCl 1300-5-X3 [0,0,0,0,0,0|2,0,1]=3 13 B4R0.1 CC(C)CBr 1100-9-20 [0,0,0,0,0,0|2,1,1]=4 14 B4R0.1 CC(C)CI 1100-H-12 [0,0,0,0,0,0|2,1,1]=4 15 B4R0.1 CC(C)CN 3133-5-08 [0,0,0,0,0,0|3,0,1]=4 16 B4R0.1 CC(C)CO 2101-1-21 [0,0,0,0,0,0|3,0,1]=4 17 B4R0.1 CC(F)CF 1100-3-15 [0,0,0,0,0,0|2,1,1]=4 18 B4R0.1 CC(F)CI 1100-K-81 [0,0,0,0,0,0|2,1,1]=4 19 B4R0.1 CC(O)CBr 2102-9-00 [0,0,0,0,0,0|1,1,1]=3 20 B4R0.1 CC=C(F)F 1300-3-95 [0,0,0,0,0,0|3,0,1]=4 21 B4R0.1 CCC(=O)Br 2116-9-08 [0,0,0,0,0,0|2,0,0]=2 22 B4R0.1 CCC(=O)F 2116-3-02 [0,0,0,0,0,0|2,0,0]=2 23 B4R0.1 CCC(=O)[O-] 2122-1-08 [0,0,0,0,0,0|1,0,1]=2 24 B4R0.1 CCC(C)Br 1100-9-X1 [0,0,0,0,0,0|3,0,1]=4 25 B4R0.1 CCC(C)C 1100-1-20 [0,0,0,0,0,0|3,0,1]=4 26 B4R0.1 CCC(C)N 3130-1-05 [0,0,0,0,0,0|3,0,1]=4 27 B4R0.1 CCC(C)S 5161-1-04 [0,0,0,0,0,0|2,1,1]=4 28 B4R0.1 CCC(F)F 1100-3-14 [0,0,0,0,0,0|3,0,1]=4 29 B4R0.1 CNC(=N)N 3141-5-07 [0,0,0,0,0,0|4,0,0]=4 30 B4R0.1 COC(=O)Cl 2123-5-04 [0,0,0,0,0,0|3,0,0]=3 31 B4R0.1 COC(C)=N 4156-5-0G [0,0,0,0,0,0|4,0,0]=4 32 B4R0.1 COC(N)=O 4156-1-X6 [0,0,0,0,0,0|3,0,0]=3 33 B4R0.1 C[C@@H](F)CO 2101-3-R1 [0,0,0,0,0,0|3,0,1]=4 34 B4R0.1 C[C@H](F)CO 2101-3-S1 [0,0,0,0,0,0|3,0,1]=4 35 B4R0.1 C[C@H](N)CN 3130-5-08 [0,0,0,0,0,0|3,0,1]=4 36 B4R0.1 C[N+](C)=CCl 3135-5-02 [0,0,0,0,0,0|3,0,1]=4 37 B4R0.1 C\C(F)=C\Cl 1300-7-60 [0,0,0,0,0,0|2,0,1]=3 38 B4R0.1 FC(Br)CBr 1100-B-09 [0,0,0,0,0,0|2,1,1]=4 39 B4R0.1 FC(F)=CBr 1300-B-01 [0,0,0,0,0,0|2,1,1]=4 40 B4R0.1 FC(F)=CCl 1300-7-01 [0,0,0,0,0,0|2,0,1]=3 41 B4R0.1 FC(F)=CI 1300-K-00 [0,0,0,0,0,0|2,1,1]=4 42 B4R0.1 FC(F)CCl 1100-7-09 [0,0,0,0,0,0|2,0,1]=3 43 B4R0.1 FC=C(Br)Br 1300-B-44 [0,0,0,0,0,0|2,1,1]=4 44 B4R0.1 FC=C(Cl)Cl 1300-7-20 [0,0,0,0,0,0|2,1,1]=4 45 B4R0.1 FC=C(F)F 1300-3-05 [0,0,0,0,0,0|2,1,1]=4 46 B4R0.1 FCC(F)Cl 1100-7-48 [0,0,0,0,0,0|2,1,1]=4 47 B4R0.1 FCC(F)F 1100-3-08 [0,0,0,0,0,0|2,1,1]=4 48 B4R0.1 F\C(Br)=C/Br 1300-B-31 [0,0,0,0,0,0|2,1,1]=4 49 B4R0.1 F\C(Cl)=C/Cl 1300-7-E0 [0,0,0,0,0,0|2,0,1]=3 50 B4R0.1 F\C(Cl)=C\Cl 1300-7-02 [0,0,0,0,0,0|2,0,1]=3 51 B4R0.1 F\C(Cl)=C\Cl 1300-7-Z1 [0,0,0,0,0,0|2,0,1]=3 52 B4R0.1 F\C=C(/F)Cl 1300-7-E2 [0,0,0,0,0,0|2,1,1]=4 53 B4R0.1 F\C=C(/F)I 1300-K-E0 [0,0,0,0,0,0|2,1,1]=4 54 B4R0.1 F\C=C(\F)Cl 1300-7-08 [0,0,0,0,0,0|2,1,1]=4 55 B4R0.1 F\C=C(\F)Cl 1300-7-Z2 [0,0,0,0,0,0|2,1,1]=4 56 B4R0.1 F\C=C(\F)I 1300-K-Z0 [0,0,0,0,0,0|2,1,1]=4 57 B4R0.1 N=C(N)NN 4141-5-00 [0,0,0,0,0,0|4,0,0]=4 58 B4R0.1 NC(=O)CI 4146-H-X0 [0,0,0,0,0,0|1,1,0]=2 59 B4R0.1 NC(=O)CO 4156-1-48 [0,0,0,0,0,0|2,0,0]=2 60 B4R0.1 NC(=O)CS 8161-1-X0 [0,0,0,0,0,0|2,0,0]=2 61 B4R0.1 NC(=O)NO 4153-1-05 [0,0,0,0,0,0|3,0,0]=3 62 B4R0.1 NCC(N)=O 4148-1-0D [0,0,0,0,0,0|2,0,0]=2 63 B4R0.1 NNC(=S)S 7167-1-28 [0,0,0,0,0,0|2,2,0]=4 64 B4R0.1 NNC(N)=O 4153-5-01 [0,0,0,0,0,0|3,0,0]=3 65 B4R0.1 O=C(Cl)CBr 2116-D-X2 [0,0,0,0,0,0|1,1,0]=2 66 B4R0.1 O=C(F)CCl 2116-7-X0 [0,0,0,0,0,0|1,0,0]=1 67 B4R0.1 O=C([O-])CS 6161-1-X1 [0,0,0,0,0,0|1,0,1]=2 68 B4R0.1 [C@@H](C)(O)CC 2101-1-S1 [0,0,0,0,0,0|2,0,1]=3 69 B3R0.1 C#CC=C 1500-1-06 [1,0,0,0,0,0|2,0,1]=4 70 B3R0.1 C#CCBr 1500-9-X0 [1,0,0,0,0,0|1,1,1]=4 71 B3R0.1 C#CCCl 1500-5-04 [1,0,0,0,0,0|1,0,1]=3 72 B3R0.1 C#CCF 1500-3-09 [1,0,0,0,0,0|1,1,1]=4 73 B3R0.1 C#CC[NH3+] 3533-5-01 [1,0,0,0,0,0|2,0,1]=4 74 B3R0.1 C=C=CC 1300-1-23 [1,0,0,0,0,0|2,0,1]=4 75 B3R0.1 C=CC=C 1300-1-X0 [1,0,0,0,0,0|2,0,1]=4 76 B3R0.1 C=C[Mg]Br 9312-9-02 [1,0,0,0,0,0|2,1,0]=4 77 B3R0.1 C=C[Mg]Cl 9312-5-04 [1,0,0,0,0,0|2,0,0]=3 78 B3R0.1 CCCF 1100-3-12 [1,0,0,0,0,0|1,1,1]=4 79 B3R0.1 CCCN 3130-1-16 [1,0,0,0,0,0|2,0,1]=4 80 B3R0.1 CCNC 3131-1-02 [1,0,0,0,0,0|3,0,0]=4 81 B3R0.1 CC[Mg]Br 9112-9-0B [1,0,0,0,0,0|3,0,0]=4 82 B3R0.1 CC[Mg]Br 9612-9-0A [1,0,0,0,0,0|3,0,0]=4 83 B3R0.1 CC[Mg]Br 9612-9-0B [1,0,0,0,0,0|3,0,0]=4 84 B3R0.1 CC[Mg]Br 9612-9-0C [1,0,0,0,0,0|3,0,0]=4 85 B3R0.1 CC[Mg]Br 9612-9-0D [1,0,0,0,0,0|3,0,0]=4 86 B3R0.1 CC[Mg]Br 9612-9-0E [1,0,0,0,0,0|3,0,0]=4 87 B3R0.1 CC[Mg]Cl 9112-5-0V [1,0,0,0,0,0|2,0,1]=4 88 B3R0.1 CC[Mg]Cl 9112-5-0W [1,0,0,0,0,0|2,0,1]=4 89 B3R0.1 CC[Mg]Cl 9212-5-00 [1,0,0,0,0,0|2,0,1]=4 90 B3R0.1 CC[Mg]Cl 9212-5-01 [1,0,0,0,0,0|2,0,1]=4 91 B3R0.1 CNC=O 4248-1-0C [1,0,0,0,0,0|2,0,0]=3 92 B3R0.1 COC=O 2123-1-1L [1,0,0,0,0,0|2,0,0]=3 93 B3R0.1 C\C=C/Cl 1300-5-Z1 [1,0,0,0,0,0|1,0,1]=3 94 B3R0.1 C\C=C\Br 1300-9-23 [1,0,0,0,0,0|1,1,1]=4 95 B3R0.1 C\C=C\C 1300-1-E4 [1,0,0,0,0,0|2,0,1]=4 96 B3R0.1 C\C=C\C 1300-1-E4HP [1,0,0,0,0,0|2,0,1]=4 97 B3R0.1 C\C=C\F 1300-3-E1 [1,0,0,0,0,0|1,1,1]=4 98 B3R0.1 ClCCBr 1100-D-03 [1,0,0,0,0,0|1,0,1]=3 99 B3R0.1 Cl\C=C/Cl 1300-5-12 [1,0,0,0,0,0|1,0,1]=3 100 B3R0.1 FCCF 1100-3-06 [1,0,0,0,0,0|1,1,1]=4 101 B3R0.1 F\C=C/Br 1300-B-22 [1,0,0,0,0,0|1,1,1]=4 102 B3R0.1 F\C=C/Cl 1300-7-Z4 [1,0,0,0,0,0|1,0,1]=3 103 B3R0.1 F\C=C\Cl 1300-7-04 [1,0,0,0,0,0|1,0,1]=3 104 B3R0.1 ICCI 1100-H-Y0 [1,0,0,0,0,0|1,1,1]=4 105 B3R0.1 N#CCCl 3137-5-06 [1,0,0,0,0,0|1,0,1]=3 106 B3R0.1 N#CCF 3137-3-X1 [1,0,0,0,0,0|1,1,1]=4 107 B3R0.1 N#CCI 3137-H-00 [1,0,0,0,0,0|1,1,1]=4 108 B3R0.1 NCCCl 3130-5-01S [1,0,0,0,0,0|1,0,1]=3 109 B3R0.1 NCCO 4156-5-08 [1,0,0,0,0,0|1,0,1]=3 110 B3R0.1 NCCS 7161-1-00 [1,0,0,0,0,0|1,1,1]=4 111 B3R0.1 N\C=N\O 4147-1-X2 [1,0,0,0,0,0|2,0,1]=4 112 B3R0.1 O=CCCl 2115-5-X1 [1,0,0,0,0,0|0,0,0]=1 113 B3R0.1 OCCS 6161-1-01 [1,0,0,0,0,0|1,0,1]=3 114 B3R0.2 C=C(C)Br 1300-9-22 [1,0,0,0,0,0|2,0,0]=3 115 B3R0.2 C=C(C)C 1300-1-06SD [1,0,0,0,0,0|2,0,0]=3 116 B3R0.2 C=C(C)C 1300-1-06ST [1,0,0,0,0,0|2,0,0]=3 117 B3R0.2 C=C(C)F 1300-3-29 [1,0,0,0,0,0|2,0,0]=3 118 B3R0.2 C=C(F)Br 1300-B-21 [1,0,0,0,0,0|2,0,1]=4 119 B3R0.2 C=C(F)F 1300-3-06 [1,0,0,0,0,0|2,0,1]=4 120 B3R0.2 CC(=N)N 3141-5-02 [1,0,0,0,0,0|2,0,0]=3 121 B3R0.2 CC(=O)F 2116-3-01 [1,0,0,0,0,0|1,0,0]=2 122 B3R0.2 CC(=O)I 2116-H-00 [1,0,0,0,0,0|1,0,0]=2 123 B3R0.2 CC(=O)O 4156-1-Y2 [1,0,0,0,0,0|0,0,0]=1 124 B3R0.2 CC(=O)[O-] 2122-1-04 [1,0,0,0,0,0|0,0,1]=2 125 B3R0.2 CC(=O)[O-] 2122-1-05 [1,0,0,0,0,0|0,0,1]=2 126 B3R0.2 CC(=O)[O-] 2122-1-63M [1,0,0,0,0,0|0,0,1]=2 127 B3R0.2 CC(=O)[O-] 2122-1-X2 [1,0,0,0,0,0|0,0,1]=2 128 B3R0.2 CC(=O)[O-] 4122-1-02 [1,0,0,0,0,0|0,0,1]=2 129 B3R0.2 CC(=O)[O-] 5522-1-00 [1,0,0,0,0,0|0,0,1]=2 130 B3R0.2 CC(=O)[O-] 9130-1-02 [1,0,0,0,0,0|0,0,1]=2 131 B3R0.2 CC(C)F 1100-3-13 [1,0,0,0,0,0|2,0,1]=4 132 B3R0.2 CC(C)[O-] 2105-1-12 [1,0,0,0,0,0|1,0,2]=4 133 B3R0.2 CC(C)[O-] 2105-1-13 [1,0,0,0,0,0|1,0,2]=4 134 B3R0.2 CC(C)[O-] 2105-1-14 [1,0,0,0,0,0|1,0,2]=4 135 B3R0.2 CC(F)Cl 1100-7-04 [1,0,0,0,0,0|2,0,1]=4 136 B3R0.2 CN(C)N 3139-1-02 [1,0,0,0,0,0|3,0,0]=4 137 B3R0.2 CS(C)=O 6165-1-00 [1,0,0,0,0,0|2,0,0]=3 138 B3R0.2 CS(C)=O 6165-1-02USP [1,0,0,0,0,0|2,0,0]=3 139 B3R0.2 C[13C](=O)O 2121-1-Y0 [1,0,0,0,0,0|0,0,0]=1 140 B3R0.2 C[PH](C)=O 6174-1-01 [1,0,0,0,0,0|2,0,0]=3 141 B3R0.2 C[SiH](C)C 5180-1-03 [1,0,0,0,0,0|2,1,0]=4 142 B3R0.2 ClB(Cl)Cl M005-4-01SD [1,0,0,0,0,0|3,0,0]=4 143 B3R0.2 ClB(Cl)Cl M005-4-01ST [1,0,0,0,0,0|3,0,0]=4 144 B3R0.2 ClB(Cl)Cl M005-4-01ST1 [1,0,0,0,0,0|3,0,0]=4 145 B3R0.2 Cl[Sb](Cl)Cl M051-4-03 [1,0,0,0,0,0|3,0,0]=4 146 B3R0.2 N=C(N)N 4141-1-02 [1,0,0,0,0,0|3,0,0]=4 147 B3R0.2 NC(N)=O 4153-3-00 [1,0,0,0,0,0|2,0,0]=3 148 B3R0.2 O=C([O-])[O-] M037-0-02 [1,0,0,0,0,0|1,0,1]=3 149 B3R0.2 O=C([O-])[O-] M062-1-01 [1,0,0,0,0,0|1,0,1]=3 150 B3R0.2 O=S(Cl)Cl M016-4-01 [1,0,0,0,0,0|2,0,0]=3 151 B3R0.2 O=[N+]([O-])[O-] 9063-0-00 [1,0,0,0,0,0|2,0,1]=4 152 B3R0.2 O=[N+]([O-])[O-] M037-0-03 [1,0,0,0,0,0|2,0,1]=4 153 B3R0.2 O=[N+]([O-])[O-] M045-0-02 [1,0,0,0,0,0|2,0,1]=4 154 B3R0.2 O=[N+]([O-])[O-] M049-1-00 [1,0,0,0,0,0|2,0,1]=4 155 B3R0.2 O=[N+]([O-])[O-] M062-1-02 [1,0,0,0,0,0|2,0,1]=4 156 B3R0.2 O=[N+]([O-])[O-] M065-1-01 [1,0,0,0,0,0|2,0,1]=4 157 B3R0.2 [BH3-]C(=O)[O-] 6160-1-02 [1,0,0,0,0,0|1,0,1]=3 158 B3R0.2 [BH3-]C(=O)[O-] 6160-1-04 [1,0,0,0,0,0|1,0,1]=3 159 B5R0.1 C=C(Br)CCC 1300-9-18 [0,1,0,0,0,0|3,0,0]=4 160 B5R0.1 C=C(Br)CCO 2301-9-00 [0,1,0,0,0,0|3,0,0]=4 161 B5R0.1 C=C(C)C[Mg]Cl 9312-5-03 [0,1,0,0,0,0|2,0,0]=3 162 B5R0.1 C=CCC(=O)Cl 2316-5-09 [0,1,0,0,0,0|2,0,0]=3 163 B5R0.1 C=CC[C@H](C)O 2302-1-S0 [0,1,0,0,0,0|2,0,1]=4 164 B5R0.1 C=CNC(C)=O 4348-1-09 [0,1,0,0,0,0|2,0,1]=4 165 B5R0.1 CC(=O)NCO 4148-1-29 [0,1,0,0,0,0|2,0,0]=3 166 B5R0.1 CC(C)C[Mg]Cl 9112-5-0S [0,1,0,0,0,0|2,0,1]=4 167 B5R0.1 CC(C)C[Mg]Cl 9112-5-0T [0,1,0,0,0,0|2,0,1]=4 168 B5R0.1 CC(C)C[Mg]Cl 9112-5-0U [0,1,0,0,0,0|2,0,1]=4 169 B5R0.1 CC(O)CC#N 4137-1-X8 [0,1,0,0,0,0|2,0,1]=4 170 B5R0.1 CCC=C(F)F 1300-3-52 [0,1,0,0,0,0|3,0,0]=4 171 B5R0.1 CCNC(C)=O 4148-1-22 [0,1,0,0,0,0|2,0,0]=3 172 B5R0.1 CCOC(=O)Cl 2123-5-02 [0,1,0,0,0,0|2,0,0]=3 173 B5R0.1 CCOC(C)=N 4147-5-08 [0,1,0,0,0,0|3,0,0]=4 174 B5R0.1 CCSC(C)=O 6166-1-0D [0,1,0,0,0,0|2,0,0]=3 175 B5R0.1 COC[C@H](C)O 2607-1-20 [0,1,0,0,0,0|2,0,1]=4 176 B5R0.1 CSCS(C)=O 6165-1-08 [0,1,0,0,0,0|3,0,0]=4 177 B5R0.1 C[C@H](O)CCO 2104-1-S0 [0,1,0,0,0,0|2,0,1]=4 178 B5R0.1 C\C=C\C(=O)Cl 2316-5-08 [0,1,0,0,0,0|2,0,1]=4 179 B5R0.1 ClCCC(Cl)Cl 1100-5-13 [0,1,0,0,0,0|2,0,1]=4 180 B5R0.1 FCC=C(F)F 1300-3-63 [0,1,0,0,0,0|2,1,0]=4 181 B5R0.1 F\C(Cl)=C\CCl 1300-7-X4 [0,1,0,0,0,0|2,0,0]=3 182 B5R0.1 N#CCC(=O)[O-] 2137-1-00 [0,1,0,0,0,0|1,0,1]=3 183 B5R0.1 NCCC(=O)O 4157-1-00 [0,1,0,0,0,0|1,0,0]=2 184 B5R0.1 O=C(O)CCCl 2121-5-08 [0,1,0,0,0,0|0,0,0]=1 185 B5R0.1 O=C(O)CCF 2121-3-40 [0,1,0,0,0,0|0,1,0]=2 186 B5R0.1 O=C(O)CCI 2121-H-02 [0,1,0,0,0,0|0,1,0]=2 187 B5R0.1 O=C(O)CCO 2129-1-06 [0,1,0,0,0,0|1,0,0]=2 188 B5R0.1 O=C(O)CCS 6161-1-02 [0,1,0,0,0,0|1,0,0]=2 189 B5R0.1 O=C(O)\C=C/Br 2321-9-Z0 [0,1,0,0,0,0|0,1,1]=3 190 B5R0.1 O=C(O)\C=C\Cl 2321-5-E1 [0,1,0,0,0,0|0,0,1]=2 191 B5R0.1 O=C(O)\C=C\I 2321-H-00 [0,1,0,0,0,0|0,1,1]=3 192 B5R0.1 O=[N+]([O-])CCO 4154-1-02 [0,1,0,0,0,0|2,0,1]=4 193 B5R0.1 OCC=C(F)F 2301-3-12 [0,1,0,0,0,0|3,0,0]=4 194 B5R0.3 C=CC(=O)CC 2317-1-06 [0,1,0,0,0,0|2,0,0]=3 195 B5R0.3 C=CC(=O)OC 2324-1-01 [0,1,0,0,0,0|1,0,1]=3 196 B5R0.3 C=CC(O)CO 2304-1-01 [0,1,0,0,0,0|2,0,1]=4 197 B5R0.3 CC(CCl)CBr 1100-D-05 [0,1,0,0,0,0|2,0,1]=4 198 B5R0.3 CCC(=N)NO 4147-5-06 [0,1,0,0,0,0|2,0,0]=3 199 B5R0.3 CCC(=O)C#N 4137-1-04 [0,1,0,0,0,0|2,0,0]=3 200 B5R0.3 CCC(=O)CC 2117-1-19 [0,1,0,0,0,0|2,0,0]=3 201 B5R0.3 CCC(C)OC 2107-1-18 [0,1,0,0,0,0|2,0,1]=4 202 B5R0.3 CCC(O)C#N 4137-1-07 [0,1,0,0,0,0|2,0,1]=4 203 B5R0.3 CCC(O)CC 2102-1-04 [0,1,0,0,0,0|2,0,1]=4 204 B5R0.3 CC[C@@H](O)CO 2104-1-X1 [0,1,0,0,0,0|1,0,2]=4 205 B5R0.3 CNC(=O)CBr 4148-9-09 [0,1,0,0,0,0|1,1,0]=3 206 B5R0.3 C\C=C(/C)C=O 2315-1-02 [0,1,0,0,0,0|2,0,1]=4 207 B5R0.3 F\C=C(/F)CF 1300-3-93 [0,1,0,0,0,0|2,1,0]=4 208 B5R0.3 NC[C@@H](O)CO 4156-1-RA [0,1,0,0,0,0|1,0,2]=4 209 B5R0.3 NC[C@H](O)CO 4156-1-S3 [0,1,0,0,0,0|1,0,2]=4 210 B5R0.3 NNC(=O)CO 4148-1-43 [0,1,0,0,0,0|2,0,0]=3 211 B5R0.3 NNC(=O)CS 8161-1-02 [0,1,0,0,0,0|2,0,0]=3 212 B5R0.3 NNC(=O)NN 4156-1-57 [0,1,0,0,0,0|3,0,0]=4 213 B5R0.3 N\C(CCl)=N/O 4147-5-00 [0,1,0,0,0,0|1,0,0]=2 214 B5R0.3 O=C(CCl)CCl 2117-5-00 [0,1,0,0,0,0|1,0,0]=2 215 B5R0.3 O=C[C@@H](O)CO 2115-1-S0 [0,1,0,0,0,0|1,0,1]=3 216 B5R0.3 O=C\C(F)=C\[O-] 2315-3-X0 [0,1,0,0,0,0|2,0,1]=4 217 B5R0.3 OC(CF)CBr 2102-B-X0 [0,1,0,0,0,0|1,1,1]=4 218 B5R0.3 OCC(Br)CBr 2101-9-05 [0,1,0,0,0,0|1,1,1]=4 219 B5R0.3 OCC(O)CF 2104-3-27 [0,1,0,0,0,0|0,1,2]=4 220 B5R0.3 OC[C@@H](O)CCl 2104-5-R0 [0,1,0,0,0,0|0,0,2]=3 221 B5R0.3 OC[C@H](O)CCl 2104-5-S0 [0,1,0,0,0,0|0,0,2]=3 222 B5R0.4 C=CP(=O)(O)O 6377-1-24 [0,1,0,0,0,0|2,0,1]=4 223 B5R0.4 CC(C)(O)CCl 2103-5-01 [0,1,0,0,0,0|1,0,1]=3 224 B5R0.4 CC(C)(O)CF 2103-3-0C [0,1,0,0,0,0|1,1,1]=4 225 B5R0.4 CC(Cl)(Cl)CCl 1100-5-24 [0,1,0,0,0,0|2,0,1]=4 226 B5R0.4 C[Si](C)(Cl)CCl 5181-5-00 [0,1,0,0,0,0|2,1,0]=4 227 B5R0.4 C[Si](Cl)(Cl)CCl 5181-5-15 [0,1,0,0,0,0|2,1,0]=4 228 B5R0.4 ClC[Si](Cl)(Cl)Cl 5181-5-16 [0,1,0,0,0,0|2,1,0]=4 229 B5R0.4 F[B-](F)(F)CCl 5160-7-00 [0,1,0,0,0,0|3,0,0]=4 230 B5R0.4 O=S(=O)(Cl)CF 6162-7-07 [0,1,0,0,0,0|1,1,1]=4 231 B5R0.5 C=C(Br)C(C)C 1300-9-15 [0,1,0,0,0,0|3,0,0]=4 232 B5R0.5 C=C(C)C(=O)Cl 2316-5-02 [0,1,0,0,0,0|2,0,1]=4 233 B5R0.5 C=C(C)C(=O)O 2321-1-02 [0,1,0,0,0,0|1,0,1]=3 234 B5R0.5 C=C(Cl)C(=O)[O-] 2322-5-14 [0,1,0,0,0,0|0,0,2]=3 235 B5R0.5 C=C(F)C(F)F 1300-3-60 [0,1,0,0,0,0|2,1,0]=4 236 B5R0.5 CC(=O)C(=O)[O-] 2122-1-14 [0,1,0,0,0,0|1,0,2]=4 237 B5R0.5 CC(=O)C(C)Br 2117-9-04 [0,1,0,0,0,0|1,1,0]=3 238 B5R0.5 CC(Br)C(=O)Br 2116-9-02 [0,1,0,0,0,0|1,1,0]=3 239 B5R0.5 CC(Br)C(=O)Cl 2116-D-X1 [0,1,0,0,0,0|1,1,0]=3 240 B5R0.5 CC(Br)C(=O)O 2121-9-13 [0,1,0,0,0,0|0,1,0]=2 241 B5R0.5 CC(C)C(=O)Br 2116-9-0B [0,1,0,0,0,0|2,0,0]=3 242 B5R0.5 CC(C)C(N)=S 7167-1-39 [0,1,0,0,0,0|2,1,0]=4 243 B5R0.5 CC(C)S(=O)[O-] 6165-1-03 [0,1,0,0,0,0|2,0,1]=4 244 B5R0.5 CN(C)C(=O)Cl 4148-5-17 [0,1,0,0,0,0|3,0,0]=4 245 B5R0.5 CN(C)C(N)=O 4153-1-03 [0,1,0,0,0,0|3,0,0]=4 246 B5R0.5 C[C@@H](Br)C(=O)O 2121-9-R0 [0,1,0,0,0,0|0,1,0]=2 247 B5R0.5 C[C@@H](O)C(=O)O 2129-1-R8 [0,1,0,0,0,0|1,0,0]=2 248 B5R0.5 C[C@@H](O)C(F)F 2102-3-R2 [0,1,0,0,0,0|1,1,1]=4 249 B5R0.5 C[C@H](O)C(F)F 2102-3-S2 [0,1,0,0,0,0|1,1,1]=4 250 B5R0.5 FC(Cl)C(F)Cl 1100-7-41 [0,1,0,0,0,0|2,0,1]=4 251 B5R0.5 FC(F)=C(Cl)Br 1300-E-03 [0,1,0,0,0,0|2,0,1]=4 252 B5R0.5 F\C(Cl)=C(\F)Cl 1300-6-16 [0,1,0,0,0,0|2,0,1]=4 253 B5R0.5 N=C(N)S(=O)O 8165-1-01 [0,1,0,0,0,0|2,0,1]=4 254 B5R0.5 NC(=O)C(=O)O 4157-1-60 [0,1,0,0,0,0|1,0,1]=3 255 B5R0.5 O=C(Br)C(=O)Br 2116-8-00 [0,1,0,0,0,0|1,1,1]=4 256 B5R0.5 O=C(Cl)C(F)Cl 2116-7-X2 [0,1,0,0,0,0|1,0,0]=2 257 B5R0.5 O=C(Cl)C(F)F 2116-7-02 [0,1,0,0,0,0|1,1,0]=3 258 B5R0.5 O=C(F)C(=O)F 2116-2-18 [0,1,0,0,0,0|1,1,1]=4 259 B5R0.5 O=C(F)C(F)Cl 2116-7-X3 [0,1,0,0,0,0|1,0,0]=2 260 B5R0.5 O=C(O)C(=O)O 2122-1-10 [0,1,0,0,0,0|1,0,1]=3 261 B5R0.5 O=C(O)C(=O)O 4H30-1-7V [0,1,0,0,0,0|1,0,1]=3 262 B5R0.5 O=C(O)C(Cl)Cl 2121-5-07 [0,1,0,0,0,0|0,0,0]=1 263 B5R0.5 O=C([O-])C(=O)[O-] M062-1-03 [0,1,0,0,0,0|1,0,2]=4 264 B5R0.5 O=C([O-])C(F)I 2122-K-01 [0,1,0,0,0,0|0,1,1]=3 265 B5R1.2 C=C1CCO1 2H10-1-0Y [0,0,0,1,0,0|2,0,0]=3 266 B5R1.3 CCC1CO1 2109-1-00 [0,0,0,1,0,0|2,0,1]=4 267 B5R1.3 CC[C@H]1CO1 2109-1-S2 [0,0,0,1,0,0|2,0,1]=4 268 B5R1.3 OCC1CO1 2109-1-X0 [0,0,0,1,0,0|2,0,1]=4 269 B5R1.3 [C@@H]1(CC)CO1 2109-1-R1 [0,0,0,1,0,0|2,0,1]=4 270 B5R1.4 CC1OC1C 2109-1-07 [0,0,0,1,0,0|2,0,1]=4 271 B2R0.1 C#CC 1500-1-01SH [2,0,0,0,0,0|1,0,1]=4 272 B2R0.1 C#CC 1500-1-05SD [2,0,0,0,0,0|1,0,1]=4 273 B2R0.1 C#CC 1500-1-05ST [2,0,0,0,0,0|1,0,1]=4 274 B2R0.1 C=C=C 1300-1-03 [2,0,0,0,0,0|1,0,1]=4 275 B2R0.1 C=CCl 1300-5-05 [2,0,0,0,0,0|0,0,1]=3 276 B2R0.1 C=CF 1300-3-01 [2,0,0,0,0,0|0,1,1]=4 277 B2R0.1 CC#N 3137-5-01 [2,0,0,0,0,0|1,0,1]=4 278 B2R0.1 CCF 1100-3-04 [2,0,0,0,0,0|0,1,1]=4 279 B2R0.1 CCN 3130-1-10SM [2,0,0,0,0,0|1,0,1]=4 280 B2R0.1 CCS 5161-1-01 [2,0,0,0,0,0|0,1,1]=4 281 B2R0.1 CC[O-] 2105-1-0B [2,0,0,0,0,0|0,0,2]=4 282 B2R0.1 CC[O-] 2105-1-15 [2,0,0,0,0,0|0,0,2]=4 283 B2R0.1 CC[S-] 5161-1-00 [2,0,0,0,0,0|0,1,1]=4 284 B2R0.1 CNC 7160-1-02 [2,0,0,0,0,0|2,0,0]=4 285 B2R0.1 COC 2107-3-79 [2,0,0,0,0,0|2,0,0]=4 286 B2R0.1 CSC M029-9-00 [2,0,0,0,0,0|2,0,0]=4 287 B2R0.1 C[Mg]Br 9112-9-04 [2,0,0,0,0,0|2,0,0]=4 288 B2R0.1 C[Mg]Br 9112-9-06 [2,0,0,0,0,0|2,0,0]=4 289 B2R0.1 C[Mg]Br 9112-9-07 [2,0,0,0,0,0|2,0,0]=4 290 B2R0.1 C[Mg]Br 9112-9-08 [2,0,0,0,0,0|2,0,0]=4 291 B2R0.1 C[Mg]Br 9612-9-06 [2,0,0,0,0,0|2,0,0]=4 292 B2R0.1 C[Mg]Br 9612-9-07 [2,0,0,0,0,0|2,0,0]=4 293 B2R0.1 C[Mg]Cl 9112-5-0Q [2,0,0,0,0,0|1,0,1]=4 294 B2R0.1 C[Mg]Cl 9112-5-0R [2,0,0,0,0,0|1,0,1]=4 295 B2R0.1 C[Mg]I 9112-H-00 [2,0,0,0,0,0|2,0,0]=4 296 B2R0.1 FCBr 1100-B-00 [2,0,0,0,0,0|1,1,0]=4 297 B2R0.1 FCCl 1100-7-01 [2,0,0,0,0,0|1,0,0]=3 298 B2R0.1 FCI 1100-K-01 [2,0,0,0,0,0|1,1,0]=4 299 B2R0.1 FCI 1100-K-01SAC [2,0,0,0,0,0|1,1,0]=4 300 B2R0.1 N=CN 3135-5-03 [2,0,0,0,0,0|2,0,0]=4 301 B2R0.1 O=[Si]=O M014-0-01 [2,0,0,0,0,0|0,1,1]=4 302 B4R0.2 C=CCC=C 1300-1-27 [1,1,0,0,0,0|2,0,0]=4 303 B4R0.2 C=CCCF 1300-3-77 [1,1,0,0,0,0|1,1,0]=4 304 B4R0.2 C=CCCN 3330-5-02 [1,1,0,0,0,0|2,0,0]=4 305 B4R0.2 C=CCOC 2307-1-06 [1,1,0,0,0,0|2,0,0]=4 306 B4R0.2 C=CCON 4347-5-01 [1,1,0,0,0,0|2,0,0]=4 307 B4R0.2 C=CC[Mg]Br 9312-9-00 [1,1,0,0,0,0|1,1,0]=4 308 B4R0.2 C=CC[Mg]Br 9312-9-06 [1,1,0,0,0,0|1,1,0]=4 309 B4R0.2 C=CC[Mg]Cl 9312-5-00 [1,1,0,0,0,0|1,0,0]=3 310 B4R0.2 C=CC[Mg]Cl 9312-5-05 [1,1,0,0,0,0|1,0,0]=3 311 B4R0.2 CCCCCl 1100-5-32 [1,1,0,0,0,0|1,0,1]=4 312 B4R0.2 CCCCO 2101-1-41N [1,1,0,0,0,0|1,0,1]=4 313 B4R0.2 CCCCO 9122-1-01 [1,1,0,0,0,0|1,0,1]=4 314 B4R0.2 CCCON 4156-5-0J [1,1,0,0,0,0|1,0,1]=4 315 B4R0.2 CCC[Mg]Cl 9112-5-0G [1,1,0,0,0,0|1,0,1]=4 316 B4R0.2 CCC[Mg]Cl 9112-5-0H [1,1,0,0,0,0|1,0,1]=4 317 B4R0.2 COCCI 2107-H-00 [1,1,0,0,0,0|0,1,1]=4 318 B4R0.2 COCCO 2106-1-00 [1,1,0,0,0,0|1,0,1]=4 319 B4R0.2 C\C=C\CCl 1300-5-00 [1,1,0,0,0,0|1,0,0]=3 320 B4R0.2 C\C=C\CCl 1300-5-39 [1,1,0,0,0,0|1,0,0]=3 321 B4R0.2 C\C=C\CO 2301-1-X1 [1,1,0,0,0,0|1,0,1]=4 322 B4R0.2 ClCOCCl 2107-5-04 [1,1,0,0,0,0|1,0,1]=4 323 B4R0.2 F\C=C\CF 1300-3-24 [1,1,0,0,0,0|1,1,0]=4 324 B4R0.2 NOCCF 4147-7-03 [1,1,0,0,0,0|0,1,1]=4 325 B4R0.3 CS(=O)(=O)[O-] 6164-1-21 [1,1,0,0,0,0|1,0,1]=4 326 B4R0.3 C[As](C)(=O)O 9121-1-X0 [1,1,0,0,0,0|1,0,0]=3 327 B4R0.3 C[Sn](C)(C)O 9150-1-00 [1,1,0,0,0,0|2,0,0]=4 328 B4R0.3 O=P([O-])(O)O M015-1-04 [1,1,0,0,0,0|2,0,0]=4 329 B4R0.3 O=S(=O)(O)F M016-3-07 [1,1,0,0,0,0|1,1,0]=4 330 B4R0.3 O=[Se](=O)(O)O M034-1-01 [1,1,0,0,0,0|2,0,0]=4 331 B6R0.1 C#CC(=O)NCC 4548-1-00 [0,2,0,0,0,0|2,0,0]=4 332 B6R0.1 C#CC(=O)OCC 2523-1-X2 [0,2,0,0,0,0|1,0,1]=4 333 B6R0.1 C=COC(=O)C=C 2223-1-10 [0,2,0,0,0,0|1,0,1]=4 334 B6R0.1 CCC(=O)CC#N 4137-1-Y8 [0,2,0,0,0,0|2,0,0]=4 335 B6R0.1 CCNC(=O)CC 4148-1-0X [0,2,0,0,0,0|2,0,0]=4 336 B6R0.1 CCNC(=O)CCl 4148-5-0H [0,2,0,0,0,0|1,0,0]=3 337 B6R0.1 CCOC(=N)CCl 4147-5-0A [0,2,0,0,0,0|1,0,0]=3 338 B6R0.1 CCOC(=O)C#N 4146-1-X0 [0,2,0,0,0,0|1,0,1]=4 339 B6R0.1 CCOC(=O)NC 4156-1-3N [0,2,0,0,0,0|2,0,0]=4 340 B6R0.1 CCOC(=O)NO 4156-1-45 [0,2,0,0,0,0|1,0,0]=3 341 B6R0.1 CCOC(=O)OC 2128-1-05 [0,2,0,0,0,0|1,0,0]=3 342 B6R0.1 CCO\C(C)=N\O 4147-1-09 [0,2,0,0,0,0|2,0,0]=4 343 B6R0.1 CCSC(=O)CC 6166-1-0B [0,2,0,0,0,0|1,1,0]=4 344 B6R0.1 CNC(=O)CCN 4148-5-01 [0,2,0,0,0,0|2,0,0]=4 345 B6R0.1 COC(=O)CCBr 2123-9-0J [0,2,0,0,0,0|0,1,0]=3 346 B6R0.1 COC(=O)CCS 6161-1-04 [0,2,0,0,0,0|1,0,0]=3 347 B6R0.1 COC(=O)OCF 2128-3-H6 [0,2,0,0,0,0|0,1,0]=3 348 B6R0.1 COC(=O)\C=C/Br 2324-9-Z0 [0,2,0,0,0,0|0,1,1]=4 349 B6R0.1 N#CCC(=O)NN 4156-1-X3 [0,2,0,0,0,0|2,0,0]=4 350 B6R0.1 N#CCC(O)CCl 4146-5-00 [0,2,0,0,0,0|1,0,1]=4 351 B6R0.1 N#CC[C@@H](O)CCl 4137-5-R0 [0,2,0,0,0,0|1,0,1]=4 352 B6R0.1 N#CC[C@H](O)CCl 4137-5-S0 [0,2,0,0,0,0|1,0,1]=4 353 B6R0.1 O=C(CCl)NCO 4148-5-08 [0,2,0,0,0,0|0,0,0]=2 354 B6R0.1 O=C=NC(=O)CCl 4149-5-01 [0,2,0,0,0,0|0,0,1]=3 355 B6R0.1 OC(CCl)CCCl 2102-5-00 [0,2,0,0,0,0|1,0,1]=4 356 B6R0.2 CC(=O)OC(C)Br 2123-9-25 [0,2,0,0,0,0|1,1,0]=4 357 B6R0.2 CC(C)CC(=O)O 2121-1-18 [0,2,0,0,0,0|1,0,0]=3 358 B6R0.2 CC(C)NC(N)=O 4153-1-10 [0,2,0,0,0,0|2,0,0]=4 359 B6R0.2 CC(C)OC(N)=O 4156-1-2S [0,2,0,0,0,0|2,0,0]=4 360 B6R0.2 CC(C)SC(=O)Cl 6166-5-00 [0,2,0,0,0,0|2,0,0]=4 361 B6R0.2 CC(Cl)CC(=O)O 2121-5-09 [0,2,0,0,0,0|0,0,0]=2 362 B6R0.2 CN(C)CC(=O)O 4158-1-41 [0,2,0,0,0,0|1,0,0]=3 363 B6R0.2 C[C@@H](N)CC(=O)O 4157-1-12 [0,2,0,0,0,0|1,0,0]=3 364 B6R0.2 C[C@H](N)CC(=O)O 4157-5-06 [0,2,0,0,0,0|1,0,0]=3 365 B6R0.2 ClC(Cl)=CC(Cl)Cl 1300-5-01 [0,2,0,0,0,0|2,0,0]=4 366 B6R0.2 F\C(Cl)=C\C(Cl)Cl 1300-7-07 [0,2,0,0,0,0|2,0,0]=4 367 B6R0.2 NC(=O)CC(N)=O 4148-1-Y8 [0,2,0,0,0,0|2,0,0]=4 368 B6R0.2 NC(=O)C[N+](=O)[O-] 4154-1-03 [0,2,0,0,0,0|2,0,0]=4 369 B6R0.2 NC(=O)C[N+](=O)[O-] 4155-1-48 [0,2,0,0,0,0|2,0,0]=4 370 B6R0.2 O=C([O-])CC(=O)[O-] 2122-1-09 [0,2,0,0,0,0|1,0,1]=4 371 B6R0.3 C=C(Br)C(=O)OC 2324-9-09 [0,2,0,0,0,0|0,1,1]=4 372 B6R0.3 CC(C)C(=O)CBr 2117-9-02 [0,2,0,0,0,0|1,1,0]=4 373 B6R0.3 CC(CBr)C(=O)O 2121-9-0A [0,2,0,0,0,0|0,1,0]=3 374 B6R0.3 CC(CS)C(=O)O 6261-1-00 [0,2,0,0,0,0|1,0,0]=3 375 B6R0.3 CCC(=O)C(F)F 2117-3-27 [0,2,0,0,0,0|1,1,0]=4 376 B6R0.3 CCC(=O)N(C)C 4148-1-16 [0,2,0,0,0,0|2,0,0]=4 377 B6R0.3 CCC(Br)C(=O)Br 2116-9-09 [0,2,0,0,0,0|1,1,0]=4 378 B6R0.3 CCC(Br)C(=O)Cl 2116-D-02 [0,2,0,0,0,0|1,1,0]=4 379 B6R0.3 CCC(Br)C(=O)O 2121-9-15 [0,2,0,0,0,0|0,1,0]=3 380 B6R0.3 CCC(O)C(=O)O 2129-1-1J [0,2,0,0,0,0|1,0,0]=3 381 B6R0.3 CCC(S)C(C)=O 6161-1-00 [0,2,0,0,0,0|2,0,0]=4 382 B6R0.3 CC[C@@H](Cl)C(=O)O 2121-5-R0 [0,2,0,0,0,0|0,0,0]=2 383 B6R0.3 CC[C@@H](O)C(=O)O 2129-1-RF [0,2,0,0,0,0|1,0,0]=3 384 B6R0.3 CC[C@H](C)C(=O)O 2121-1-S0 [0,2,0,0,0,0|1,0,0]=3 385 B6R0.3 CC[C@H](Cl)C(=O)O 2121-5-S0 [0,2,0,0,0,0|0,0,0]=2 386 B6R0.3 CC[C@H](N)C(N)=O 4148-5-S0 [0,2,0,0,0,0|2,0,0]=4 387 B6R0.3 CN(C)C(=O)CCl 4148-5-0B [0,2,0,0,0,0|1,0,0]=3 388 B6R0.3 CN(C)C(=O)CN 4148-1-0C [0,2,0,0,0,0|2,0,0]=4 389 B6R0.3 CN(C)C(=O)CN 4148-5-X3 [0,2,0,0,0,0|2,0,0]=4 390 B6R0.3 CNC(C)C(=O)O 4157-1-0A [0,2,0,0,0,0|1,0,0]=3 391 B6R0.3 COC(=N)C(C)C 4156-5-0M [0,2,0,0,0,0|2,0,0]=4 392 B6R0.3 COC(=O)C(=O)[O-] 2123-1-56 [0,2,0,0,0,0|1,0,1]=4 393 B6R0.3 COC(=O)C(C)=O 2129-1-05 [0,2,0,0,0,0|1,0,1]=4 394 B6R0.3 COC(=O)C(C)Br 2123-9-35 [0,2,0,0,0,0|0,1,0]=3 395 B6R0.3 COC(=O)C(C)C 2123-1-77 [0,2,0,0,0,0|1,0,0]=3 396 B6R0.3 COC(=O)C(C)N 4158-5-16 [0,2,0,0,0,0|1,0,0]=3 397 B6R0.3 COC(=O)[C@@H](C)Cl 2123-5-R1 [0,2,0,0,0,0|0,0,0]=2 398 B6R0.3 COC(=O)[C@@H](C)F 2123-3-R2 [0,2,0,0,0,0|0,1,0]=3 399 B6R0.3 COC(=O)[C@@H](C)N 4158-5-15 [0,2,0,0,0,0|1,0,0]=3 400 B6R0.3 COC(=O)[C@H](C)Cl 2123-5-S1 [0,2,0,0,0,0|0,0,0]=2 401 B6R0.3 COC(=O)[C@H](C)F 2123-3-S2 [0,2,0,0,0,0|0,1,0]=3 402 B6R0.3 CO[C@@H](C)C(=O)O 2121-1-S1 [0,2,0,0,0,0|1,0,0]=3 403 B6R0.3 CO[C@H](C)C(=O)O 2121-1-R1 [0,2,0,0,0,0|1,0,0]=3 404 B6R0.3 CO\C(F)=C(\F)Cl 2307-7-04 [0,2,0,0,0,0|1,0,1]=4 405 B6R0.3 ClCC(Cl)=C(Cl)Cl 1300-5-08 [0,2,0,0,0,0|2,0,0]=4 406 B6R0.3 Cl\C=C(/Cl)C(Cl)Cl 1300-5-16 [0,2,0,0,0,0|2,0,0]=4 407 B6R0.3 FC(F)=C(Cl)CCl 1300-7-38 [0,2,0,0,0,0|2,0,0]=4 408 B6R0.3 NC(=O)C(Cl)CCl 4148-5-0K [0,2,0,0,0,0|1,0,0]=3 409 B6R0.3 NC(CS)C(=O)O 8161-5-00 [0,2,0,0,0,0|1,0,0]=3 410 B6R0.3 NCC(N)C(=O)O 4157-1-27 [0,2,0,0,0,0|1,0,0]=3 411 B6R0.3 NCC(N)C(=O)O 4157-5-02 [0,2,0,0,0,0|1,0,0]=3 412 B6R0.3 NCC(O)C(=O)O 4157-1-47 [0,2,0,0,0,0|1,0,0]=3 413 B6R0.3 NC[C@@H](N)C(=O)O 4157-5-R5 [0,2,0,0,0,0|1,0,0]=3 414 B6R0.3 NC[C@H](N)C(=O)O 4157-5-S5 [0,2,0,0,0,0|1,0,0]=3 415 B6R0.3 NC[C@H](O)C(=O)O 4156-1-SR [0,2,0,0,0,0|1,0,0]=3 416 B6R0.3 N[C@@H](CCl)C(=O)O 4157-5-R3 [0,2,0,0,0,0|0,0,0]=2 417 B6R0.3 N[C@@H](CS)C(=O)O 8161-5-R2 [0,2,0,0,0,0|1,0,0]=3 418 B6R0.3 N[C@H](CS)C(=O)O 8161-5-S2 [0,2,0,0,0,0|1,0,0]=3 419 B6R0.3 O=C(O)C(=O)CBr 2129-9-X1 [0,2,0,0,0,0|0,1,0]=3 420 B6R0.3 O=C(O)C(Br)CBr 2121-9-06 [0,2,0,0,0,0|0,1,0]=3 421 B6R0.3 O=C(O)C(F)CF 2121-3-1P [0,2,0,0,0,0|0,1,0]=3 422 B6R0.3 O=C([O-])C(=O)CF 2129-3-X0 [0,2,0,0,0,0|0,1,1]=4 423 B6R0.3 OC(CCl)C(F)F 2102-7-00 [0,2,0,0,0,0|1,0,1]=4 424 B6R0.3 O[C@@H](CCl)C(F)F 2102-7-R0 [0,2,0,0,0,0|1,0,1]=4 425 B6R0.3 O[C@H](CCl)C(F)F 2102-7-S0 [0,2,0,0,0,0|1,0,1]=4 426 B6R0.4 C#CCOC(C)=O 2523-1-01 [0,2,0,0,0,0|2,0,0]=4 427 B6R0.4 C=CCCC(=O)O 2321-1-0D [0,2,0,0,0,0|1,0,0]=3 428 B6R0.4 CC(=O)CCCBr 2117-9-0A [0,2,0,0,0,0|1,1,0]=4 429 B6R0.4 CC(=O)OCC=O 2123-1-53 [0,2,0,0,0,0|2,0,0]=4 430 B6R0.4 CC(=O)OCCBr 2123-9-24 [0,2,0,0,0,0|1,1,0]=4 431 B6R0.4 CC(=O)OCCCl 2123-5-0M [0,2,0,0,0,0|1,0,0]=3 432 B6R0.4 CC(=O)SCC#N 8166-1-X0 [0,2,0,0,0,0|2,0,0]=4 433 B6R0.4 CCCCC(=O)Br 2116-9-0A [0,2,0,0,0,0|2,0,0]=4 434 B6R0.4 CCCCC(C)=O 2117-1-11 [0,2,0,0,0,0|2,0,0]=4 435 B6R0.4 CCCCC(N)=O 4148-1-0P [0,2,0,0,0,0|2,0,0]=4 436 B6R0.4 CCCNC(N)=O 4153-1-00 [0,2,0,0,0,0|2,0,0]=4 437 B6R0.4 CCCOC(=O)Cl 2116-5-30 [0,2,0,0,0,0|2,0,0]=4 438 B6R0.4 CCCOC(N)=O 4156-1-2G [0,2,0,0,0,0|2,0,0]=4 439 B6R0.4 CCCSC(C)=O 6166-1-0A [0,2,0,0,0,0|2,0,0]=4 440 B6R0.4 CCNCC(=O)O 4158-1-76 [0,2,0,0,0,0|1,0,0]=3 441 B6R0.4 CCOCC(=O)O 2121-1-20 [0,2,0,0,0,0|1,0,0]=3 442 B6R0.4 CC\C=C\C(=O)O 2321-1-X5 [0,2,0,0,0,0|1,0,0]=3 443 B6R0.4 CNCCC(=O)O 4157-1-11 [0,2,0,0,0,0|1,0,0]=3 444 B6R0.4 COCCC(=O)Cl 2116-5-0C [0,2,0,0,0,0|2,0,0]=4 445 B6R0.4 COCCC(=O)O 2123-1-63 [0,2,0,0,0,0|1,0,0]=3 446 B6R0.4 CO\N=C\C(=O)O 4135-1-01 [0,2,0,0,0,0|1,0,1]=4 447 B6R0.4 CSCCC(=O)Cl 6166-5-01 [0,2,0,0,0,0|2,0,0]=4 448 B6R0.4 CSCCC(C)=O 6166-1-0J [0,2,0,0,0,0|2,0,0]=4 449 B6R0.4 FC(F)=CCCCl 1300-7-26 [0,2,0,0,0,0|2,0,0]=4 450 B6R0.4 N#CCCC(=O)O 4137-1-00 [0,2,0,0,0,0|1,0,0]=3 451 B6R0.4 O=C(Cl)CCCBr 2116-D-01 [0,2,0,0,0,0|1,1,0]=4 452 B6R0.4 O=C(Cl)OCCBr 2123-D-00 [0,2,0,0,0,0|1,1,0]=4 453 B6R0.4 O=C(Cl)OCCCl 2123-5-0K [0,2,0,0,0,0|1,0,0]=3 454 B6R0.4 O=C(O)CCCBr 2121-9-05 [0,2,0,0,0,0|0,1,0]=3 455 B6R0.4 O=C(O)\C=C\CBr 2321-9-00 [0,2,0,0,0,0|0,1,0]=3 456 B6R0.4 O=C([O-])CNCO 4158-1-62 [0,2,0,0,0,0|1,0,1]=4 457 B6R0.4 OB(O)\C=C\CCl 6360-5-E0 [0,2,0,0,0,0|1,0,1]=4 458 B6R0.5 C=CCP(=O)(O)O 6377-1-22 [0,2,0,0,0,0|2,0,0]=4 459 B6R0.5 CCCS(=O)(=O)O 6164-1-05 [0,2,0,0,0,0|2,0,0]=4 460 B6R0.5 O=P(O)(O)CCBr 2677-9-00 [0,2,0,0,0,0|1,1,0]=4 461 B6R0.5 O=P(O)(O)CCCl 6177-5-02 [0,2,0,0,0,0|1,0,0]=3 462 B6R0.5 O=S(=O)(Cl)CCCl 6162-5-0J [0,2,0,0,0,0|1,0,1]=4 463 B6R0.5 O=S(=O)(F)CCCl 6162-7-06 [0,2,0,0,0,0|1,0,1]=4 464 B6R0.8 CC(C)(CO)CCl 2101-5-00 [0,2,0,0,0,0|1,0,1]=4 465 B6R0.8 CC(O)(CCl)CBr 2103-D-01 [0,2,0,0,0,0|1,0,1]=4 466 B6R0.9 CCC(CC)=NO 4147-1-08 [0,2,0,0,0,0|2,0,0]=4 467 B6R0.9 COC(CCl)OC 2108-5-0B [0,2,0,0,0,0|0,0,2]=4 468 B6R0.7 C=C(Cl)C(Cl)(Cl)Cl 1300-5-38 [0,2,0,0,0,0|2,0,0]=4 469 B6R0.7 C=C(Cl)C(F)(F)Cl 1300-7-00 [0,2,0,0,0,0|2,0,0]=4 470 B6R0.7 CC(=O)C(C)(C)Br 2117-9-08 [0,2,0,0,0,0|1,1,0]=4 471 B6R0.7 CC(=O)C(Cl)(Cl)Cl 2117-5-06 [0,2,0,0,0,0|1,0,0]=3 472 B6R0.7 CC(Br)(Br)C(=O)O 2121-9-0F [0,2,0,0,0,0|0,1,0]=3 473 B6R0.7 CC(C)(Br)C(=O)Br 2116-9-04 [0,2,0,0,0,0|1,1,0]=4 474 B6R0.7 CC(C)(Br)C(=O)O 2121-9-14 [0,2,0,0,0,0|0,1,0]=3 475 B6R0.7 CC(C)(C)C(=O)Br 2116-9-05 [0,2,0,0,0,0|2,0,0]=4 476 B6R0.7 CC(C)(C)C(=O)O 2121-1-45 [0,2,0,0,0,0|1,0,0]=3 477 B6R0.7 CC(C)(C)C(=O)[O-] 2122-1-16 [0,2,0,0,0,0|1,0,1]=4 478 B6R0.7 CC(C)(F)C(=O)Cl 2116-7-00 [0,2,0,0,0,0|1,1,0]=4 479 B6R0.7 CC(C)(F)C(N)=O 4148-3-0J [0,2,0,0,0,0|1,1,0]=4 480 B6R0.7 CC(O)C(Cl)(Cl)Cl 2102-5-01 [0,2,0,0,0,0|1,0,1]=4 481 B6R0.7 C[C@H](N)P(=O)(O)O 8177-1-17 [0,2,0,0,0,0|2,0,0]=4 482 B6R0.7 NC(=O)C(F)(F)Cl 4148-7-01 [0,2,0,0,0,0|1,0,0]=3 483 B6R0.7 O=C(Br)C(F)(F)Cl 2116-E-02 [0,2,0,0,0,0|1,0,0]=3 484 B6R0.7 O=C(Cl)C(Cl)(Cl)Cl 2116-4-03 [0,2,0,0,0,0|1,0,0]=3 485 B6R0.7 O=C(F)C(F)(F)Cl 2116-7-X1 [0,2,0,0,0,0|1,0,0]=3 486 B6R0.7 O=C(O)C(F)(F)F 2121-3-02P [0,2,0,0,0,0|0,1,0]=3 487 B6R0.7 O=C(O)C(F)(F)F 4H22-3-11 [0,2,0,0,0,0|0,1,0]=3 488 B6R0.7 O=C(O)C(F)(F)I 2121-K-02 [0,2,0,0,0,0|0,1,0]=3 489 B6R0.7 O=C([O-])C(F)(F)F 2122-2-07 [0,2,0,0,0,0|0,1,1]=4 490 B6R0.7 O=C([O-])C(F)(F)F 2122-2-11 [0,2,0,0,0,0|0,1,1]=4 491 B6R0.7 O=C([O-])C(F)(F)F 2122-2-49 [0,2,0,0,0,0|0,1,1]=4 492 B6R0.7 O=S(=O)(Cl)C(F)Cl 6162-7-00 [0,2,0,0,0,0|1,0,1]=4 493 B6R0.7 O=[13C]([O-])[13C](F)(F)F 2122-3-X2 [0,2,0,0,0,0|0,1,1]=4 494 B4R1.2 C[C@@H]1CO1 2109-1-R3 [1,0,0,1,0,0|1,0,1]=4 495 B4R1.2 C[C@H]1CO1 2109-1-S3 [1,0,0,1,0,0|1,0,1]=4 496 B6R1.2 CC1=NCCO1 4H56-1-Z8 [0,1,0,1,0,0|2,0,0]=4 497 B6R1.2 NC1=NCCO1 4H33-5-0M [0,1,0,1,0,0|2,0,0]=4 498 B6R1.2 O=C1C=CCO1 2H25-1-15 [0,1,0,1,0,0|1,0,1]=4 499 B6R1.2 O=C1CC=CC1 2417-1-00 [0,1,0,1,0,0|2,0,0]=4 500 B6R1.2 O=C1CCNC1 4H17-1-3A [0,1,0,1,0,0|2,0,0]=4 501 B6R1.2 O=C1NCCO1 4H56-1-03K [0,1,0,1,0,0|1,0,0]=3 502 B6R1.2 S=C1NCCO1 8H67-1-78 [0,1,0,1,0,0|1,1,0]=4 503 B6R1.5 CC1CC(=O)C1 2217-1-09 [0,1,0,1,0,0|2,0,0]=4 504 B6R1.5 NC1CC(=O)C1 4256-5-09 [0,1,0,1,0,0|2,0,0]=4 505 B6R1.11 CC(=O)C1CO1 1900-D-11 [0,1,0,1,0,0|2,0,0]=4 506 B6R1.11 NC(=O)C1CC1 4248-1-X1 [0,1,0,1,0,0|2,0,0]=4 507 B6R1.11 O=C([O-])C1CO1 2222-1-00 [0,1,0,1,0,0|1,0,1]=4 508 B6R1.6 ON=C1CCC1 4247-1-11 [0,1,0,1,0,0|2,0,0]=4