0 B6R0.2 CC(=O)CC(C)=O 2118-1-01 [0,0,0,0,0,0|2,0,1]=3 1 B6R0.2 CC(=O)CC(C)C 2118-1-02 [0,0,0,0,0,0|1,0,0]=1 2 B6R0.2 CC(=O)\C=C(\C)N 4356-1-06 [0,0,0,0,0,0|2,0,2]=4 3 B6R0.2 CC(=O)\C=C(\C)[O-] 9128-1-X0 [0,0,0,0,0,0|2,0,2]=4 4 B6R0.2 CC(C)=CB(O)O 6360-1-X3 [0,0,0,0,0,0|1,0,3]=4 5 B6R0.2 CC(C)=CC(=O)O 2321-1-X4 [0,0,0,0,0,0|0,0,2]=2 6 B6R0.2 CC(C)CB(O)O 6160-1-X3 [0,0,0,0,0,0|1,0,1]=2 7 B6R0.2 CC(C)CC(N)=O 4148-1-Y7 [0,0,0,0,0,0|1,0,0]=1 8 B6R0.2 CC(C)NC(C)C 3135-5-00 [0,0,0,0,0,0|3,0,1]=4 9 B6R0.2 CC(C)NC(C)C 4133-5-01 [0,0,0,0,0,0|3,0,1]=4 10 B6R0.2 CC(C)NC(N)=S 7167-1-18 [0,0,0,0,0,0|2,1,0]=3 11 B6R0.2 CC(C)OP(Cl)Cl 6174-5-00 [0,0,0,0,0,0|4,0,0]=4 12 B6R0.2 CC(Cl)OC(=O)Cl 2116-5-X1 [0,0,0,0,0,0|3,0,0]=3 13 B6R0.2 CC(O)CC(=O)[O-] 2129-1-35 [0,0,0,0,0,0|1,0,1]=2 14 B6R0.2 CC(O)CC(C)O 2104-1-X3 [0,0,0,0,0,0|2,0,1]=3 15 B6R0.2 CN(C)CC(=O)O 4158-1-40 [0,0,0,0,0,0|1,0,0]=1 16 B6R0.2 CN(C)CC(N)=S 7167-5-01 [0,0,0,0,0,0|2,1,0]=3 17 B6R0.2 C[C@@H](O)C[C@@H](C)O 2104-1-28 [0,0,0,0,0,0|2,0,1]=3 18 B6R0.2 O=C(O)CC(=O)O 2121-1-05 [0,0,0,0,0,0|2,0,1]=3 19 B5R0.1 C=CCC(C)O 2302-1-00 [1,0,0,0,0,0|2,0,0]=3 20 B5R0.1 CC#CC(=O)O 2521-1-13 [1,0,0,0,0,0|0,0,2]=3 21 B5R0.1 CC(C)CCI 1100-H-X4 [1,0,0,0,0,0|1,0,1]=3 22 B5R0.1 CC(C)CCN 3130-1-X4 [1,0,0,0,0,0|1,0,1]=3 23 B5R0.1 CC(C)CCO 2101-1-53 [1,0,0,0,0,0|0,0,1]=2 24 B5R0.1 CC(C)CNN 3139-5-X0 [1,0,0,0,0,0|2,0,0]=3 25 B5R0.1 CC(C)N=C=S 7168-1-X2 [1,0,0,0,0,0|1,1,1]=4 26 B5R0.1 CC(N)CCO 4156-1-4D [1,0,0,0,0,0|1,0,1]=3 27 B5R0.1 CCCB(O)O 6160-1-X5 [1,0,0,0,0,0|1,0,1]=3 28 B5R0.1 CCCC(=O)Cl 2116-5-09 [1,0,0,0,0,0|1,0,0]=2 29 B5R0.1 CCCC(=O)[O-] 2122-1-X1 [1,0,0,0,0,0|0,0,1]=2 30 B5R0.1 CCCC(C)C 1100-1-04 [1,0,0,0,0,0|1,0,1]=3 31 B5R0.1 CCCC(C)O 2102-1-52 [1,0,0,0,0,0|1,0,1]=3 32 B5R0.1 CCNC(N)=O 4153-1-X1 [1,0,0,0,0,0|2,0,0]=3 33 B5R0.1 CCOC(=S)[S-] 6167-1-02 [1,0,0,0,0,0|1,2,0]=4 34 B5R0.1 CN(C)CC#N 3137-1-03 [1,0,0,0,0,0|2,0,1]=4 35 B5R0.1 CN(C)CCN 3132-1-X2 [1,0,0,0,0,0|2,0,1]=4 36 B5R0.1 COCC(=O)Cl 2116-5-X4 [1,0,0,0,0,0|2,0,0]=3 37 B5R0.1 CSCC(=O)O 6166-1-05 [1,0,0,0,0,0|1,0,0]=2 38 B5R0.1 C[C@@H](N)CCO 4156-1-RB [1,0,0,0,0,0|1,0,1]=3 39 B5R0.1 C[C@@H](O)CCO 2101-1-X0 [1,0,0,0,0,0|1,0,1]=3 40 B5R0.1 NC(=O)CCBr 4148-9-00 [1,0,0,0,0,0|2,0,0]=3 41 B5R0.1 NC(=O)CCCl 4148-5-02 [1,0,0,0,0,0|2,0,0]=3 42 B5R0.1 O=C(O)CCO 2129-1-Y8 [1,0,0,0,0,0|1,0,0]=2 43 B7R0.2 CC(C)NC(=S)NN 7167-1-17 [0,1,0,0,0,0|2,1,0]=4 44 B7R0.2 CCC(C)CC(C)N 3130-5-X2 [0,1,0,0,0,0|2,0,1]=4 45 B7R0.2 CN(C)CC(O)CO 4156-1-0H [0,1,0,0,0,0|1,0,2]=4 46 B7R0.2 CNC(=O)CC(C)=O 4148-1-51 [0,1,0,0,0,0|2,0,1]=4 47 B7R0.2 COC(=O)CC(=O)Cl 2116-5-X2 [0,1,0,0,0,0|2,0,1]=4 48 B7R0.2 COC(=O)CC(=O)[O-] 2123-1-X2 [0,1,0,0,0,0|1,0,2]=4 49 B7R0.2 COC(=O)CC(C)=O 2129-1-72 [0,1,0,0,0,0|1,0,1]=3 50 B7R0.2 COC(=O)C[C@@H](C)O 2129-1-36 [0,1,0,0,0,0|1,0,0]=2 51 B7R0.2 COC(=O)C[N+](=O)[O-] 4154-1-07 [0,1,0,0,0,0|3,0,0]=4 52 B7R0.9 CC(=O)CC(F)(F)F 2117-3-44 [0,1,0,0,0,0|3,0,0]=4 53 B7R0.9 CC(=O)CS(C)(=O)=O 6163-1-06 [0,1,0,0,0,0|3,0,0]=4 54 B7R0.9 CC(C)(C)CC(=O)O 2121-1-X4 [0,1,0,0,0,0|0,0,0]=1 55 B7R0.9 CC(C)(C)NC(N)=S 7167-1-04 [0,1,0,0,0,0|2,1,0]=4 56 B7R0.9 CC(C)(C)OC(N)=O 4156-1-65 [0,1,0,0,0,0|2,0,0]=3 57 B7R0.9 CC(C)(N)CC(=O)O P911-A-54 [0,1,0,0,0,0|0,0,0]=1 58 B7R0.9 CS(=O)(=O)CC(=O)O 6165-1-01 [0,1,0,0,0,0|2,0,0]=3 59 B7R0.9 O=C(Cl)CC(F)(F)F 2116-7-33 [0,1,0,0,0,0|3,0,0]=4 60 B7R0.9 O=C(O)CC(F)(F)F 2121-3-11 [0,1,0,0,0,0|2,0,0]=3 61 B7R0.16 CC(=O)C(Cl)C(C)=O 2118-5-01 [0,1,0,0,0,0|2,0,1]=4 62 B7R0.16 CC(C)[C@H](O)C(=O)O 2129-1-S3 [0,1,0,0,0,0|0,0,0]=1 63 B7R0.16 CC(F)C(N)C(=O)O 4157-3-20 [0,1,0,0,0,0|1,0,0]=2 64 B7R0.16 CN(C)C(=O)C(=O)O 4156-1-Z5 [0,1,0,0,0,0|1,0,1]=3 65 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O 4157-1-35 [0,1,0,0,0,0|1,0,0]=2 66 B7R1.2 CC1=CC(=O)CC1 2417-1-07 [0,0,0,1,0,0|1,0,2]=4 67 B7R1.2 CC1=NNC(=O)C1 4H17-1-1W [0,0,0,1,0,0|2,0,1]=4 68 B7R1.2 CN1CCC(O)C1 4H56-1-Z4 [0,0,0,1,0,0|2,0,1]=4 69 B7R1.2 CN1CC[C@@H](O)C1 4H56-1-R1 [0,0,0,1,0,0|2,0,1]=4 70 B7R1.2 CN1CC[C@H](O)C1 4H56-1-S4 [0,0,0,1,0,0|2,0,1]=4 71 B7R1.2 O=C1CCC(=O)C1 P911-A-79 [0,0,0,1,0,0|2,0,1]=4 72 B7R1.2 O=C1COC(=O)C1 2H25-1-29 [0,0,0,1,0,0|1,0,1]=3 73 B7R1.2 O=C1C[C@H](O)CN1 4H20-1-X7 [0,0,0,1,0,0|2,0,0]=3 74 B7R1.2 O=C1OCC(F)O1 2H28-3-04 [0,0,0,1,0,0|2,0,0]=3 75 B7R1.2 O=C1OCC(F)O1 2H28-3-04H [0,0,0,1,0,0|2,0,0]=3 76 B7R1.12 O=C(O)C1CC1F 2221-3-0B [0,0,0,1,0,0|1,0,0]=2 77 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F 2221-3-25 [0,0,0,1,0,0|1,0,0]=2 78 B7R1.20 O=C(O)CC1CC1 2221-1-X4 [0,0,0,1,0,0|0,0,0]=1 79 B5R0.5 C=C(C)C(C)C 1300-1-24 [0,0,0,0,1,0|2,0,0]=3 80 B5R0.5 C=C(F)C(=O)O 2321-3-06 [0,0,0,0,1,0|1,0,2]=4 81 B5R0.5 CC(=O)C(=O)O 2129-1-03 [0,0,0,0,1,0|1,0,1]=3 82 B5R0.5 CC(=O)C(C)=O 2118-1-05 [0,0,0,0,1,0|2,0,1]=4 83 B5R0.5 CC(=O)C(C)C 2117-1-13 [0,0,0,0,1,0|1,0,0]=2 84 B5R0.5 CC(=O)C(C)F 2117-3-11 [0,0,0,0,1,0|2,0,0]=3 85 B5R0.5 CC(=O)C(F)F 2117-3-13 [0,0,0,0,1,0|3,0,0]=4 86 B5R0.5 CC(=O)N(C)C 4148-1-08 [0,0,0,0,1,0|2,0,0]=3 87 B5R0.5 CC(Br)C(N)=O 4157-9-X1 [0,0,0,0,1,0|2,0,0]=3 88 B5R0.5 CC(C)=C(C)C 1300-1-X1 [0,0,0,0,1,0|2,0,1]=4 89 B5R0.5 CC(C)B(O)O 6160-1-X0 [0,0,0,0,1,0|1,0,1]=3 90 B5R0.5 CC(C)C(=N)N 3141-5-X0 [0,0,0,0,1,0|2,0,0]=3 91 B5R0.5 CC(C)C(=O)Cl 2116-5-05 [0,0,0,0,1,0|1,0,0]=2 92 B5R0.5 CC(F)C(=O)O 2121-3-95 [0,0,0,0,1,0|1,0,0]=2 93 B5R0.5 CC(N)C(N)=O 4158-5-X5 [0,0,0,0,1,0|2,0,0]=3 94 B5R0.5 CC(O)C(C)O 2104-1-07 [0,0,0,0,1,0|2,0,1]=4 95 B5R0.5 CN(C)C(=N)N 3141-5-00 [0,0,0,0,1,0|3,0,0]=4 96 B5R0.5 CN(C)C(=S)Cl P911-A-76 [0,0,0,0,1,0|2,1,0]=4 97 B5R0.5 CN(C)C(=S)[S-] 5167-1-01 [0,0,0,0,1,0|1,2,0]=4 98 B5R0.5 C[C@@H](Cl)C(=O)O 2121-5-R1 [0,0,0,0,1,0|1,0,0]=2 99 B5R0.5 C[C@@H](O)C(N)=O 4148-1-R1 [0,0,0,0,1,0|2,0,0]=3 100 B5R0.5 C[C@@H](O)[C@@H](C)O 2104-1-R1 [0,0,0,0,1,0|2,0,1]=4 101 B5R0.5 C[C@H](N)C(=O)O 4157-1-S5 [0,0,0,0,1,0|1,0,0]=2 102 B5R0.5 C[C@H](N)C(N)=O 4148-5-04 [0,0,0,0,1,0|2,0,0]=3 103 B5R0.5 C[C@H](O)C(=O)O 2129-1-S8 [0,0,0,0,1,0|1,0,0]=2 104 B5R0.5 C[C@H](O)[C@H](C)O 2104-1-X2 [0,0,0,0,1,0|2,0,1]=4 105 B5R0.5 NC(=O)C(Cl)Cl 4148-5-X4 [0,0,0,0,1,0|3,0,0]=4 106 B5R0.5 NC(=O)C(F)Br 4148-B-02 [0,0,0,0,1,0|3,0,0]=4 107 B5R0.5 NC(=O)C(F)Cl 4148-7-03 [0,0,0,0,1,0|3,0,0]=4 108 B5R0.5 NC(=O)C(F)F 4148-3-18 [0,0,0,0,1,0|3,0,0]=4 109 B5R0.5 NC(=O)C(F)I 4148-K-01 [0,0,0,0,1,0|3,0,0]=4 110 B5R0.5 O=C(Cl)C(Cl)Cl 2116-5-00 [0,0,0,0,1,0|3,0,0]=4 111 B5R0.5 O=C(O)C(=O)O 2121-1-12 [0,0,0,0,1,0|2,0,1]=4 112 B5R0.5 O=C(O)C(F)Br 2121-B-03 [0,0,0,0,1,0|2,0,0]=3 113 B5R0.5 O=C(O)C(F)Cl 2121-7-03 [0,0,0,0,1,0|2,0,0]=3 114 B5R0.5 O=C(O)C(F)F 2121-3-05 [0,0,0,0,1,0|2,0,0]=3 115 B5R0.5 O=C(O)C(F)I 2121-K-01 [0,0,0,0,1,0|2,0,0]=3 116 B5R0.5 O=C([O-])C(F)Br 2122-B-01 [0,0,0,0,1,0|2,0,1]=4 117 B5R0.5 O=C([O-])C(F)Cl 2122-7-01 [0,0,0,0,1,0|2,0,1]=4 118 B5R0.5 O=C([O-])C(F)F 2122-3-02 [0,0,0,0,1,0|2,0,1]=4 119 B5R0.5 O=C([O-])C(F)F 2122-3-07 [0,0,0,0,1,0|2,0,1]=4 120 B5R0.5 [C@@H](C)(Cl)C(=O)O 2121-5-S1 [0,0,0,0,1,0|1,0,0]=2 121 B7R0.6 CC(=O)CCC(C)=O 2118-1-25 [0,0,0,0,0,1|2,0,1]=4 122 B7R0.6 CC(=O)OCC(=O)Cl 2129-5-X0 [0,0,0,0,0,1|2,0,1]=4 123 B7R0.6 CC(=O)OCC(F)F 2123-3-09 [0,0,0,0,0,1|3,0,0]=4 124 B7R0.6 CC(=O)\C=C\C(C)C 2317-1-04 [0,0,0,0,0,1|1,0,1]=3 125 B7R0.6 CC(C)=NNC(N)=O 4153-1-0A [0,0,0,0,0,1|2,0,1]=4 126 B7R0.6 CC(C)CCC(=O)Cl 2116-5-0A [0,0,0,0,0,1|1,0,0]=2 127 B7R0.6 CC(C)COC(=O)Cl 2123-5-1N [0,0,0,0,0,1|1,0,0]=2 128 B7R0.6 CC(C)OCC(=O)O 2121-1-43 [0,0,0,0,0,1|0,0,0]=1 129 B7R0.6 CC(C)\C=C\C(=O)O 2321-1-13 [0,0,0,0,0,1|0,0,1]=2 130 B7R0.6 CN(C)CCC(=O)O 4158-5-13 [0,0,0,0,0,1|1,0,0]=2 131 B7R0.6 N=C(N)NCC(=O)O 4156-1-60 [0,0,0,0,0,1|2,0,1]=4 132 B7R0.6 O=C(Cl)OCC(F)F 2123-7-00 [0,0,0,0,0,1|3,0,0]=4 133 B4R0.1 C#CC(=O)O 2521-1-01 [2,0,0,0,0,0|0,0,2]=4 134 B4R0.1 C=C(Br)CC 1300-9-24 [2,0,0,0,0,0|2,0,0]=4 135 B4R0.1 C=C(C)CC 1300-1-21 [2,0,0,0,0,0|2,0,0]=4 136 B4R0.1 C=CC(C)C 1300-1-26 [2,0,0,0,0,0|0,0,1]=3 137 B4R0.1 C=CC(C)Cl 1300-5-41 [2,0,0,0,0,0|1,0,1]=4 138 B4R0.1 CC(=O)C=O 2117-1-X0 [2,0,0,0,0,0|1,0,1]=4 139 B4R0.1 CC(=O)C=O 2117-1-X0A [2,0,0,0,0,0|1,0,1]=4 140 B4R0.1 CC(=O)CF 2117-3-10 [2,0,0,0,0,0|2,0,0]=4 141 B4R0.1 CC(=O)CO 2120-1-01 [2,0,0,0,0,0|1,0,1]=4 142 B4R0.1 CC(C)C#N 3137-1-Y4 [2,0,0,0,0,0|1,0,1]=4 143 B4R0.1 CC(C)C=O 2115-1-13 [2,0,0,0,0,0|0,0,0]=2 144 B4R0.1 CC(C)NN 3139-5-X2 [2,0,0,0,0,0|2,0,0]=4 145 B4R0.1 CC(C)[Mg]Cl 9112-5-04 [2,0,0,0,0,0|2,0,0]=4 146 B4R0.1 CC(F)CO 2101-3-64 [2,0,0,0,0,0|1,0,0]=3 147 B4R0.1 CC(N)CO 4156-1-92 [2,0,0,0,0,0|1,0,0]=3 148 B4R0.1 CC(O)CF 2102-3-12 [2,0,0,0,0,0|2,0,0]=4 149 B4R0.1 CC(O)CO 2104-1-12 [2,0,0,0,0,0|1,0,0]=3 150 B4R0.1 CCB(O)O 6160-1-X1 [2,0,0,0,0,0|1,0,1]=4 151 B4R0.1 CCC(=N)N 3141-5-03 [2,0,0,0,0,0|2,0,0]=4 152 B4R0.1 CCC(C)Cl 1100-5-25 [2,0,0,0,0,0|1,0,1]=4 153 B4R0.1 CCC(C)F 1100-3-47 [2,0,0,0,0,0|1,0,1]=4 154 B4R0.1 CCC(C)I 1100-H-X6 [2,0,0,0,0,0|1,0,1]=4 155 B4R0.1 CC[C@@H](C)O 2101-1-R1 [2,0,0,0,0,0|1,0,1]=4 156 B4R0.1 CN(C)C=O 4148-1-03 [2,0,0,0,0,0|1,0,0]=3 157 B4R0.1 C[C@@H](N)CO 4156-1-R3 [2,0,0,0,0,0|1,0,0]=3 158 B4R0.1 C[C@@H](O)CN 4156-1-R2 [2,0,0,0,0,0|2,0,0]=4 159 B4R0.1 C[C@@H](O)CO 2104-1-R3 [2,0,0,0,0,0|1,0,0]=3 160 B4R0.1 C[C@H](O)CN 4156-1-S2 [2,0,0,0,0,0|2,0,0]=4 161 B4R0.1 C[C@H](O)CO 2104-1-S3 [2,0,0,0,0,0|1,0,0]=3 162 B4R0.1 NC(=O)CBr 4148-9-X4 [2,0,0,0,0,0|2,0,0]=4 163 B4R0.1 NC(=O)CCl 4148-5-00 [2,0,0,0,0,0|2,0,0]=4 164 B4R0.1 O=C(Br)CBr 2116-9-03 [2,0,0,0,0,0|2,0,0]=4 165 B4R0.1 O=C(O)CBr 2121-9-01 [2,0,0,0,0,0|1,0,0]=3 166 B4R0.1 O=C(O)CI 2121-H-00 [2,0,0,0,0,0|1,0,0]=3 167 B4R0.1 O=C(O)CO 2129-1-20 [2,0,0,0,0,0|1,0,0]=3 168 B4R0.1 O=CC(=O)O 2129-1-X4 [2,0,0,0,0,0|1,0,1]=4 169 B4R0.1 OCC(F)F 2101-3-02 [2,0,0,0,0,0|2,0,0]=4 170 B4R0.1 [C@@H](C)(N)CC 3130-1-S1 [2,0,0,0,0,0|1,0,1]=4 171 B4R0.1 [C@@H](C)(N)CO 4156-1-Y5 [2,0,0,0,0,0|1,0,0]=3 172 B4R0.1 [C@H](C)(N)CC 3130-1-R1 [2,0,0,0,0,0|1,0,1]=4 173 B4R0.2 C#CCCC 1500-1-X1 [2,0,0,0,0,0|1,0,1]=4 174 B4R0.2 C=CCCBr 1300-9-04 [2,0,0,0,0,0|2,0,0]=4 175 B4R0.2 C=CCCC 1300-1-09 [2,0,0,0,0,0|1,0,0]=3 176 B4R0.2 CCCC#N 3137-1-Y3 [2,0,0,0,0,0|1,0,1]=4 177 B4R0.2 CCCCBr 1100-9-15 [2,0,0,0,0,0|1,0,1]=4 178 B4R0.2 CCCCF 1100-3-32 [2,0,0,0,0,0|1,0,1]=4 179 B4R0.2 CNCCO 4156-1-3Y [2,0,0,0,0,0|1,0,1]=4 180 B4R0.2 C\C=C\CC 1300-1-05 [2,0,0,0,0,0|1,0,1]=4 181 B4R0.2 OCCCBr 2101-9-X2 [2,0,0,0,0,0|1,0,1]=4 182 B4R0.2 OCCCCl 2101-5-13 [2,0,0,0,0,0|1,0,1]=4 183 B4R0.2 OCCCF 2101-3-50 [2,0,0,0,0,0|1,0,1]=4 184 B4R0.2 OCCCI 2101-H-01 [2,0,0,0,0,0|1,0,1]=4 185 B4R0.2 OCCCO 2104-1-11 [2,0,0,0,0,0|1,0,1]=4 186 B6R0.1 CCCC(=N)NO 4141-1-X1 [1,1,0,0,0,0|1,0,0]=3 187 B6R0.1 CCCC(=O)NN 4156-1-15 [1,1,0,0,0,0|1,0,0]=3 188 B6R0.1 CCCC(C)CCl 1100-5-0A [1,1,0,0,0,0|1,0,1]=4 189 B6R0.1 CCCC(O)CO 2104-1-0A [1,1,0,0,0,0|0,0,2]=4 190 B6R0.1 CCOC(=O)C=O 2323-1-X0 [1,1,0,0,0,0|1,0,1]=4 191 B6R0.1 CCOC(=O)CCl 2123-5-01 [1,1,0,0,0,0|2,0,0]=4 192 B6R0.1 CCOC(=O)CN 4158-5-25 [1,1,0,0,0,0|2,0,0]=4 193 B6R0.1 CCOC(=O)CS 6161-1-03 [1,1,0,0,0,0|1,1,0]=4 194 B6R0.1 CCOC(=O)NN 4156-1-55 [1,1,0,0,0,0|2,0,0]=4 195 B6R0.1 CNC(=O)CCN 4148-1-13 [1,1,0,0,0,0|2,0,0]=4 196 B6R0.1 CNCC(=O)OC 4158-5-X0 [1,1,0,0,0,0|1,0,0]=3 197 B6R0.1 COC(=O)CC#N 4137-1-X2 [1,1,0,0,0,0|1,0,1]=4 198 B6R0.1 COC(=O)CCN 4158-1-02 [1,1,0,0,0,0|1,0,0]=3 199 B6R0.1 COC(=O)CSC 6166-1-06 [1,1,0,0,0,0|1,0,0]=3 200 B6R0.1 OCC[C@H](O)CO 2104-1-S1 [1,1,0,0,0,0|1,0,1]=4 201 B6R0.1 [C-]#[N+]CC(=O)OC 4149-1-06 [1,1,0,0,0,0|1,0,1]=4 202 B6R0.3 CC(C#N)C(=O)O 4137-1-0Z [1,1,0,0,0,0|1,0,1]=4 203 B6R0.3 CC(C)C(=N)NO 4156-1-Z3 [1,1,0,0,0,0|1,0,1]=4 204 B6R0.3 CC(C)C(N)CO 4156-1-88 [1,1,0,0,0,0|0,0,1]=3 205 B6R0.3 CC(C)[C@@H](N)CO 4156-1-R5 [1,1,0,0,0,0|0,0,1]=3 206 B6R0.3 CC(C)[C@H](N)CO 4156-1-S5 [1,1,0,0,0,0|0,0,1]=3 207 B6R0.3 CCC(N)C(=O)O 4157-1-16 [1,1,0,0,0,0|0,0,0]=2 208 B6R0.3 CCN(C)C(=O)Cl 4148-5-18 [1,1,0,0,0,0|2,0,0]=4 209 B6R0.3 CC[C@H](O)C(=O)O 2129-1-SF [1,1,0,0,0,0|0,0,0]=2 210 B6R0.3 CNC(=O)C(=O)O 4156-1-Y4 [1,1,0,0,0,0|1,0,1]=4 211 B6R0.3 CN[C@@H](C)C(=O)O 4157-1-07 [1,1,0,0,0,0|1,0,0]=3 212 B6R0.3 C\C=C(/C)C(=O)O 2321-1-17 [1,1,0,0,0,0|0,0,2]=4 213 B6R0.3 C\C=C(/C)C(=O)O 2321-1-E0 [1,1,0,0,0,0|0,0,2]=4 214 B6R0.3 NCC(F)C(=O)O 4157-3-02 [1,1,0,0,0,0|1,0,0]=3 215 B6R0.3 N[C@@H](CS)C(=O)O 8158-1-01 [1,1,0,0,0,0|1,0,0]=3 216 B6R0.3 O=C(O)C(=O)CBr 2129-9-X3 [1,1,0,0,0,0|1,0,1]=4 217 B6R0.3 [C@@H](N)(CC)C(=O)O 4157-1-X5 [1,1,0,0,0,0|0,0,0]=2 218 B6R0.3 [C@H](N)(CC)C(=O)O 4157-1-X4 [1,1,0,0,0,0|0,0,0]=2 219 B6R0.4 C#CCCC(=O)O 2521-1-02 [1,1,0,0,0,0|0,0,1]=3 220 B6R0.4 C=CCCC(=O)Cl 2316-5-06 [1,1,0,0,0,0|1,0,1]=4 221 B6R0.4 C=CCC[C@@H](C)O 2302-1-R1 [1,1,0,0,0,0|2,0,0]=4 222 B6R0.4 CC(=O)CCCCl 2117-5-52 [1,1,0,0,0,0|1,0,0]=3 223 B6R0.4 CC(=O)NCCCl 4148-5-15 [1,1,0,0,0,0|2,0,0]=4 224 B6R0.4 CC(C)CN=C=S 7168-1-X1 [1,1,0,0,0,0|0,1,1]=4 225 B6R0.4 CC(C)OCCO 2107-1-0H [1,1,0,0,0,0|0,0,1]=3 226 B6R0.4 CCC#CC(=O)O 2521-1-12 [1,1,0,0,0,0|0,0,1]=3 227 B6R0.4 CCCCB(O)O 6160-1-06 [1,1,0,0,0,0|1,0,1]=4 228 B6R0.4 CCCCC(=O)O 2121-1-0C [1,1,0,0,0,0|0,0,0]=2 229 B6R0.4 CCCNC(N)=S 7167-1-23 [1,1,0,0,0,0|1,1,0]=4 230 B6R0.4 CCCOC(C)=O 2123-1-32 [1,1,0,0,0,0|1,0,0]=3 231 B6R0.4 CCCO[N+](=O)[O-] 4154-1-11 [1,1,0,0,0,0|1,0,1]=4 232 B6R0.4 CCOCC(=O)Cl 2116-5-0F [1,1,0,0,0,0|1,0,0]=3 233 B6R0.4 CN(C)CCCO 4156-1-40 [1,1,0,0,0,0|1,0,1]=4 234 B6R0.4 CNCCC(N)=O 4148-1-30 [1,1,0,0,0,0|1,0,0]=3 235 B6R0.4 NC(=O)NCCO 4153-1-02 [1,1,0,0,0,0|2,0,0]=4 236 B6R0.4 NCCCC(=O)O 4157-1-X2 [1,1,0,0,0,0|0,0,0]=2 237 B6R0.4 NCCNC(N)=O 4153-5-07 [1,1,0,0,0,0|2,0,0]=4 238 B6R0.4 O=C(Cl)CCCCl 2116-5-X5 [1,1,0,0,0,0|1,0,0]=3 239 B6R0.5 C=CC[Si](C)(C)C 5380-1-01 [1,1,0,0,0,0|1,1,0]=4 240 B6R0.5 C=CC[Si](C)(C)Cl 5381-5-03 [1,1,0,0,0,0|1,1,0]=4 241 B6R0.5 CC(C)(C)ON=O 4145-1-X1 [1,1,0,0,0,0|2,0,0]=4 242 B6R0.5 CCCS(=O)(=O)Cl 6162-5-05 [1,1,0,0,0,0|1,0,1]=4 243 B6R0.5 CCCS(N)(=O)=O P612-A-86 [1,1,0,0,0,0|1,0,1]=4 244 B6R0.5 CCOP(C)(=O)O 6177-1-37 [1,1,0,0,0,0|2,0,0]=4 245 B6R0.5 C[Si](C)(C)CCO 6180-1-X1 [1,1,0,0,0,0|0,1,1]=4 246 B6R0.5 NCCP(=O)(O)O 8177-1-35 [1,1,0,0,0,0|2,0,0]=4 247 B6R0.5 O=S(=O)(O)CCO 6164-1-0E [1,1,0,0,0,0|2,0,0]=4 248 B6R0.7 CC(=O)C(C)(C)C 2117-1-05 [0,1,0,0,1,0|1,0,0]=3 249 B6R0.7 CC(C)(Br)C(N)=O 4148-9-X0 [0,1,0,0,1,0|1,0,0]=3 250 B6R0.7 CC(C)(C)C(=N)N 4141-5-X0 [0,1,0,0,1,0|2,0,0]=4 251 B6R0.7 CC(C)(C)C(N)=O 4148-1-26 [0,1,0,0,1,0|1,0,0]=3 252 B6R0.7 CC(C)(C)C(N)=S 7169-1-00 [0,1,0,0,1,0|1,1,0]=4 253 B6R0.7 CC(C)(C)S(N)=O 8169-1-01 [0,1,0,0,1,0|2,0,0]=4 254 B6R0.7 CC(C)(C)[S@@](N)=O 8169-1-S2 [0,1,0,0,1,0|2,0,0]=4 255 B6R0.7 CC(C)(C)[S@](N)=O P311-A-51 [0,1,0,0,1,0|2,0,0]=4 256 B6R0.7 CC(C)(F)C(=O)O 2121-3-57 [0,1,0,0,1,0|0,0,0]=2 257 B6R0.7 CC(C)(O)C(=O)O 2129-1-10 [0,1,0,0,1,0|0,0,0]=2 258 B6R0.7 CC(F)(Br)C(=O)O 2121-B-06 [0,1,0,0,1,0|1,0,0]=3 259 B6R0.7 CC(F)(F)C(=O)O 2121-3-52 [0,1,0,0,1,0|1,0,0]=3 260 B6R0.7 CC(F)(F)C(=O)[O-] 2122-3-52 [0,1,0,0,1,0|1,0,1]=4 261 B6R0.7 CC(F)(F)C(N)=O 4148-3-X1 [0,1,0,0,1,0|2,0,0]=4 262 B6R0.7 O=C(O)C(Cl)(Cl)Cl 2121-5-X0 [0,1,0,0,1,0|2,0,0]=4 263 B6R0.7 O=C(O)C(F)(Br)Br 2121-B-01 [0,1,0,0,1,0|2,0,0]=4 264 B6R0.7 O=C(O)C(F)(Cl)Cl 2121-7-07 [0,1,0,0,1,0|2,0,0]=4 265 B6R0.7 O=C(O)C(F)(F)Br 2121-B-02 [0,1,0,0,1,0|2,0,0]=4 266 B6R0.7 O=C(O)C(F)(F)Cl 2121-7-01 [0,1,0,0,1,0|2,0,0]=4 267 B6R0.7 O=C(O)C(F)(F)F 2121-3-01 [0,1,0,0,1,0|2,0,0]=4 268 B6R0.7 O=C(O)C(F)(F)F 2121-3-02 [0,1,0,0,1,0|2,0,0]=4 269 B6R0.7 O=C(O)C(F)(F)F 2121-3-02L [0,1,0,0,1,0|2,0,0]=4 270 B6R0.7 O=C(O)C(F)(F)F 4H33-3-00 [0,1,0,0,1,0|2,0,0]=4 271 B8R0.9 CC(=O)OCC(O)CCl 2129-5-08 [0,1,0,0,0,1|2,0,0]=4 272 B8R0.9 COC(=O)OCC(F)F 2128-3-03 [0,1,0,0,0,1|2,0,0]=4 273 B8R0.9 COC(=O)\C=C\C(C)C 2323-1-X3 [0,1,0,0,0,1|0,0,1]=3 274 B8R0.9 NCC(=O)CCC(=O)O 4157-5-07 [0,1,0,0,0,1|1,0,1]=4 275 B8R0.9 NCC(=O)NCC(=O)O 4157-1-X3 [0,1,0,0,0,1|1,0,1]=4 276 B8R0.23 CC(=O)N[C@@H](C)C(=O)O 4158-1-S9 [0,1,0,0,0,1|1,0,1]=4 277 B8R0.23 CC(=O)N[C@H](C)C(=O)O 4158-1-59 [0,1,0,0,0,1|1,0,1]=4 278 B8R0.23 CC(C)C[C@H](O)C(=O)O 2129-1-SB [0,1,0,0,0,1|0,0,0]=2 279 B8R0.29 CC(C)(C)OCC(=O)O 2121-1-X5 [0,1,0,0,0,1|0,0,0]=2 280 B8R0.29 O=C(O)CCC(F)(F)F 2121-3-44 [0,1,0,0,0,1|2,0,0]=4 281 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O 4157-1-0X [0,2,0,0,0,0|0,0,0]=2 282 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O 4157-1-19 [0,2,0,0,0,0|0,0,0]=2 283 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O 4158-1-X5 [0,2,0,0,0,0|0,0,0]=2 284 B8R0.5 CCOC(=O)C=C(C)C 2324-1-49 [0,2,0,0,0,0|0,0,2]=4 285 B8R0.5 CCOC(=O)CC(=O)O 2123-1-84 [0,2,0,0,0,0|1,0,1]=4 286 B8R0.5 CCOC(=O)C[C@H](C)O 2129-1-S9 [0,2,0,0,0,0|1,0,0]=3 287 B8R0.5 CCOC(=O)C[S+](C)C 6166-9-X3 [0,2,0,0,0,0|1,0,0]=3 288 B8R0.16 COC(CC(C)=O)OC 2117-1-X6 [0,2,0,0,0,0|1,0,0]=3 289 B8R0.19 CCC(=O)CC(=O)OC 2129-1-X6 [0,2,0,0,0,0|1,0,1]=4 290 B8R0.19 COC(=O)CC(=O)CCl 2129-5-X1 [0,2,0,0,0,0|1,0,1]=4 291 B8R0.19 COC(=O)CC(=O)OC 2123-1-X5 [0,2,0,0,0,0|1,0,1]=4 292 B8R0.24 CC(C)(C)NC(=O)CCl 4148-5-11 [0,2,0,0,0,0|2,0,0]=4 293 B8R0.24 CC(C)(C)OC(=O)CBr 2123-9-07 [0,2,0,0,0,0|2,0,0]=4 294 B8R0.24 CC(C)(C)OC(=O)CN 4158-1-32 [0,2,0,0,0,0|2,0,0]=4 295 B8R0.24 CC(C)(C)OC(=O)CN 4158-5-46 [0,2,0,0,0,0|2,0,0]=4 296 B8R0.24 CC(C)(C)OC(=O)NO 4156-1-03 [0,2,0,0,0,0|1,0,0]=3 297 B8R0.24 CNC(=O)OC(C)(C)C 4156-1-36 [0,2,0,0,0,0|2,0,0]=4 298 B8R0.24 COC(=O)CC(F)(F)F 2123-3-66 [0,2,0,0,0,0|2,0,0]=4 299 B8R0.34 COP(C)(=O)OC(C)C 6177-1-0S [0,2,0,0,0,0|2,0,0]=4 300 B8R0.27 CC(C(=O)O)C(F)(F)F 2121-3-F8 [0,2,0,0,0,0|2,0,0]=4 301 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O 4157-1-34 [0,2,0,0,0,0|0,0,0]=2 302 B8R0.27 CC(C)(C)[C@H](N)C(=O)O 4157-1-04 [0,2,0,0,0,0|0,0,0]=2 303 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O 8157-1-X0 [0,2,0,0,0,0|0,0,0]=2 304 B8R0.27 NC(C(=O)O)C(F)(F)F 4157-3-05 [0,2,0,0,0,0|2,0,0]=4 305 B8R0.27 NC(C(=O)O)C(F)(F)F 4157-7-33 [0,2,0,0,0,0|2,0,0]=4 306 B8R0.27 O=C(O)C(Br)C(F)(F)F 2121-B-08 [0,2,0,0,0,0|2,0,0]=4 307 B8R0.27 O=C(O)C(F)C(F)(F)F 2121-3-65 [0,2,0,0,0,0|2,0,0]=4 308 B8R0.27 O=C(O)C(O)C(F)(F)F 2129-3-14 [0,2,0,0,0,0|2,0,0]=4 309 B8R0.27 O=C(O)[C@H](O)C(F)(F)F 2129-3-S1 [0,2,0,0,0,0|2,0,0]=4 310 B8R0.37 O=C(O)C(F)(F)C(F)F 2121-3-36 [0,2,0,0,0,0|2,0,0]=4 311 B6R1.2 CC1CCCC1 1200-1-07 [1,0,0,1,0,0|1,0,1]=4 312 B6R1.2 CC1CCCO1 2H10-1-01 [1,0,0,1,0,0|1,0,1]=4 313 B6R1.2 CC1CCNC1 3H31-5-95 [1,0,0,1,0,0|1,0,1]=4 314 B6R1.2 C[C@H]1CCNC1 3H31-5-S5 [1,0,0,1,0,0|1,0,1]=4 315 B6R1.2 NC1CCOC1 4H30-1-07 [1,0,0,1,0,0|1,0,1]=4 316 B6R1.2 NC1CCOC1 4H56-5-2A [1,0,0,1,0,0|1,0,1]=4 317 B6R1.2 N[C@@H]1CCOC1 4H56-1-R04 [1,0,0,1,0,0|1,0,1]=4 318 B6R1.2 N[C@@H]1CCOC1 4H56-5-R0 [1,0,0,1,0,0|1,0,1]=4 319 B6R1.2 N[C@H]1CCOC1 4H56-1-S13 [1,0,0,1,0,0|1,0,1]=4 320 B6R1.2 O=C1C=CCC1 2417-1-X0 [1,0,0,1,0,0|1,0,1]=4 321 B6R1.2 O=C1CCCC1 2217-1-01 [1,0,0,1,0,0|1,0,0]=3 322 B6R1.2 O=C1CCNC1 4H17-5-04 [1,0,0,1,0,0|2,0,0]=4 323 B6R1.2 O=C1CCOC1 2H17-1-Y1 [1,0,0,1,0,0|2,0,0]=4 324 B6R1.2 O=C1CCSC1 6H66-1-Y6 [1,0,0,1,0,0|2,0,0]=4 325 B6R1.2 O=C1NCCS1 8H70-1-8S [1,0,0,1,0,0|1,1,0]=4 326 B6R1.2 OC1CC=CC1 2402-1-00 [1,0,0,1,0,0|2,0,0]=4 327 B6R1.2 OC1CCOC1 2H10-1-87 [1,0,0,1,0,0|1,0,1]=4 328 B6R1.2 O[C@@H]1CCOC1 2H01-1-Y2 [1,0,0,1,0,0|1,0,1]=4 329 B6R1.2 O[C@H]1CCOC1 G311-A-08 [1,0,0,1,0,0|1,0,1]=4 330 B6R1.2 S=C1CCCN1 7H67-1-31 [1,0,0,1,0,0|1,1,0]=4 331 B6R1.3 NCCC1CC1 3230-5-07 [1,0,0,1,0,0|1,0,1]=4 332 B6R1.3 OCCC1CC1 2201-1-11 [1,0,0,1,0,0|0,0,1]=3 333 B6R1.5 NC1CC(O)C1 4256-1-30 [1,0,0,1,0,0|1,0,1]=4 334 B6R1.10 CC1(C)CNC1 3H31-5-96 [1,0,0,1,0,0|2,0,0]=4 335 B6R1.11 CC(=O)C1CC1 2217-1-X9 [1,0,0,1,0,0|1,0,0]=3 336 B6R1.11 CC(O)C1CC1 2202-1-14 [1,0,0,1,0,0|1,0,1]=4 337 B6R1.11 N=C(N)C1CC1 3241-5-X2 [1,0,0,1,0,0|2,0,0]=4 338 B6R1.11 O=C(Cl)C1CC1 2216-5-X1 [1,0,0,1,0,0|1,0,0]=3 339 B6R1.11 O=C(O)C1CC1 2221-1-X1 [1,0,0,1,0,0|0,0,0]=2 340 B6R1.11 OB(O)C1CC1 P911-A-22 [1,0,0,1,0,0|1,0,1]=4 341 B8R1.3 CN1CCC(=O)CC1 4H56-1-7L [0,0,0,1,0,1|2,0,0]=4 342 B8R1.3 O=C1COC(=O)CO1 2H08-1-X0 [0,0,0,1,0,1|1,0,1]=4 343 B8R1.23 C=C1CC(C(=O)O)C1 2321-1-X3 [0,0,0,1,0,1|0,0,2]=4 344 B8R1.23 CC(=O)N1CC(N)C1 4H48-5-71 [0,0,0,1,0,1|2,0,0]=4 345 B8R1.23 CN1CC(C(=O)O)C1 4H58-1-60 [0,0,0,1,0,1|1,0,0]=3 346 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 2229-1-Z2 [0,0,0,1,0,1|1,0,0]=3 347 B8R1.23 O=C1CC(C(=O)O)C1 P911-A-73 [0,0,0,1,0,1|1,0,1]=4 348 B8R1.51 CC1(C)COC(=S)N1 8H67-1-X7 [0,0,0,1,0,1|1,1,0]=4 349 B8R1.77 O=C(O)C1CC1(F)Cl 2221-7-X0 [0,0,0,1,0,1|2,0,0]=4 350 B8R1.77 O=C(O)C1CC1(F)F 2221-3-X2 [0,0,0,1,0,1|2,0,0]=4 351 B8R1.77 [C@H]1(C(N)=O)CC1(C)C 4248-1-S1 [0,0,0,1,0,1|1,0,0]=3 352 B8R1.1 O=C1CC[C@H](CO)N1 4H48-1-MC [0,1,0,1,0,0|2,0,0]=4 353 B8R1.1 O=C1NCC(CCl)O1 4H56-5-PH [0,1,0,1,0,0|2,0,0]=4 354 B8R1.1 O=C1OCC(CO)O1 2H28-1-37 [0,1,0,1,0,0|1,0,0]=3 355 B8R1.4 CC1CC(=O)CCO1 2H17-1-89 [0,1,0,1,0,0|1,0,0]=3 356 B8R1.4 CC1CC(O)CCO1 2H10-1-83 [0,1,0,1,0,0|1,0,1]=4 357 B8R1.4 CN1CCNC(=O)C1 4H48-1-YY [0,1,0,1,0,0|2,0,0]=4 358 B8R1.18 CC1OC(=O)OC1C 2H28-1-17 [0,1,0,1,0,0|1,0,0]=3 359 B8R1.18 C[C@@H]1OC(=O)O[C@H]1C 2H28-1-E0 [0,1,0,1,0,0|1,0,0]=3 360 B8R1.18 O=C1OC(Cl)C(Cl)O1 2H28-5-01 [0,1,0,1,0,0|2,0,0]=4 361 B8R1.18 O=C1O[C@H](F)[C@@H](F)O1 2H28-3-E0 [0,1,0,1,0,0|2,0,0]=4 362 B8R1.34 CC(=O)NC1CNC1 4H48-5-5Z [0,1,0,1,0,0|2,0,0]=4 363 B8R1.34 O=C(O)C=C1CCC1 2421-1-08 [0,1,0,1,0,0|0,0,2]=4 364 B8R1.34 O=C(O)CC1CNC1 4H22-3-07 [0,1,0,1,0,0|0,0,0]=2 365 B8R1.40 O=C(CCl)NC1CC1 4248-5-01 [0,1,0,1,0,0|2,0,0]=4 366 B8R1.50 O=C1COC(=O)C1Cl 2H18-5-02 [0,1,0,1,0,0|1,0,1]=4 367 B8R2.38 O=C1CCC2CC12 2217-1-33 [0,0,0,2,0,0|1,0,0]=3