0 B6R0.2 CC(=O)CC(C)=O 2118-1-01 [0,0,0,0,0,0|3,0,0]=3 1 B6R0.2 CC(=O)CC(C)C 2118-1-02 [0,0,0,0,0,0|2,0,0]=2 2 B6R0.2 CC(=O)NC(=N)N 3153-1-X0 [0,0,0,0,0,0|4,0,0]=4 3 B6R0.2 CC(=O)\C=C(\C)N 4356-1-06 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.2 CC(=O)\C=C(\C)[O-] 9128-1-X0 [0,0,0,0,0,0|3,0,1]=4 5 B6R0.2 CC(C)=CC(=O)O 2321-1-X4 [0,0,0,0,0,0|2,0,1]=3 6 B6R0.2 CC(C)CB(O)O 6160-1-X3 [0,0,0,0,0,0|3,0,1]=4 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(N)=S 7167-1-18 [0,0,0,0,0,0|2,1,0]=3 9 B6R0.2 CC(Cl)OC(=O)Cl 2116-5-X1 [0,0,0,0,0,0|4,0,0]=4 10 B6R0.2 CC(O)CC(=O)[O-] 2129-1-35 [0,0,0,0,0,0|3,0,0]=3 11 B6R0.2 CN(C)CC(=O)O 4158-1-40 [0,0,0,0,0,0|1,0,0]=1 12 B6R0.2 CN(C)CC(N)=S 7167-5-01 [0,0,0,0,0,0|0,1,0]=1 13 B6R0.2 O=C(O)CC(=O)O 2121-1-05 [0,0,0,0,0,0|4,0,0]=4 14 B5R0.1 C=CCC(C)O 2302-1-00 [1,0,0,0,0,0|3,0,0]=4 15 B5R0.1 CC#CC(=O)O 2521-1-13 [1,0,0,0,0,0|2,0,1]=4 16 B5R0.1 CC(C)CCI 1100-H-X4 [1,0,0,0,0,0|2,0,1]=4 17 B5R0.1 CC(C)CCN 3130-1-X4 [1,0,0,0,0,0|1,0,1]=3 18 B5R0.1 CC(C)CCO 2101-1-53 [1,0,0,0,0,0|1,0,2]=4 19 B5R0.1 CC(C)CNN 3139-5-X0 [1,0,0,0,0,0|2,0,0]=3 20 B5R0.1 CCCC(=O)Cl 2116-5-09 [1,0,0,0,0,0|2,0,0]=3 21 B5R0.1 CCCC(=O)[O-] 2122-1-X1 [1,0,0,0,0,0|2,0,0]=3 22 B5R0.1 CCCC(C)C 1100-1-04 [1,0,0,0,0,0|2,0,1]=4 23 B5R0.1 CCNC(N)=O 4153-1-X1 [1,0,0,0,0,0|2,0,0]=3 24 B5R0.1 CN(C)CC#N 3137-1-03 [1,0,0,0,0,0|0,0,2]=3 25 B5R0.1 CN(C)CCN 3132-1-X2 [1,0,0,0,0,0|0,0,1]=2 26 B5R0.1 COCC(=O)Cl 2116-5-X4 [1,0,0,0,0,0|2,0,0]=3 27 B5R0.1 CSCC(=O)O 6166-1-05 [1,0,0,0,0,0|2,0,0]=3 28 B5R0.1 N#CCC(N)=S 7167-1-W0 [1,0,0,0,0,0|2,1,0]=4 29 B5R0.1 NC(=O)CCBr 4148-9-00 [1,0,0,0,0,0|2,0,0]=3 30 B5R0.1 NC(=O)CCCl 4148-5-02 [1,0,0,0,0,0|2,0,0]=3 31 B5R0.1 O=C(O)CCO 2129-1-Y8 [1,0,0,0,0,0|3,0,0]=4 32 B7R0.2 CC(C)NC(=S)NN 7167-1-17 [0,1,0,0,0,0|2,1,0]=4 33 B7R0.2 CCC(C)CC(C)N 3130-5-X2 [0,1,0,0,0,0|2,0,1]=4 34 B7R0.2 CN(C)CC(O)CO 4156-1-0H [0,1,0,0,0,0|1,0,2]=4 35 B7R0.2 CNC(=O)CC(C)=O 4148-1-51 [0,1,0,0,0,0|2,0,0]=3 36 B7R0.2 COC(=O)CC(=O)Cl 2116-5-X2 [0,1,0,0,0,0|3,0,0]=4 37 B7R0.2 COC(=O)CC(=O)[O-] 2123-1-X2 [0,1,0,0,0,0|3,0,0]=4 38 B7R0.2 COC(=O)CC(C)=O 2129-1-72 [0,1,0,0,0,0|3,0,0]=4 39 B7R0.2 COC(=O)C[C@@H](C)O 2129-1-36 [0,1,0,0,0,0|3,0,0]=4 40 B7R0.9 CC(=O)CS(C)(=O)=O 6163-1-06 [0,1,0,0,0,0|3,0,0]=4 41 B7R0.9 CC(C)(C)CC(=O)O 2121-1-X4 [0,1,0,0,0,0|2,0,0]=3 42 B7R0.9 CC(C)(C)NC(N)=S 7167-1-04 [0,1,0,0,0,0|2,1,0]=4 43 B7R0.9 CC(C)(C)OC(N)=O 4156-1-65 [0,1,0,0,0,0|2,0,0]=3 44 B7R0.9 CC(C)(N)CC(=O)O P911-A-54 [0,1,0,0,0,0|2,0,0]=3 45 B7R0.9 CS(=O)(=O)CC(=O)O 6165-1-01 [0,1,0,0,0,0|3,0,0]=4 46 B7R0.16 CC(=O)C(Cl)C(C)=O 2118-5-01 [0,1,0,0,0,0|3,0,0]=4 47 B7R0.16 CC(C)[C@H](O)C(=O)O 2129-1-S3 [0,1,0,0,0,0|2,0,0]=3 48 B7R0.16 CC(F)C(N)C(=O)O 4157-3-20 [0,1,0,0,0,0|3,0,0]=4 49 B7R0.16 CN(C)C(=O)C(=O)O 4156-1-Z5 [0,1,0,0,0,0|1,0,1]=3 50 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O 4157-1-35 [0,1,0,0,0,0|3,0,0]=4 51 B7R0.16 NC(=O)C(N)C(N)=O 4148-1-07 [0,1,0,0,0,0|3,0,0]=4 52 B7R1.2 CC1=CC(=O)CC1 2417-1-07 [0,0,0,1,0,0|2,0,1]=4 53 B7R1.2 CC1=CC(=O)NO1 4H56-1-4S [0,0,0,1,0,0|2,0,1]=4 54 B7R1.2 CC1=NNC(=O)C1 4H17-1-1W [0,0,0,1,0,0|2,0,0]=3 55 B7R1.2 CN1C=C(N)C=N1 3H32-1-B5 [0,0,0,1,0,0|2,0,1]=4 56 B7R1.2 CN1C=CC(N)=N1 3H30-1-L7 [0,0,0,1,0,0|2,0,1]=4 57 B7R1.2 CN1CCC(O)C1 4H56-1-Z4 [0,0,0,1,0,0|1,0,2]=4 58 B7R1.2 CN1CC[C@@H](O)C1 4H56-1-R1 [0,0,0,1,0,0|1,0,2]=4 59 B7R1.2 CN1CC[C@H](O)C1 4H56-1-S4 [0,0,0,1,0,0|1,0,2]=4 60 B7R1.2 O=C1CCC(=O)C1 P911-A-79 [0,0,0,1,0,0|3,0,0]=4 61 B7R1.2 O=C1COC(=O)C1 2H25-1-29 [0,0,0,1,0,0|3,0,0]=4 62 B7R1.2 O=C1C[C@H](O)CN1 4H20-1-X7 [0,0,0,1,0,0|2,0,0]=3 63 B7R1.12 O=C(O)C1CC1F 2221-3-0B [0,0,0,1,0,0|3,0,0]=4 64 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F 2221-3-25 [0,0,0,1,0,0|3,0,0]=4 65 B7R1.20 O=C(O)CC1CC1 2221-1-X4 [0,0,0,1,0,0|2,0,0]=3 66 B5R0.5 C=C(C)C(C)C 1300-1-24 [0,0,0,0,1,0|3,0,0]=4 67 B5R0.5 CC(=O)C(=O)O 2129-1-03 [0,0,0,0,1,0|3,0,0]=4 68 B5R0.5 CC(=O)C(C)=O 2118-1-05 [0,0,0,0,1,0|3,0,0]=4 69 B5R0.5 CC(=O)C(C)C 2117-1-13 [0,0,0,0,1,0|2,0,0]=3 70 B5R0.5 CC(=O)C(C)F 2117-3-11 [0,0,0,0,1,0|3,0,0]=4 71 B5R0.5 CC(=O)N(C)C 4148-1-08 [0,0,0,0,1,0|1,0,0]=2 72 B5R0.5 CC(Br)C(N)=O 4157-9-X1 [0,0,0,0,1,0|2,0,0]=3 73 B5R0.5 CC(C)=C(C)C 1300-1-X1 [0,0,0,0,1,0|3,0,0]=4 74 B5R0.5 CC(C)C(=N)N 3141-5-X0 [0,0,0,0,1,0|2,0,0]=3 75 B5R0.5 CC(C)C(=O)Cl 2116-5-05 [0,0,0,0,1,0|2,0,0]=3 76 B5R0.5 CC(F)C(=O)O 2121-3-95 [0,0,0,0,1,0|3,0,0]=4 77 B5R0.5 CC(N)C(N)=O 4158-5-X5 [0,0,0,0,1,0|2,0,0]=3 78 B5R0.5 CN(C)C(=N)N 3141-5-00 [0,0,0,0,1,0|1,0,0]=2 79 B5R0.5 CN(C)C(=S)Cl P911-A-76 [0,0,0,0,1,0|1,1,0]=3 80 B5R0.5 CN(C)C(=S)[S-] 5167-1-01 [0,0,0,0,1,0|1,1,0]=3 81 B5R0.5 C[C@@H](Cl)C(=O)O 2121-5-R1 [0,0,0,0,1,0|3,0,0]=4 82 B5R0.5 C[C@@H](O)C(N)=O 4148-1-R1 [0,0,0,0,1,0|2,0,0]=3 83 B5R0.5 C[C@H](N)C(=O)O 4157-1-S5 [0,0,0,0,1,0|3,0,0]=4 84 B5R0.5 C[C@H](N)C(N)=O 4148-5-04 [0,0,0,0,1,0|2,0,0]=3 85 B5R0.5 C[C@H](O)C(=O)O 2129-1-S8 [0,0,0,0,1,0|3,0,0]=4 86 B5R0.5 NC(=O)C(Cl)Cl 4148-5-X4 [0,0,0,0,1,0|3,0,0]=4 87 B5R0.5 NC(=O)C(F)Br 4148-B-02 [0,0,0,0,1,0|3,0,0]=4 88 B5R0.5 NC(=O)C(F)Cl 4148-7-03 [0,0,0,0,1,0|3,0,0]=4 89 B5R0.5 NC(=O)C(F)F 4148-3-18 [0,0,0,0,1,0|3,0,0]=4 90 B5R0.5 NC(=O)C(F)I 4148-K-01 [0,0,0,0,1,0|3,0,0]=4 91 B5R0.5 NC(=O)C(N)=O 4148-1-18 [0,0,0,0,1,0|3,0,0]=4 92 B5R0.5 [C@@H](C)(Cl)C(=O)O 2121-5-S1 [0,0,0,0,1,0|3,0,0]=4 93 B7R0.6 CC(=O)CCC(C)=O 2118-1-25 [0,0,0,0,0,1|3,0,0]=4 94 B7R0.6 CC(=O)OCC(=O)Cl 2129-5-X0 [0,0,0,0,0,1|3,0,0]=4 95 B7R0.6 CC(=O)\C=C\C(C)C 2317-1-04 [0,0,0,0,0,1|2,0,1]=4 96 B7R0.6 CC(C)=NNC(N)=O 4153-1-0A [0,0,0,0,0,1|2,0,0]=3 97 B7R0.6 CC(C)CCC(=O)Cl 2116-5-0A [0,0,0,0,0,1|2,0,0]=3 98 B7R0.6 CC(C)COC(=O)Cl 2123-5-1N [0,0,0,0,0,1|2,0,0]=3 99 B7R0.6 CC(C)OCC(=O)O 2121-1-43 [0,0,0,0,0,1|2,0,0]=3 100 B7R0.6 CC(C)\C=C\C(=O)O 2321-1-13 [0,0,0,0,0,1|2,0,1]=4 101 B7R0.6 CN(C)CCC(=O)O 4158-5-13 [0,0,0,0,0,1|1,0,0]=2 102 B7R0.6 CN(C)CCN(C)C 3132-1-06 [0,0,0,0,0,1|3,0,0]=4 103 B4R0.1 C#CC(N)=O 4148-1-01 [2,0,0,0,0,0|0,0,2]=4 104 B4R0.1 C=C(Br)CC 1300-9-24 [2,0,0,0,0,0|2,0,0]=4 105 B4R0.1 C=C(C)CC 1300-1-21 [2,0,0,0,0,0|2,0,0]=4 106 B4R0.1 C=C(C)CN 3330-1-X1 [2,0,0,0,0,0|1,0,1]=4 107 B4R0.1 C=C(C)CN 3330-5-X0 [2,0,0,0,0,0|1,0,1]=4 108 B4R0.1 C=C(F)CN 3330-3-32 [2,0,0,0,0,0|2,0,0]=4 109 B4R0.1 C=CC(C)C 1300-1-26 [2,0,0,0,0,0|1,0,1]=4 110 B4R0.1 CC(=O)C=O 2117-1-X0 [2,0,0,0,0,0|2,0,0]=4 111 B4R0.1 CC(=O)C=O 2117-1-X0A [2,0,0,0,0,0|2,0,0]=4 112 B4R0.1 CC(=O)CF 2117-3-10 [2,0,0,0,0,0|2,0,0]=4 113 B4R0.1 CC(=O)CO 2120-1-01 [2,0,0,0,0,0|2,0,0]=4 114 B4R0.1 CC(=O)NN 4156-1-2V [2,0,0,0,0,0|2,0,0]=4 115 B4R0.1 CC(C)C=O 2115-1-13 [2,0,0,0,0,0|1,0,0]=3 116 B4R0.1 CC(C)NN 3139-5-X2 [2,0,0,0,0,0|2,0,0]=4 117 B4R0.1 CCC(=N)N 3141-5-03 [2,0,0,0,0,0|1,0,0]=3 118 B4R0.1 CN(C)C=O 4148-1-03 [2,0,0,0,0,0|0,0,0]=2 119 B4R0.1 CNC(N)=S 7167-1-20 [2,0,0,0,0,0|0,1,0]=3 120 B4R0.1 COC(=N)N 8153-1-01 [2,0,0,0,0,0|2,0,0]=4 121 B4R0.1 CSC(=N)N 7167-H-X1 [2,0,0,0,0,0|2,0,0]=4 122 B4R0.1 CSC(=N)N 8167-1-01 [2,0,0,0,0,0|2,0,0]=4 123 B4R0.1 C[C@@H](O)CN 4156-1-R2 [2,0,0,0,0,0|2,0,0]=4 124 B4R0.1 C[C@H](O)CN 4156-1-S2 [2,0,0,0,0,0|2,0,0]=4 125 B4R0.1 N=C(N)CCl 3141-5-X3 [2,0,0,0,0,0|2,0,0]=4 126 B4R0.1 NC(=O)CBr 4148-9-X4 [2,0,0,0,0,0|1,0,0]=3 127 B4R0.1 NC(=O)CCl 4148-5-00 [2,0,0,0,0,0|1,0,0]=3 128 B4R0.1 O=C(Br)CBr 2116-9-03 [2,0,0,0,0,0|2,0,0]=4 129 B4R0.1 O=C(O)CBr 2121-9-01 [2,0,0,0,0,0|2,0,0]=4 130 B4R0.1 O=C(O)CI 2121-H-00 [2,0,0,0,0,0|2,0,0]=4 131 B4R0.1 O=C(O)CO 2129-1-20 [2,0,0,0,0,0|2,0,0]=4 132 B4R0.1 [C@@H](C)(N)CC 3130-1-S1 [2,0,0,0,0,0|1,0,1]=4 133 B4R0.1 [C@H](C)(N)CC 3130-1-R1 [2,0,0,0,0,0|1,0,1]=4 134 B4R0.2 C=CCCC 1300-1-09 [2,0,0,0,0,0|2,0,0]=4 135 B4R0.2 CNCCCl 3133-5-05 [2,0,0,0,0,0|1,0,1]=4 136 B4R0.2 CNCCN 3131-1-11 [2,0,0,0,0,0|0,0,1]=3 137 B4R0.2 CNCCO 4156-1-3Y [2,0,0,0,0,0|0,0,2]=4 138 B4R0.2 COCCN 4130-1-X3 [2,0,0,0,0,0|1,0,1]=4 139 B4R0.2 CSCCN 7166-1-X1 [2,0,0,0,0,0|1,0,1]=4 140 B6R0.1 CCCC(=N)NO 4141-1-X1 [1,1,0,0,0,0|2,0,0]=4 141 B6R0.1 CCCC(=O)NN 4156-1-15 [1,1,0,0,0,0|1,0,0]=3 142 B6R0.1 CCOC(=O)CN 4158-5-25 [1,1,0,0,0,0|2,0,0]=4 143 B6R0.1 CCOC(=O)NN 4156-1-55 [1,1,0,0,0,0|2,0,0]=4 144 B6R0.1 CNC(=O)CC#N 4148-1-X3 [1,1,0,0,0,0|2,0,0]=4 145 B6R0.1 CNC(=O)CCN 4148-1-13 [1,1,0,0,0,0|2,0,0]=4 146 B6R0.1 CNCC(=O)OC 4158-5-X0 [1,1,0,0,0,0|1,0,0]=3 147 B6R0.1 COC(=O)CSC 6166-1-06 [1,1,0,0,0,0|2,0,0]=4 148 B6R0.3 CCC(N)C(=O)O 4157-1-16 [1,1,0,0,0,0|2,0,0]=4 149 B6R0.3 CC[C@H](O)C(=O)O 2129-1-SF [1,1,0,0,0,0|2,0,0]=4 150 B6R0.3 CN(C)C(=S)NN 7167-1-08 [1,1,0,0,0,0|1,0,1]=4 151 B6R0.3 CNC(=O)C(=O)O 4156-1-Y4 [1,1,0,0,0,0|1,0,1]=4 152 B6R0.3 CN[C@@H](C)C(=O)O 4157-1-07 [1,1,0,0,0,0|1,0,0]=3 153 B6R0.3 N#CC(N)C(N)=O 4148-1-X1 [1,1,0,0,0,0|2,0,0]=4 154 B6R0.3 [C@@H](N)(CC)C(=O)O 4157-1-X5 [1,1,0,0,0,0|2,0,0]=4 155 B6R0.3 [C@H](N)(CC)C(=O)O 4157-1-X4 [1,1,0,0,0,0|2,0,0]=4 156 B6R0.4 C#CCNC(N)=O 4553-1-01 [1,1,0,0,0,0|1,0,1]=4 157 B6R0.4 CC(=O)CCCCl 2117-5-52 [1,1,0,0,0,0|2,0,0]=4 158 B6R0.4 CCCCC(=O)O 2121-1-0C [1,1,0,0,0,0|2,0,0]=4 159 B6R0.4 CCCNC(N)=S 7167-1-23 [1,1,0,0,0,0|1,1,0]=4 160 B6R0.4 CCCOC(C)=O 2123-1-32 [1,1,0,0,0,0|2,0,0]=4 161 B6R0.4 CCOCC(=O)Cl 2116-5-0F [1,1,0,0,0,0|2,0,0]=4 162 B6R0.4 CN(C)CCCBr 3132-9-03 [1,1,0,0,0,0|1,0,1]=4 163 B6R0.4 CN(C)CCCCl 3132-5-X0 [1,1,0,0,0,0|1,0,1]=4 164 B6R0.4 CN(C)CCCO 4156-1-40 [1,1,0,0,0,0|0,0,2]=4 165 B6R0.4 CN(C)\C=C\C#N 3337-1-Z0 [1,1,0,0,0,0|0,0,2]=4 166 B6R0.4 CNCCC(N)=O 4148-1-30 [1,1,0,0,0,0|0,0,0]=2 167 B6R0.4 NC(=O)NCCO 4153-1-02 [1,1,0,0,0,0|2,0,0]=4 168 B6R0.4 NCCCC(=O)O 4157-1-X2 [1,1,0,0,0,0|2,0,0]=4 169 B6R0.4 NCCNC(N)=O 4153-5-07 [1,1,0,0,0,0|2,0,0]=4 170 B6R0.4 O=C(Cl)CCCCl 2116-5-X5 [1,1,0,0,0,0|2,0,0]=4 171 B6R0.5 C=CC[Si](C)(C)C 5380-1-01 [1,1,0,0,0,0|2,0,0]=4 172 B6R0.5 C=CC[Si](C)(C)Cl 5381-5-03 [1,1,0,0,0,0|2,0,0]=4 173 B6R0.5 CCCS(N)(=O)=O P612-A-86 [1,1,0,0,0,0|2,0,0]=4 174 B6R0.7 CC(=O)C(C)(C)C 2117-1-05 [0,1,0,0,1,0|2,0,0]=4 175 B6R0.7 CC(C)(Br)C(N)=O 4148-9-X0 [0,1,0,0,1,0|1,0,0]=3 176 B6R0.7 CC(C)(C)C(=N)N 4141-5-X0 [0,1,0,0,1,0|2,0,0]=4 177 B6R0.7 CC(C)(C)C(N)=O 4148-1-26 [0,1,0,0,1,0|1,0,0]=3 178 B6R0.7 CC(C)(C)C(N)=S 7169-1-00 [0,1,0,0,1,0|1,1,0]=4 179 B6R0.7 CC(C)(C)S(N)=O 8169-1-01 [0,1,0,0,1,0|2,0,0]=4 180 B6R0.7 CC(C)(C)[S@@](N)=O 8169-1-S2 [0,1,0,0,1,0|2,0,0]=4 181 B6R0.7 CC(C)(C)[S@](N)=O P311-A-51 [0,1,0,0,1,0|2,0,0]=4 182 B6R0.7 CC(C)(F)C(=O)O 2121-3-57 [0,1,0,0,1,0|2,0,0]=4 183 B6R0.7 CC(C)(O)C(=O)O 2129-1-10 [0,1,0,0,1,0|2,0,0]=4 184 B6R0.7 CC(F)(F)C(N)=O 4148-3-X1 [0,1,0,0,1,0|2,0,0]=4 185 B8R0.23 CC(C)C[C@H](O)C(=O)O 2129-1-SB [0,1,0,0,0,1|2,0,0]=4 186 B8R0.23 CN(C)C(=N)NC(=N)N 3141-5-06 [0,1,0,0,0,1|1,0,1]=4 187 B8R0.29 CC(C)(C)OCC(=O)O 2121-1-X5 [0,1,0,0,0,1|2,0,0]=4 188 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O 4157-1-0X [0,2,0,0,0,0|2,0,0]=4 189 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O 4157-1-19 [0,2,0,0,0,0|2,0,0]=4 190 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O 4158-1-X5 [0,2,0,0,0,0|2,0,0]=4 191 B8R0.5 CCOC(=O)CC(N)=O 4148-1-28 [0,2,0,0,0,0|2,0,0]=4 192 B8R0.5 CCOC(=O)C[S+](C)C 6166-9-X3 [0,2,0,0,0,0|2,0,0]=4 193 B8R0.16 COC(CC(C)=O)OC 2117-1-X6 [0,2,0,0,0,0|2,0,0]=4 194 B8R0.24 CC(C)(C)OC(=O)CN 4158-1-32 [0,2,0,0,0,0|2,0,0]=4 195 B8R0.24 CC(C)(C)OC(=O)CN 4158-5-46 [0,2,0,0,0,0|2,0,0]=4 196 B8R0.24 CC(C)(C)OC(=O)NO 4156-1-03 [0,2,0,0,0,0|2,0,0]=4 197 B8R0.24 CNC(=O)OC(C)(C)C 4156-1-36 [0,2,0,0,0,0|2,0,0]=4 198 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O 4157-1-34 [0,2,0,0,0,0|2,0,0]=4 199 B8R0.27 CC(C)(C)[C@H](N)C(=O)O 4157-1-04 [0,2,0,0,0,0|2,0,0]=4 200 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O 8157-1-X0 [0,2,0,0,0,0|2,0,0]=4 201 B6R1.2 CC1CCNC1 3H31-5-95 [1,0,0,1,0,0|1,0,1]=4 202 B6R1.2 C[C@H]1CCNC1 3H31-5-S5 [1,0,0,1,0,0|1,0,1]=4 203 B6R1.2 O=C1CCCC1 2217-1-01 [1,0,0,1,0,0|2,0,0]=4 204 B6R1.2 O=C1CCNC1 4H17-5-04 [1,0,0,1,0,0|1,0,0]=3 205 B6R1.2 O=C1CCOC1 2H17-1-Y1 [1,0,0,1,0,0|2,0,0]=4 206 B6R1.2 O=C1CCSC1 6H66-1-Y6 [1,0,0,1,0,0|2,0,0]=4 207 B6R1.2 O=C1NCCS1 8H70-1-8S [1,0,0,1,0,0|2,0,0]=4 208 B6R1.2 S=C1CCCN1 7H67-1-31 [1,0,0,1,0,0|1,1,0]=4 209 B6R1.3 NCCC1CC1 3230-5-07 [1,0,0,1,0,0|1,0,1]=4 210 B6R1.11 CC(=O)C1CC1 2217-1-X9 [1,0,0,1,0,0|2,0,0]=4 211 B6R1.11 N=C(N)C1CC1 3241-5-X2 [1,0,0,1,0,0|2,0,0]=4 212 B6R1.11 O=C(Cl)C1CC1 2216-5-X1 [1,0,0,1,0,0|2,0,0]=4 213 B6R1.11 O=C(O)C1CC1 2221-1-X1 [1,0,0,1,0,0|2,0,0]=4 214 B8R1.3 CC1=NNC(=O)CC1 4H56-1-XC [0,0,0,1,0,1|2,0,0]=4 215 B8R1.3 CN1CCC(=O)CC1 4H56-1-7L [0,0,0,1,0,1|1,0,0]=3 216 B8R1.3 CN1CCC(N)CC1 3H32-1-M2 [0,0,0,1,0,1|1,0,1]=4 217 B8R1.3 O=C1CNC(=O)CN1 4H48-1-Q2 [0,0,0,1,0,1|2,0,0]=4 218 B8R1.23 CN1CC(C(=O)O)C1 4H58-1-60 [0,0,0,1,0,1|1,0,0]=3 219 B8R1.51 CC1(C)COC(=S)N1 8H67-1-X7 [0,0,0,1,0,1|1,1,0]=4 220 B8R1.77 [C@H]1(C(N)=O)CC1(C)C 4248-1-S1 [0,0,0,1,0,1|1,0,0]=3 221 B8R1.1 CN1CCC(CN)C1 3H32-1-C0 [0,1,0,1,0,0|1,0,1]=4 222 B8R1.1 O=C1NCC(CCl)O1 4H56-5-PH [0,1,0,1,0,0|2,0,0]=4 223 B8R1.4 CC1CC(=O)CCO1 2H17-1-89 [0,1,0,1,0,0|2,0,0]=4 224 B8R1.4 CN1CCCC(N)C1 3H32-5-Q9 [0,1,0,1,0,0|1,0,1]=4 225 B8R1.4 CN1CCNC(=O)C1 4H48-1-YY [0,1,0,1,0,0|0,0,0]=2 226 B8R1.4 O=C1CCNC(=O)C1 4H48-1-67 [0,1,0,1,0,0|2,0,0]=4 227 B8R1.18 CC1=NN(C)C(=O)C1 4H48-1-U6 [0,1,0,1,0,0|2,0,0]=4 228 B8R1.18 CN1CC(=O)NC1=O 4H48-1-K8 [0,1,0,1,0,0|0,0,1]=3 229 B8R1.34 O=C(O)CC1CNC1 4H22-3-07 [0,1,0,1,0,0|2,0,0]=4 230 B8R2.38 O=C1CCC2CC12 2217-1-33 [0,0,0,2,0,0|2,0,0]=4