0 B7R0.7 BrCCC(=C)CCBr 1P01DHUS [0,0,0,0,0,0|3,0,1]=4 1 B7R0.7 BrCCC(=O)CCBr 1P001CLU [0,0,0,0,0,0|2,1,1]=4 2 B7R0.7 BrCCC(=O)NCC 1P01STCA [0,0,0,0,0,0|2,1,1]=4 3 B7R0.7 BrCCC(=O)OCC 1P0035BI [0,0,0,0,0,0|2,1,1]=4 4 B7R0.7 BrCCC(CCBr)C 1P003E6O [0,0,0,0,0,0|3,0,0]=3 5 B7R0.7 CC(=CCO)CSC 1P028SVZ [0,0,0,0,0,0|2,0,2]=4 6 B7R0.7 CC(N=C=O)CCC 1P01B3IO [0,0,0,0,0,0|2,0,2]=4 7 B7R0.7 CC(N=C=S)CCC 1P002DR3 [0,0,0,0,0,0|2,1,1]=4 8 B7R0.7 CC(SCC)CC=O 1P00C4U2 [0,0,0,0,0,0|2,0,2]=4 9 B7R0.7 CCCC(=C)CCO 1P028FMM [0,0,0,0,0,0|1,0,1]=2 10 B7R0.7 CCCC(=N)OCC 1P00JTEH [0,0,0,0,0,0|3,0,1]=4 11 B7R0.7 CCCC(=O)CCC 1P000KD4 [0,0,0,0,0,0|1,1,1]=3 12 B7R0.7 CCCC(=O)CCN 1P028CRC [0,0,0,0,0,0|1,1,1]=3 13 B7R0.7 CCCC(=O)OCBr 1P0289LM [0,0,0,0,0,0|2,1,1]=4 14 B7R0.7 CCCC(=O)OCC 1P00351H [0,0,0,0,0,0|2,1,1]=4 15 B7R0.7 CCCC(=O)OCCl 1P007D9T [0,0,0,0,0,0|2,1,1]=4 16 B7R0.7 CCCC(CC=C)O 1P003EU9 [0,0,0,0,0,0|1,1,1]=3 17 B7R0.7 CCCC(CC=O)C 1P002GOG [0,0,0,0,0,0|1,0,2]=3 18 B7R0.7 CCCC(CCBr)Br 1P01JTVR [0,0,0,0,0,0|2,0,0]=2 19 B7R0.7 CCCC(CCC)Br 1P003LGL [0,0,0,0,0,0|2,0,0]=2 20 B7R0.7 CCCC(CCC)C 1P003M8N [0,0,0,0,0,0|2,0,0]=2 21 B7R0.7 CCCC(CCC)N 1P001XW6 [0,0,0,0,0,0|2,0,0]=2 22 B7R0.7 CCCC(CCC)O 1P003LXE [0,0,0,0,0,0|1,1,0]=2 23 B7R0.7 CCCC(CCC)S 1P01A89D [0,0,0,0,0,0|1,0,0]=1 24 B7R0.7 CCCC(CCO)C 1P0010Z8 [0,0,0,0,0,0|1,0,0]=1 25 B7R0.7 CCCC(CCO)N 1P005O4J [0,0,0,0,0,0|1,0,0]=1 26 B7R0.7 CCCC(CCO)O 1P00BTGZ [0,0,0,0,0,0|0,1,0]=1 27 B7R0.7 CCCC(CCO)S 1P003K2X [0,0,0,0,0,0|0,0,0]=0 28 B7R0.7 CCCC(CNC)C 1P01FKWE [0,0,0,0,0,0|3,0,0]=3 29 B7R0.7 CCCC(OCC)C 1P0023IU [0,0,0,0,0,0|3,0,0]=3 30 B7R0.7 CCCN(CCC)C 1P003TO7 [0,0,0,0,0,0|3,0,0]=3 31 B7R0.7 CCCN(CCN)C 1P01B6O9 [0,0,0,0,0,0|3,0,0]=3 32 B7R0.7 CCC[C@@H](CCO)N 1P00FEK2 [0,0,0,0,0,0|1,0,0]=1 33 B7R0.7 CCC[C@H](CCO)N 1P01JS6F [0,0,0,0,0,0|1,0,0]=1 34 B7R0.7 CCOC(OCC)C 1P003O2W [0,0,0,0,0,0|4,0,0]=4 35 B7R0.7 CNCC(CCO)C 1P02835R [0,0,0,0,0,0|2,0,0]=2 36 B7R0.7 CNCC(CCO)O 1P0283F3 [0,0,0,0,0,0|1,1,0]=2 37 B7R0.7 CNCC(COC)C 1P027X7U [0,0,0,0,0,0|4,0,0]=4 38 B7R0.7 CNCC(COC)O 1P00F4ZA [0,0,0,0,0,0|3,1,0]=4 39 B7R0.7 CNCC(COC)O 1P019NOY [0,0,0,0,0,0|3,1,0]=4 40 B7R0.7 CNCC(OCC)C 1P004795 [0,0,0,0,0,0|4,0,0]=4 41 B7R0.7 CNC[C@@H](COC)O 1P02939P [0,0,0,0,0,0|3,1,0]=4 42 B7R0.7 COCC(CC#C)N 1P01BYAF [0,0,0,0,0,0|3,0,1]=4 43 B7R0.7 COCC(CC#N)C 1P01C5PF [0,0,0,0,0,0|3,0,1]=4 44 B7R0.7 COCC(CC=O)C 1P0292UC [0,0,0,0,0,0|2,0,2]=4 45 B7R0.7 COCC(CCN)O 1P01A40K [0,0,0,0,0,0|2,1,0]=3 46 B7R0.7 COCC(CCO)C 1P01B2MQ [0,0,0,0,0,0|2,0,0]=2 47 B7R0.7 COCC(CCO)N 1P018STF [0,0,0,0,0,0|2,0,0]=2 48 B7R0.7 COCC(COC)Br 1P01C8JR [0,0,0,0,0,0|4,0,0]=4 49 B7R0.7 COCC(COC)N 1P005AHM [0,0,0,0,0,0|4,0,0]=4 50 B7R0.7 COCC(COC)N 1P009V1E [0,0,0,0,0,0|4,0,0]=4 51 B7R0.7 COCC(COC)O 1P003E0U [0,0,0,0,0,0|3,1,0]=4 52 B7R0.7 COCC(COC)S 1P0291NJ [0,0,0,0,0,0|3,0,0]=3 53 B7R0.7 COCC(CON)O 1P028PHQ [0,0,0,0,0,0|3,1,0]=4 54 B7R0.7 COCC(NCC)C 1P019MEW [0,0,0,0,0,0|4,0,0]=4 55 B7R0.7 COCC(NCC)C 1P019NIR [0,0,0,0,0,0|4,0,0]=4 56 B7R0.7 COC[C@@H](CC#C)O 1P01BU19 [0,0,0,0,0,0|2,1,1]=4 57 B7R0.7 COC[C@H](CC#C)O 1P01BU84 [0,0,0,0,0,0|2,1,1]=4 58 B7R0.7 CSCC(=O)CCN 1P027ZVY [0,0,0,0,0,0|2,1,1]=4 59 B7R0.7 CSCC(CCO)N 1P018SSM [0,0,0,0,0,0|2,0,0]=2 60 B7R0.7 ClCCC(=N)OCC 1P00C39N [0,0,0,0,0,0|3,0,1]=4 61 B7R0.7 ClCCC(=O)CCCl 1P00C63H [0,0,0,0,0,0|2,1,1]=4 62 B7R0.7 ClCCC(=O)NCC 1P00C90F [0,0,0,0,0,0|2,1,1]=4 63 B7R0.7 ClCCC(=O)OCC 1P0037NW [0,0,0,0,0,0|2,1,1]=4 64 B7R0.7 ClCCN(CCCl)C 1P0033Q5 [0,0,0,0,0,0|4,0,0]=4 65 B7R0.7 FCCN(CCBr)C 1P028EBT [0,0,0,0,0,0|4,0,0]=4 66 B7R0.7 ICCC(=O)CCI 1P028HD4 [0,0,0,0,0,0|2,1,1]=4 67 B7R0.7 ICCC(=O)OCC 1P003QOM [0,0,0,0,0,0|2,1,1]=4 68 B7R0.7 NCCC(=O)CCN 1P0291V4 [0,0,0,0,0,0|2,1,1]=4 69 B7R0.7 NCCC(=O)OCC 1P003QNU [0,0,0,0,0,0|2,1,1]=4 70 B7R0.7 NCCC(CC#C)O 1P01C0YW [0,0,0,0,0,0|1,1,2]=4 71 B7R0.7 NCCC(CCN)N 1P028ZVA [0,0,0,0,0,0|3,0,0]=3 72 B7R0.7 NCCC(CCN)O 1P028VWF [0,0,0,0,0,0|2,1,0]=3 73 B7R0.7 NCCC(OCC)C 1P028T42 [0,0,0,0,0,0|3,0,0]=3 74 B7R0.7 NCCN(CCF)C 1P0291TF [0,0,0,0,0,0|4,0,0]=4 75 B7R0.7 NCCN(CCN)C 1P003TMY [0,0,0,0,0,0|4,0,0]=4 76 B7R0.7 NCCN(CCO)C 1P00EERP [0,0,0,0,0,0|3,0,0]=3 77 B7R0.7 NCC[C@H](CCO)O 1P02836B [0,0,0,0,0,0|1,1,0]=2 78 B7R0.7 OCCC(=O)CCCl 1P027TLK [0,0,0,0,0,0|1,1,1]=3 79 B7R0.7 OCCC(=O)CCO 1P00BZ06 [0,0,0,0,0,0|1,1,1]=3 80 B7R0.7 OCCC(=O)NCC 1P01BB4T [0,0,0,0,0,0|1,1,1]=3 81 B7R0.7 OCCC(=O)OCC 1P0035BL [0,0,0,0,0,0|1,1,1]=3 82 B7R0.7 OCCC(CCO)C 1P00347M [0,0,0,0,0,0|2,0,0]=2 83 B7R0.7 OCCC(CCO)O 1P00DDUY [0,0,0,0,0,0|1,1,0]=2 84 B7R0.7 OCCC(NCC)C 1P005GLM [0,0,0,0,0,0|2,0,0]=2 85 B7R0.7 OCCN(CC#C)C 1P01ABIH [0,0,0,0,0,0|2,0,2]=4 86 B7R0.7 OCCN(CC=C)C 1P007IKJ [0,0,0,0,0,0|2,0,2]=4 87 B7R0.7 OCCN(CCF)C 1P028JAP [0,0,0,0,0,0|3,0,0]=3 88 B7R0.7 OCCN(CCO)C 1P0035V1 [0,0,0,0,0,0|3,0,0]=3 89 B7R0.7 OCCN(CCO)C 1P0039OU [0,0,0,0,0,0|3,0,0]=3 90 B7R0.7 OCCS(=O)CCO 1P00BE4F [0,0,0,0,0,0|2,1,0]=3 91 B7R0.7 SCCC(=O)OCC 1P003QOP [0,0,0,0,0,0|1,2,1]=4 92 B6R0.1 BrCCC(CBr)Br 1P007ARL [1,0,0,0,0,0|3,0,0]=4 93 B6R0.1 BrCCC(CBr)F 1P01SYS2 [1,0,0,0,0,0|3,0,0]=4 94 B6R0.1 BrCCC(CBr)O 1P003E4L [1,0,0,0,0,0|2,1,0]=4 95 B6R0.1 BrCCC(CC)C 1P00DA2E [1,0,0,0,0,0|2,0,0]=3 96 B6R0.1 BrCCC(CC)O 1P028LP8 [1,0,0,0,0,0|1,1,0]=3 97 B6R0.1 BrCCN(CC)C 1P0284N1 [1,0,0,0,0,0|3,0,0]=4 98 B6R0.1 BrCC[C@H](CC)N 1P028BDQ [1,0,0,0,0,0|2,0,0]=3 99 B6R0.1 CC(C=O)CCC 1P000KD7 [1,0,0,0,0,0|1,0,2]=4 100 B6R0.1 CC(CBr)COC 1P01BL3B [1,0,0,0,0,0|3,0,0]=4 101 B6R0.1 CC(CC)CC#N 1P002LKL [1,0,0,0,0,0|2,0,1]=4 102 B6R0.1 CC(CC)CC=O 1P001RBW [1,0,0,0,0,0|1,0,2]=4 103 B6R0.1 CC(CC)CON 1P01ALR3 [1,0,0,0,0,0|3,0,0]=4 104 B6R0.1 CC(CN)CNC 1P009GBP [1,0,0,0,0,0|3,0,0]=4 105 B6R0.1 CC(CN)COC 1P019YCQ [1,0,0,0,0,0|3,0,0]=4 106 B6R0.1 CC(CN)COC 1P01AG3X [1,0,0,0,0,0|3,0,0]=4 107 B6R0.1 CC(CN)CSC 1P01AI97 [1,0,0,0,0,0|3,0,0]=4 108 B6R0.1 CC(CO)CNC 1P019SBY [1,0,0,0,0,0|2,0,0]=3 109 B6R0.1 CC(CO)CNN 1P028D07 [1,0,0,0,0,0|3,0,0]=4 110 B6R0.1 CC(CO)COC 1P01ACWE [1,0,0,0,0,0|2,0,0]=3 111 B6R0.1 CC(CO)CSC 1P01AUUE [1,0,0,0,0,0|2,0,0]=3 112 B6R0.1 CC(CS)COC 1P028GFT [1,0,0,0,0,0|2,1,0]=4 113 B6R0.1 CC(NC)CCO 1P007MHQ [1,0,0,0,0,0|2,0,0]=3 114 B6R0.1 CC(OC)CCN 1P00J2ZL [1,0,0,0,0,0|3,0,0]=4 115 B6R0.1 CC(OC)CCN 1P01A9Y6 [1,0,0,0,0,0|3,0,0]=4 116 B6R0.1 CC(OC)CCO 1P002R7Z [1,0,0,0,0,0|2,0,0]=3 117 B6R0.1 CC(OC)CCS 1P0283KM [1,0,0,0,0,0|2,1,0]=4 118 B6R0.1 CC(SC)CCN 1P01A9TM [1,0,0,0,0,0|3,0,0]=4 119 B6R0.1 CC(SC)CCO 1P00ABIB [1,0,0,0,0,0|2,0,0]=3 120 B6R0.1 CCC(CC#C)Br 1P028Y5P [1,0,0,0,0,0|1,0,2]=4 121 B6R0.1 CCC(CC#C)N 1P01ALFD [1,0,0,0,0,0|1,0,2]=4 122 B6R0.1 CCC(CC#C)N 1P0293WI [1,0,0,0,0,0|1,0,2]=4 123 B6R0.1 CCC(CC#N)N 1P00GAZE [1,0,0,0,0,0|2,0,1]=4 124 B6R0.1 CCC(CC#N)O 1P001294 [1,0,0,0,0,0|1,1,1]=4 125 B6R0.1 CCC(CC=C)N 1P01B82X [1,0,0,0,0,0|1,0,2]=4 126 B6R0.1 CCC(CC=C)O 1P00617Z [1,0,0,0,0,0|0,1,2]=4 127 B6R0.1 CCC(CNN)O 1P0072DM [1,0,0,0,0,0|2,1,0]=4 128 B6R0.1 CCC(CNN)O 1P01C51E [1,0,0,0,0,0|2,1,0]=4 129 B6R0.1 CCC(CON)O 1P028X3A [1,0,0,0,0,0|2,1,0]=4 130 B6R0.1 CCCC(=N)NO 1P002UQT [1,0,0,0,0,0|2,0,1]=4 131 B6R0.1 CCCC(=O)CBr 1P00517X [1,0,0,0,0,0|1,1,1]=4 132 B6R0.1 CCCC(=O)CC 1P003JZA [1,0,0,0,0,0|0,1,1]=3 133 B6R0.1 CCCC(=O)CCl 1P002GN5 [1,0,0,0,0,0|1,1,1]=4 134 B6R0.1 CCCC(=O)CN 1P01C2B2 [1,0,0,0,0,0|1,1,1]=4 135 B6R0.1 CCCC(=O)CO 1P00EZ0V [1,0,0,0,0,0|0,1,1]=3 136 B6R0.1 CCCC(=O)NO 1P00D8ZA [1,0,0,0,0,0|1,1,1]=4 137 B6R0.1 CCCC(=O)OC 1P003SGE [1,0,0,0,0,0|1,1,1]=4 138 B6R0.1 CCCC(=S)OC 1P003SJF [1,0,0,0,0,0|1,0,2]=4 139 B6R0.1 CCCC(C#C)N 1P01B24W [1,0,0,0,0,0|1,0,2]=4 140 B6R0.1 CCCC(C#N)N 1P019NM7 [1,0,0,0,0,0|2,0,1]=4 141 B6R0.1 CCCC(C#N)O 1P00EDK5 [1,0,0,0,0,0|1,1,1]=4 142 B6R0.1 CCCC(C=C)O 1P0035G8 [1,0,0,0,0,0|0,1,2]=4 143 B6R0.1 CCCC(CC)Br 1P003JL2 [1,0,0,0,0,0|1,0,0]=2 144 B6R0.1 CCCC(CC)C 1P003K83 [1,0,0,0,0,0|1,0,0]=2 145 B6R0.1 CCCC(CC)Cl 1P002NSV [1,0,0,0,0,0|1,0,0]=2 146 B6R0.1 CCCC(CC)N 1P00G5JZ [1,0,0,0,0,0|1,0,0]=2 147 B6R0.1 CCCC(CC)O 1P003JZ9 [1,0,0,0,0,0|0,1,0]=2 148 B6R0.1 CCCC(CC)S 1P001UGW [1,0,0,0,0,0|0,0,0]=1 149 B6R0.1 CCCC(CCl)C 1P000YIZ [1,0,0,0,0,0|2,0,0]=3 150 B6R0.1 CCCC(CCl)Cl 1P001XTQ [1,0,0,0,0,0|2,0,0]=3 151 B6R0.1 CCCC(CCl)O 1P01A0X7 [1,0,0,0,0,0|1,1,0]=3 152 B6R0.1 CCCC(CN)C 1P028Y09 [1,0,0,0,0,0|2,0,0]=3 153 B6R0.1 CCCC(CN)N 1P019XKI [1,0,0,0,0,0|2,0,0]=3 154 B6R0.1 CCCC(CO)C 1P003I22 [1,0,0,0,0,0|1,0,0]=2 155 B6R0.1 CCCC(CO)Cl 1P01ANMN [1,0,0,0,0,0|1,0,0]=2 156 B6R0.1 CCCC(CO)N 1P001US0 [1,0,0,0,0,0|1,0,0]=2 157 B6R0.1 CCCC(CO)O 1P00IA05 [1,0,0,0,0,0|0,1,0]=2 158 B6R0.1 CCCC(CO)S 1P028AGF [1,0,0,0,0,0|0,0,0]=1 159 B6R0.1 CCCC(NC)C 1P019NHH [1,0,0,0,0,0|2,0,0]=3 160 B6R0.1 CCC[C@@H](CC)O 1P007MBP [1,0,0,0,0,0|0,1,0]=2 161 B6R0.1 CCC[C@@H](CO)N 1P006XCX [1,0,0,0,0,0|1,0,0]=2 162 B6R0.1 CCC[C@@H](CO)N 1P00IMEX [1,0,0,0,0,0|1,0,0]=2 163 B6R0.1 CCC[C@@H](CO)O 1P002XUM [1,0,0,0,0,0|0,1,0]=2 164 B6R0.1 CCC[C@H](CF)N 1P01DFM7 [1,0,0,0,0,0|2,0,0]=3 165 B6R0.1 CCC[C@H](CO)N 1P003CKG [1,0,0,0,0,0|1,0,0]=2 166 B6R0.1 CCC[C@H](CO)O 1P00845B [1,0,0,0,0,0|0,1,0]=2 167 B6R0.1 CCC\C(=N\O)\N 1P00J2F4 [1,0,0,0,0,0|2,0,1]=4 168 B6R0.1 CCNC(=O)CC 1P003THF [1,0,0,0,0,0|1,1,1]=4 169 B6R0.1 CCNC(=O)CO 1P00FI4I [1,0,0,0,0,0|1,1,1]=4 170 B6R0.1 CCNC(CC)C 1P00C2HF [1,0,0,0,0,0|2,0,0]=3 171 B6R0.1 CCNC(CC)C 1P00J252 [1,0,0,0,0,0|2,0,0]=3 172 B6R0.1 CCNC(CO)C 1P00C2H6 [1,0,0,0,0,0|2,0,0]=3 173 B6R0.1 CCN[C@H](CO)C 1P01AMLY [1,0,0,0,0,0|2,0,0]=3 174 B6R0.1 CCOC(=N)CC 1P00CNWY [1,0,0,0,0,0|2,0,1]=4 175 B6R0.1 CCOC(=O)CC 1P003QXI [1,0,0,0,0,0|1,1,1]=4 176 B6R0.1 CCOC(=O)CO 1P0035CV [1,0,0,0,0,0|1,1,1]=4 177 B6R0.1 CCOC(CC)C 1P003UOV [1,0,0,0,0,0|2,0,0]=3 178 B6R0.1 CCOC(CN)C 1P004FBX [1,0,0,0,0,0|3,0,0]=4 179 B6R0.1 CCOC(CN)C 1P00910W [1,0,0,0,0,0|3,0,0]=4 180 B6R0.1 CCOC(CO)C 1P002FCO [1,0,0,0,0,0|2,0,0]=3 181 B6R0.1 CCOS(=O)CC 1P006I98 [1,0,0,0,0,0|2,1,0]=4 182 B6R0.1 CCSC(=O)CC 1P003UPF [1,0,0,0,0,0|1,1,1]=4 183 B6R0.1 CCSC(=S)CC 1P01DXER [1,0,0,0,0,0|1,0,2]=4 184 B6R0.1 CC[C@H](CC#N)O 1P002C38 [1,0,0,0,0,0|1,1,1]=4 185 B6R0.1 CNC(=O)CCO 1P00FDP7 [1,0,0,0,0,0|1,1,1]=4 186 B6R0.1 CNCC(CC)C 1P01AHGF [1,0,0,0,0,0|2,0,0]=3 187 B6R0.1 CNCC(CC)O 1P024V99 [1,0,0,0,0,0|1,1,0]=3 188 B6R0.1 CNCC(CF)O 1P01E0KU [1,0,0,0,0,0|2,1,0]=4 189 B6R0.1 CNCC(CN)O 1P01BCUO [1,0,0,0,0,0|2,1,0]=4 190 B6R0.1 CNCC(CO)O 1P003K75 [1,0,0,0,0,0|1,1,0]=3 191 B6R0.1 CNCC(OC)C 1P00GW3L [1,0,0,0,0,0|3,0,0]=4 192 B6R0.1 CNCC(SC)C 1P028WMN [1,0,0,0,0,0|3,0,0]=4 193 B6R0.1 CNC[C@@H](CC)O 1P028LOU [1,0,0,0,0,0|1,1,0]=3 194 B6R0.1 CNC[C@@H](OC)C 1P0281A1 [1,0,0,0,0,0|3,0,0]=4 195 B6R0.1 CNC[C@H](CC)O 1P0289AA [1,0,0,0,0,0|1,1,0]=3 196 B6R0.1 CNC[C@H](CO)O 1P0251OY [1,0,0,0,0,0|1,1,0]=3 197 B6R0.1 CNC[C@H](OC)C 1P0280T4 [1,0,0,0,0,0|3,0,0]=4 198 B6R0.1 COC(=O)CCO 1P003S96 [1,0,0,0,0,0|1,1,1]=4 199 B6R0.1 COCC(=O)CC 1P01AK1L [1,0,0,0,0,0|1,1,1]=4 200 B6R0.1 COCC(CBr)O 1P028WWM [1,0,0,0,0,0|2,1,0]=4 201 B6R0.1 COCC(CC)Br 1P01DWQ5 [1,0,0,0,0,0|2,0,0]=3 202 B6R0.1 COCC(CC)N 1P003GSV [1,0,0,0,0,0|2,0,0]=3 203 B6R0.1 COCC(CC)O 1P003EX7 [1,0,0,0,0,0|1,1,0]=3 204 B6R0.1 COCC(CC)S 1P0291KA [1,0,0,0,0,0|1,0,0]=2 205 B6R0.1 COCC(CCl)O 1P003EOM [1,0,0,0,0,0|2,1,0]=4 206 B6R0.1 COCC(CF)O 1P00CALG [1,0,0,0,0,0|2,1,0]=4 207 B6R0.1 COCC(CN)F 1P01APJ4 [1,0,0,0,0,0|3,0,0]=4 208 B6R0.1 COCC(CN)N 1P00067R [1,0,0,0,0,0|3,0,0]=4 209 B6R0.1 COCC(CN)O 1P00GW2U [1,0,0,0,0,0|2,1,0]=4 210 B6R0.1 COCC(CO)N 1P00BCT2 [1,0,0,0,0,0|2,0,0]=3 211 B6R0.1 COCC(CO)N 1P01BH5E [1,0,0,0,0,0|2,0,0]=3 212 B6R0.1 COCC(CO)O 1P003K35 [1,0,0,0,0,0|1,1,0]=3 213 B6R0.1 COC[C@@H](CC)N 1P00FGX9 [1,0,0,0,0,0|2,0,0]=3 214 B6R0.1 COC[C@@H](CF)N 1P028KEA [1,0,0,0,0,0|3,0,0]=4 215 B6R0.1 COC[C@@H](CF)O 1P028KDZ [1,0,0,0,0,0|2,1,0]=4 216 B6R0.1 COC[C@@H](CN)O 1P01B9RG [1,0,0,0,0,0|2,1,0]=4 217 B6R0.1 COC[C@@H](CO)O 1P0290HJ [1,0,0,0,0,0|1,1,0]=3 218 B6R0.1 COC[C@@H](NC)C 1P028QST [1,0,0,0,0,0|3,0,0]=4 219 B6R0.1 COC[C@H](CC)N 1P00FGXE [1,0,0,0,0,0|2,0,0]=3 220 B6R0.1 COC[C@H](CF)N 1P028LTW [1,0,0,0,0,0|3,0,0]=4 221 B6R0.1 COC[C@H](CF)O 1P028JQY [1,0,0,0,0,0|2,1,0]=4 222 B6R0.1 COC[C@H](CN)O 1P01B9RH [1,0,0,0,0,0|2,1,0]=4 223 B6R0.1 COC[C@H](CN)O 1P01EMR9 [1,0,0,0,0,0|2,1,0]=4 224 B6R0.1 COC[C@H](CO)N 1P001G1J [1,0,0,0,0,0|2,0,0]=3 225 B6R0.1 COC[C@H](CO)O 1P005I6I [1,0,0,0,0,0|1,1,0]=3 226 B6R0.1 CONC(CC)C 1P01A1JH [1,0,0,0,0,0|3,0,0]=4 227 B6R0.1 CSCC(=O)CC 1P0012TN [1,0,0,0,0,0|1,1,1]=4 228 B6R0.1 CSCC(CC)N 1P01A52Y [1,0,0,0,0,0|2,0,0]=3 229 B6R0.1 CSCC(CC)O 1P005GLR [1,0,0,0,0,0|1,1,0]=3 230 B6R0.1 CSCC(CO)O 1P00BGAN [1,0,0,0,0,0|1,1,0]=3 231 B6R0.1 CSCC(CO)S 1P028JTH [1,0,0,0,0,0|1,0,0]=2 232 B6R0.1 CSCC(NC)C 1P018SCY [1,0,0,0,0,0|3,0,0]=4 233 B6R0.1 CSC[C@@H](CN)O 1P027X79 [1,0,0,0,0,0|2,1,0]=4 234 B6R0.1 CSC[C@@H](CO)N 1P028W67 [1,0,0,0,0,0|2,0,0]=3 235 B6R0.1 CSC[C@H](CN)O 1P0280WA [1,0,0,0,0,0|2,1,0]=4 236 B6R0.1 CSC[C@H](CO)N 1P004DS3 [1,0,0,0,0,0|2,0,0]=3 237 B6R0.1 C[C@@H](CO)CNC 1P027V9N [1,0,0,0,0,0|2,0,0]=3 238 B6R0.1 C[C@@H](NC)CCO 1P027OJ6 [1,0,0,0,0,0|2,0,0]=3 239 B6R0.1 C[C@H](CO)CNC 1P02931Y [1,0,0,0,0,0|2,0,0]=3 240 B6R0.1 C[C@H](NC)CCO 1P027OLB [1,0,0,0,0,0|2,0,0]=3 241 B6R0.1 ClCCC(CC)C 1P01BL7F [1,0,0,0,0,0|2,0,0]=3 242 B6R0.1 ClCCC(CC)Cl 1P007JYP [1,0,0,0,0,0|2,0,0]=3 243 B6R0.1 ClCCC(CCl)O 1P003E4R [1,0,0,0,0,0|2,1,0]=4 244 B6R0.1 ClCCC(CO)C 1P027OYJ [1,0,0,0,0,0|2,0,0]=3 245 B6R0.1 ClCCS(=O)CC 1P01HOTP [1,0,0,0,0,0|2,1,0]=4 246 B6R0.1 FCCC(CO)N 1P01BDLW [1,0,0,0,0,0|2,0,0]=3 247 B6R0.1 FCC[C@@H](CO)O 1P028CF6 [1,0,0,0,0,0|1,1,0]=3 248 B6R0.1 FCC[C@H](CO)O 1P028BCV [1,0,0,0,0,0|1,1,0]=3 249 B6R0.1 ICCN(CC)C 1P0290XD [1,0,0,0,0,0|3,0,0]=4 250 B6R0.1 NC(CO)CC#C 1P01BC92 [1,0,0,0,0,0|1,0,2]=4 251 B6R0.1 NC(CO)CC=C 1P00BJSZ [1,0,0,0,0,0|1,0,2]=4 252 B6R0.1 NC(CO)CC=C 1P01AC0Y [1,0,0,0,0,0|1,0,2]=4 253 B6R0.1 NCCC(=C)CO 1P01BKU7 [1,0,0,0,0,0|2,0,1]=4 254 B6R0.1 NCCC(=C)CO 1P028SA0 [1,0,0,0,0,0|2,0,1]=4 255 B6R0.1 NCCC(=O)CC 1P028D82 [1,0,0,0,0,0|1,1,1]=4 256 B6R0.1 NCCC(CC)C 1P01B5N1 [1,0,0,0,0,0|2,0,0]=3 257 B6R0.1 NCCC(CC)O 1P002XYG [1,0,0,0,0,0|1,1,0]=3 258 B6R0.1 NCCC(CCl)C 1P028C6J [1,0,0,0,0,0|3,0,0]=4 259 B6R0.1 NCCC(CN)F 1P028EPS [1,0,0,0,0,0|3,0,0]=4 260 B6R0.1 NCCC(CN)O 1P02010R [1,0,0,0,0,0|2,1,0]=4 261 B6R0.1 NCCC(CO)C 1P003L5C [1,0,0,0,0,0|2,0,0]=3 262 B6R0.1 NCCC(CO)C 1P028TNW [1,0,0,0,0,0|2,0,0]=3 263 B6R0.1 NCCC(CO)O 1P004KQO [1,0,0,0,0,0|1,1,0]=3 264 B6R0.1 NCCC(CO)O 1P008I9N [1,0,0,0,0,0|1,1,0]=3 265 B6R0.1 NCCC(CS)C 1P028UTC [1,0,0,0,0,0|2,1,0]=4 266 B6R0.1 NCCN(CC)C 1P007TLV [1,0,0,0,0,0|3,0,0]=4 267 B6R0.1 NCCN(CC)C 1P01FJYF [1,0,0,0,0,0|3,0,0]=4 268 B6R0.1 NCCS(=O)CC 1P018HD6 [1,0,0,0,0,0|2,1,0]=4 269 B6R0.1 NCC[C@@H](CN)F 1P028CUO [1,0,0,0,0,0|3,0,0]=4 270 B6R0.1 NCC[C@H](CO)C 1P003CQO [1,0,0,0,0,0|2,0,0]=3 271 B6R0.1 NCC[C@H](CO)O 1P01FJY8 [1,0,0,0,0,0|1,1,0]=3 272 B6R0.1 N[C@@H](CO)CC=C 1P00IHR8 [1,0,0,0,0,0|1,0,2]=4 273 B6R0.1 N[C@@H](CO)CC=C 1P028ZL4 [1,0,0,0,0,0|1,0,2]=4 274 B6R0.1 N[C@H](CO)CC=C 1P00IHR7 [1,0,0,0,0,0|1,0,2]=4 275 B6R0.1 OC(C=C)CCO 1P01IK6E [1,0,0,0,0,0|0,1,2]=4 276 B6R0.1 OC(CO)CC#N 1P028OR8 [1,0,0,0,0,0|1,1,1]=4 277 B6R0.1 OCC(CC=C)Br 1P02848A [1,0,0,0,0,0|1,0,2]=4 278 B6R0.1 OCCC(=C)CC 1P007UQT [1,0,0,0,0,0|1,0,1]=3 279 B6R0.1 OCCC(CC)C 1P003K5F [1,0,0,0,0,0|1,0,0]=2 280 B6R0.1 OCCC(CC)N 1P01AKWW [1,0,0,0,0,0|1,0,0]=2 281 B6R0.1 OCCC(CC)N 1P01XD7X [1,0,0,0,0,0|1,0,0]=2 282 B6R0.1 OCCC(CC)O 1P00CZR5 [1,0,0,0,0,0|0,1,0]=2 283 B6R0.1 OCCC(CC)S 1P01FGKM [1,0,0,0,0,0|0,0,0]=1 284 B6R0.1 OCCC(CN)C 1P019T9G [1,0,0,0,0,0|2,0,0]=3 285 B6R0.1 OCCC(CN)N 1P01AL1F [1,0,0,0,0,0|2,0,0]=3 286 B6R0.1 OCCC(CO)C 1P002YPC [1,0,0,0,0,0|2,0,0]=3 287 B6R0.1 OCCC(CO)N 1P01B4Y6 [1,0,0,0,0,0|2,0,0]=3 288 B6R0.1 OCCC(CO)O 1P00319T [1,0,0,0,0,0|1,1,0]=3 289 B6R0.1 OCCN(CC)C 1P00BI0H [1,0,0,0,0,0|2,0,0]=3 290 B6R0.1 OCCN(CC)N 1P01C4O7 [1,0,0,0,0,0|2,0,0]=3 291 B6R0.1 OCC[C@@H](CC)N 1P028XN3 [1,0,0,0,0,0|1,0,0]=2 292 B6R0.1 OCC[C@@H](CCl)O 1P001AHD [1,0,0,0,0,0|1,1,0]=3 293 B6R0.1 OCC[C@@H](CN)O 1P028S0I [1,0,0,0,0,0|1,1,0]=3 294 B6R0.1 OCC[C@@H](CO)C 1P003CUE [1,0,0,0,0,0|2,0,0]=3 295 B6R0.1 OCC[C@@H](CO)F 1P0284NK [1,0,0,0,0,0|2,0,0]=3 296 B6R0.1 OCC[C@@H](CO)N 1P01BHZO [1,0,0,0,0,0|2,0,0]=3 297 B6R0.1 OCC[C@@H](CO)O 1P0032WY [1,0,0,0,0,0|1,1,0]=3 298 B6R0.1 OCC[C@H](CC)N 1P028ZSN [1,0,0,0,0,0|1,0,0]=2 299 B6R0.1 OCC[C@H](CN)N 1P01AMDG [1,0,0,0,0,0|2,0,0]=3 300 B6R0.1 OCC[C@H](CO)N 1P00IDL8 [1,0,0,0,0,0|2,0,0]=3 301 B6R0.1 OCC[C@H](CO)O 1P003CL8 [1,0,0,0,0,0|1,1,0]=3 302 B6R0.1 OC\C=C(/CC)\C 1P0031SF [1,0,0,0,0,0|1,0,2]=4 303 B6R0.1 OC\C=C(\CC)/C 1P0031SO [1,0,0,0,0,0|1,0,2]=4 304 B6R0.1 O[C@@H](CO)CC#C 1P028UNP [1,0,0,0,0,0|0,1,2]=4 305 B6R0.1 O[C@H](CO)CC#C 1P028JEU [1,0,0,0,0,0|0,1,2]=4 306 B6R0.1 SCCC(=O)CC 1P01BV4A [1,0,0,0,0,0|0,2,1]=4 307 B6R0.1 SCCN(CC)C 1P01DX0O [1,0,0,0,0,0|2,1,0]=4 308 B6R0.1 SCC[C@@H](CS)N 1P00A0DB [1,0,0,0,0,0|2,1,0]=4 309 B6R0.6 BrCCCCC#C 1P005RYA [1,0,0,0,0,0|1,0,2]=4 310 B6R0.6 BrCCCCC#N 1P003N1Z [1,0,0,0,0,0|2,0,1]=4 311 B6R0.6 BrCCCCC=C 1P003N8U [1,0,0,0,0,0|1,0,2]=4 312 B6R0.6 BrCCCCC=O 1P000IND [1,0,0,0,0,0|1,0,2]=4 313 B6R0.6 BrCCCCCBr 1P00333X [1,0,0,0,0,0|2,0,0]=3 314 B6R0.6 BrCCCOCC 1P00336B [1,0,0,0,0,0|2,0,0]=3 315 B6R0.6 BrCCCSCC 1P019SO2 [1,0,0,0,0,0|2,0,0]=3 316 B6R0.6 BrCCNCCBr 1P0037Y8 [1,0,0,0,0,0|3,0,0]=4 317 B6R0.6 BrCCOCCBr 1P003FQW [1,0,0,0,0,0|3,0,0]=4 318 B6R0.6 CC#CCCCN 1P028W0J [1,0,0,0,0,0|1,0,2]=4 319 B6R0.6 CC#CCCCO 1P00GV5D [1,0,0,0,0,0|0,0,2]=3 320 B6R0.6 CC=CCCCO 1P00EG91 [1,0,0,0,0,0|0,0,2]=3 321 B6R0.6 CCCC#CCO 1P003RBZ [1,0,0,0,0,0|0,0,2]=3 322 B6R0.6 CCCCCC#C 1P003EUC [1,0,0,0,0,0|1,0,1]=3 323 B6R0.6 CCCCCC=C 1P003EUA [1,0,0,0,0,0|1,0,1]=3 324 B6R0.6 CCCCCC=O 1P0033AJ [1,0,0,0,0,0|0,0,2]=3 325 B6R0.6 CCCCCCBr 1P0035GN [1,0,0,0,0,0|1,0,0]=2 326 B6R0.6 CCCCCCN 1P001I02 [1,0,0,0,0,0|1,0,0]=2 327 B6R0.6 CCCCCCN 1P005P82 [1,0,0,0,0,0|1,0,0]=2 328 B6R0.6 CCCCCCO 1P003RDW [1,0,0,0,0,0|0,0,0]=1 329 B6R0.6 CCCCCC[Mg+] 1P003RE7 [1,0,0,0,0,0|1,0,0]=2 330 B6R0.6 CCCCCNC 1P003TP3 [1,0,0,0,0,0|2,0,0]=3 331 B6R0.6 CCCCCNN 1P00HWX3 [1,0,0,0,0,0|2,0,0]=3 332 B6R0.6 CCCCCSC 1P001ZXE [1,0,0,0,0,0|2,0,0]=3 333 B6R0.6 CCCCC[Mg]Br 1P003TRJ [1,0,0,0,0,0|2,0,0]=3 334 B6R0.6 CCCCN=C=O 1P0035IG [1,0,0,0,0,0|1,0,2]=4 335 B6R0.6 CCCCN=C=S 1P003P2N [1,0,0,0,0,0|1,1,1]=4 336 B6R0.6 CCCCN=[N+]=N 1P0061PU [1,0,0,0,0,0|3,0,0]=4 337 B6R0.6 CCCCNC=O 1P004TQ7 [1,0,0,0,0,0|1,0,2]=4 338 B6R0.6 CCCCNCC 1P009AZS [1,0,0,0,0,0|2,0,0]=3 339 B6R0.6 CCCCOC=C 1P0038FE [1,0,0,0,0,0|2,0,1]=4 340 B6R0.6 CCCCOCCl 1P002NYD [1,0,0,0,0,0|2,0,0]=3 341 B6R0.6 CCCCSC#N 1P00E9MA [1,0,0,0,0,0|2,0,1]=4 342 B6R0.6 CCCCSCC 1P003TBE [1,0,0,0,0,0|2,0,0]=3 343 B6R0.6 CCCNCC#C 1P019XM4 [1,0,0,0,0,0|2,0,1]=4 344 B6R0.6 CCCNCC#N 1P019WXB [1,0,0,0,0,0|2,0,1]=4 345 B6R0.6 CCCNCC=C 1P00EEVI [1,0,0,0,0,0|2,0,1]=4 346 B6R0.6 CCCNCC=C 1P00J2H3 [1,0,0,0,0,0|2,0,1]=4 347 B6R0.6 CCCNCCC 1P001HZZ [1,0,0,0,0,0|2,0,0]=3 348 B6R0.6 CCCNCCC 1P003Q57 [1,0,0,0,0,0|2,0,0]=3 349 B6R0.6 CCCNCCN 1P003SVJ [1,0,0,0,0,0|2,0,0]=3 350 B6R0.6 CCCNCCO 1P001URY [1,0,0,0,0,0|1,0,0]=2 351 B6R0.6 CCCOCC#N 1P019XSC [1,0,0,0,0,0|2,0,1]=4 352 B6R0.6 CCCOCCBr 1P024SKS [1,0,0,0,0,0|2,0,0]=3 353 B6R0.6 CCCOCCCl 1P00I8N6 [1,0,0,0,0,0|2,0,0]=3 354 B6R0.6 CCCOCCN 1P003H01 [1,0,0,0,0,0|2,0,0]=3 355 B6R0.6 CCCOCCN 1P028YUN [1,0,0,0,0,0|2,0,0]=3 356 B6R0.6 CCCOCCO 1P003ID8 [1,0,0,0,0,0|1,0,0]=2 357 B6R0.6 CCCOCCS 1P028Y6D [1,0,0,0,0,0|1,1,0]=3 358 B6R0.6 CCCSCCN 1P00C9FB [1,0,0,0,0,0|2,0,0]=3 359 B6R0.6 CCCSSCC 1P0030MR [1,0,0,0,0,0|3,0,0]=4 360 B6R0.6 CCC\C=C\CC 1P001EUK [1,0,0,0,0,0|1,0,2]=4 361 B6R0.6 CCC\C=C\CI 1P000HQT [1,0,0,0,0,0|1,0,2]=4 362 B6R0.6 CCC\C=C\CN 1P01DWZW [1,0,0,0,0,0|1,0,2]=4 363 B6R0.6 CCC\C=C\CO 1P00GS1G [1,0,0,0,0,0|0,0,2]=3 364 B6R0.6 CCNCCC#C 1P028G9J [1,0,0,0,0,0|2,0,1]=4 365 B6R0.6 CCNCCC#N 1P003IOS [1,0,0,0,0,0|2,0,1]=4 366 B6R0.6 CCNCCC=C 1P028RU7 [1,0,0,0,0,0|2,0,1]=4 367 B6R0.6 CCOCCC#C 1P028X5B [1,0,0,0,0,0|2,0,1]=4 368 B6R0.6 CCOCCC#N 1P003JUQ [1,0,0,0,0,0|2,0,1]=4 369 B6R0.6 CCOCCC=C 1P028AU6 [1,0,0,0,0,0|2,0,1]=4 370 B6R0.6 CCOCCC=O 1P00BG9R [1,0,0,0,0,0|1,0,2]=4 371 B6R0.6 CCOCCNN 1P00J2UJ [1,0,0,0,0,0|3,0,0]=4 372 B6R0.6 CCOCCON 1P004104 [1,0,0,0,0,0|3,0,0]=4 373 B6R0.6 CCOCCON 1P01ADLQ [1,0,0,0,0,0|3,0,0]=4 374 B6R0.6 CCOCOCC 1P0038BZ [1,0,0,0,0,0|3,0,0]=4 375 B6R0.6 CCSCCC#C 1P007FXM [1,0,0,0,0,0|2,0,1]=4 376 B6R0.6 CNCCCC#C 1P01FPQR [1,0,0,0,0,0|2,0,1]=4 377 B6R0.6 CNCCCC=C 1P01AK5P [1,0,0,0,0,0|2,0,1]=4 378 B6R0.6 CNCCCC=C 1P01EMGO [1,0,0,0,0,0|2,0,1]=4 379 B6R0.6 CNCCCCBr 1P01FPCH [1,0,0,0,0,0|2,0,0]=3 380 B6R0.6 CNCCCCCl 1P0079M0 [1,0,0,0,0,0|2,0,0]=3 381 B6R0.6 CNCCCCI 1P028S4P [1,0,0,0,0,0|2,0,0]=3 382 B6R0.6 CNCCCCN 1P001KKK [1,0,0,0,0,0|2,0,0]=3 383 B6R0.6 CNCCCCO 1P00745C [1,0,0,0,0,0|1,0,0]=2 384 B6R0.6 CNCCCNC 1P0035S0 [1,0,0,0,0,0|3,0,0]=4 385 B6R0.6 CNCCCOC 1P00DDHK [1,0,0,0,0,0|3,0,0]=4 386 B6R0.6 CNCCCSC 1P01B8I7 [1,0,0,0,0,0|3,0,0]=4 387 B6R0.6 CNCCOCC 1P007B7W [1,0,0,0,0,0|3,0,0]=4 388 B6R0.6 CNCCOCC 1P00AN7H [1,0,0,0,0,0|3,0,0]=4 389 B6R0.6 COBCCCC 1P003P2U [1,0,0,0,0,0|3,0,0]=4 390 B6R0.6 COCCCC#C 1P01B83T [1,0,0,0,0,0|2,0,1]=4 391 B6R0.6 COCCCC#N 1P019VD4 [1,0,0,0,0,0|2,0,1]=4 392 B6R0.6 COCCCC=O 1P00CBQP [1,0,0,0,0,0|1,0,2]=4 393 B6R0.6 COCCCCBr 1P00720Z [1,0,0,0,0,0|2,0,0]=3 394 B6R0.6 COCCCCCl 1P0027AF [1,0,0,0,0,0|2,0,0]=3 395 B6R0.6 COCCCCN 1P00C84L [1,0,0,0,0,0|2,0,0]=3 396 B6R0.6 COCCCCO 1P003E3X [1,0,0,0,0,0|1,0,0]=2 397 B6R0.6 COCCCCS 1P028G1B [1,0,0,0,0,0|1,1,0]=3 398 B6R0.6 COCCCNN 1P00IJ6Z [1,0,0,0,0,0|3,0,0]=4 399 B6R0.6 COCCCOC 1P007UR7 [1,0,0,0,0,0|3,0,0]=4 400 B6R0.6 COCCCON 1P01BBDG [1,0,0,0,0,0|3,0,0]=4 401 B6R0.6 COCCNCC 1P003TGA [1,0,0,0,0,0|3,0,0]=4 402 B6R0.6 COCCNCC 1P00GMCJ [1,0,0,0,0,0|3,0,0]=4 403 B6R0.6 COCCOCCl 1P0033UB [1,0,0,0,0,0|3,0,0]=4 404 B6R0.6 COCCSCCl 1P01BG89 [1,0,0,0,0,0|3,0,0]=4 405 B6R0.6 COCOCCBr 1P003EJB [1,0,0,0,0,0|3,0,0]=4 406 B6R0.6 CONCCCO 1P01FICB [1,0,0,0,0,0|2,0,0]=3 407 B6R0.6 CSC#CCCO 1P0284B8 [1,0,0,0,0,0|1,0,2]=4 408 B6R0.6 CSCCCC#C 1P0292QU [1,0,0,0,0,0|2,0,1]=4 409 B6R0.6 CSCCCC#N 1P00EFCB [1,0,0,0,0,0|2,0,1]=4 410 B6R0.6 CSCCCC=O 1P00D7TQ [1,0,0,0,0,0|1,0,2]=4 411 B6R0.6 CSCCCCN 1P00DAJB [1,0,0,0,0,0|2,0,0]=3 412 B6R0.6 CSCCCCO 1P003KQ9 [1,0,0,0,0,0|1,0,0]=2 413 B6R0.6 CSCCNCC 1P01C5HY [1,0,0,0,0,0|3,0,0]=4 414 B6R0.6 CSSCCCO 1P028DQG [1,0,0,0,0,0|2,0,0]=3 415 B6R0.6 C[NH2+]CCCC[NH3+] 1P0043DY [1,0,0,0,0,0|2,0,0]=3 416 B6R0.6 C\C=C\CCCI 1P028HXK [1,0,0,0,0,0|1,0,2]=4 417 B6R0.6 C\C=C\CCCN 1P023ZOR [1,0,0,0,0,0|1,0,2]=4 418 B6R0.6 C\C=C\CCCO 1P003LXM [1,0,0,0,0,0|0,0,2]=3 419 B6R0.6 ClCCCCC#C 1P003NLU [1,0,0,0,0,0|1,0,2]=4 420 B6R0.6 ClCCCCC#N 1P003N5T [1,0,0,0,0,0|2,0,1]=4 421 B6R0.6 ClCCCCC=O 1P002DET [1,0,0,0,0,0|1,0,2]=4 422 B6R0.6 ClCCCCCBr 1P00336O [1,0,0,0,0,0|2,0,0]=3 423 B6R0.6 ClCCCCCCl 1P00ETQY [1,0,0,0,0,0|2,0,0]=3 424 B6R0.6 ClCCCCCI 1P0037KR [1,0,0,0,0,0|2,0,0]=3 425 B6R0.6 ClCCCOCC 1P007857 [1,0,0,0,0,0|2,0,0]=3 426 B6R0.6 ClCCCOCCl 1P01B67D [1,0,0,0,0,0|3,0,0]=4 427 B6R0.6 ClCCNCCCl 1P003OP1 [1,0,0,0,0,0|3,0,0]=4 428 B6R0.6 ClCCNCCCl 1P00CZOD [1,0,0,0,0,0|3,0,0]=4 429 B6R0.6 ClCCOCCI 1P00I8MV [1,0,0,0,0,0|3,0,0]=4 430 B6R0.6 FCCCCC#N 1P00CWH8 [1,0,0,0,0,0|2,0,1]=4 431 B6R0.6 FCCCCCBr 1P003ELZ [1,0,0,0,0,0|2,0,0]=3 432 B6R0.6 FCCCCCS 1P01K8ZD [1,0,0,0,0,0|1,1,0]=3 433 B6R0.6 FCCCNCC 1P028MP3 [1,0,0,0,0,0|2,0,0]=3 434 B6R0.6 FCCNCCF 1P0284GE [1,0,0,0,0,0|3,0,0]=4 435 B6R0.6 FCCOCCBr 1P028DOE [1,0,0,0,0,0|3,0,0]=4 436 B6R0.6 FCCOCCS 1P028532 [1,0,0,0,0,0|2,1,0]=4 437 B6R0.6 ICCCCC#C 1P002PHI [1,0,0,0,0,0|1,0,2]=4 438 B6R0.6 ICCCCC#N 1P006JEI [1,0,0,0,0,0|2,0,1]=4 439 B6R0.6 ICCCCC=C 1P002IJY [1,0,0,0,0,0|1,0,2]=4 440 B6R0.6 ICCCCCI 1P003E6Z [1,0,0,0,0,0|2,0,0]=3 441 B6R0.6 ICCCOCC 1P000LEZ [1,0,0,0,0,0|2,0,0]=3 442 B6R0.6 ICCOCCI 1P003E6Y [1,0,0,0,0,0|3,0,0]=4 443 B6R0.6 NCCC#CCC 1P023ZIW [1,0,0,0,0,0|1,0,2]=4 444 B6R0.6 NCCC#CCO 1P0285RN [1,0,0,0,0,0|1,0,2]=4 445 B6R0.6 NCCCCC#C 1P000799 [1,0,0,0,0,0|1,0,2]=4 446 B6R0.6 NCCCCC#C 1P00B5EI [1,0,0,0,0,0|1,0,2]=4 447 B6R0.6 NCCCCC#N 1P00F3PE [1,0,0,0,0,0|2,0,1]=4 448 B6R0.6 NCCCCC#N 1P00IMQG [1,0,0,0,0,0|2,0,1]=4 449 B6R0.6 NCCCCC=C 1P007HPO [1,0,0,0,0,0|1,0,2]=4 450 B6R0.6 NCCCCCBr 1P01DLW1 [1,0,0,0,0,0|2,0,0]=3 451 B6R0.6 NCCCCCCl 1P002067 [1,0,0,0,0,0|2,0,0]=3 452 B6R0.6 NCCCCCF 1P00EW9Z [1,0,0,0,0,0|2,0,0]=3 453 B6R0.6 NCCCCCF 1P024WLM [1,0,0,0,0,0|2,0,0]=3 454 B6R0.6 NCCCCCN 1P001FHD [1,0,0,0,0,0|2,0,0]=3 455 B6R0.6 NCCCCCO 1P002QWC [1,0,0,0,0,0|1,0,0]=2 456 B6R0.6 NCCCCCS 1P01BHWZ [1,0,0,0,0,0|1,1,0]=3 457 B6R0.6 NCCCCNO 1P01C2R4 [1,0,0,0,0,0|2,0,0]=3 458 B6R0.6 NCCCNCC 1P0084W6 [1,0,0,0,0,0|2,0,0]=3 459 B6R0.6 NCCCNOC 1P01B5AX [1,0,0,0,0,0|3,0,0]=4 460 B6R0.6 NCCCOCC 1P00IBKM [1,0,0,0,0,0|2,0,0]=3 461 B6R0.6 NCCNCCN 1P002LO7 [1,0,0,0,0,0|3,0,0]=4 462 B6R0.6 NCCNCCN 1P00357B [1,0,0,0,0,0|3,0,0]=4 463 B6R0.6 NCCNCCO 1P0035QW [1,0,0,0,0,0|2,0,0]=3 464 B6R0.6 NCCNCCS 1P01EJ7P [1,0,0,0,0,0|2,1,0]=4 465 B6R0.6 NCCNCCS 1P01EJ8W [1,0,0,0,0,0|2,1,0]=4 466 B6R0.6 NCCNOCC 1P028AXI [1,0,0,0,0,0|3,0,0]=4 467 B6R0.6 NCCOCCBr 1P028NCY [1,0,0,0,0,0|3,0,0]=4 468 B6R0.6 NCCOCCCl 1P00VVOD [1,0,0,0,0,0|3,0,0]=4 469 B6R0.6 NCCOCCF 1P01BEMA [1,0,0,0,0,0|3,0,0]=4 470 B6R0.6 NCCOCCN 1P002UGL [1,0,0,0,0,0|3,0,0]=4 471 B6R0.6 NCCOCCN 1P003FT5 [1,0,0,0,0,0|3,0,0]=4 472 B6R0.6 NCCOCCO 1P0033B3 [1,0,0,0,0,0|2,0,0]=3 473 B6R0.6 NCCOCCS 1P028L1I [1,0,0,0,0,0|2,1,0]=4 474 B6R0.6 NCCSCCN 1P003FTC [1,0,0,0,0,0|3,0,0]=4 475 B6R0.6 NCCSCCO 1P007OA8 [1,0,0,0,0,0|2,0,0]=3 476 B6R0.6 NNCCCCO 1P008H9A [1,0,0,0,0,0|2,0,0]=3 477 B6R0.6 NOCCCCF 1P027UMH [1,0,0,0,0,0|3,0,0]=4 478 B6R0.6 OCCC#CCC 1P0001O9 [1,0,0,0,0,0|0,0,2]=3 479 B6R0.6 OCCC#CCN 1P020M5V [1,0,0,0,0,0|1,0,2]=4 480 B6R0.6 OCCCC#CBr 1P01GHFN [1,0,0,0,0,0|1,0,2]=4 481 B6R0.6 OCCCCC#C 1P0034QT [1,0,0,0,0,0|0,0,2]=3 482 B6R0.6 OCCCCC#C 1P01H94D [1,0,0,0,0,0|0,0,2]=3 483 B6R0.6 OCCCCC#N 1P01AIQX [1,0,0,0,0,0|1,0,1]=3 484 B6R0.6 OCCCCC=C 1P0034QQ [1,0,0,0,0,0|0,0,2]=3 485 B6R0.6 OCCCCC=O 1P003A4R [1,0,0,0,0,0|1,0,1]=3 486 B6R0.6 OCCCCCBr 1P0034P3 [1,0,0,0,0,0|1,0,0]=2 487 B6R0.6 OCCCCCCl 1P0034PV [1,0,0,0,0,0|1,0,0]=2 488 B6R0.6 OCCCCCI 1P00FHY0 [1,0,0,0,0,0|1,0,0]=2 489 B6R0.6 OCCCCCO 1P003E7M [1,0,0,0,0,0|1,0,0]=2 490 B6R0.6 OCCCCCS 1P001UH0 [1,0,0,0,0,0|1,0,0]=2 491 B6R0.6 OCCCNC=O 1P01I7G6 [1,0,0,0,0,0|2,0,1]=4 492 B6R0.6 OCCCNCC 1P003IOQ [1,0,0,0,0,0|1,0,0]=2 493 B6R0.6 OCCCOCC 1P003JU2 [1,0,0,0,0,0|1,0,0]=2 494 B6R0.6 OCCCSCC 1P003IOV [1,0,0,0,0,0|1,0,0]=2 495 B6R0.6 OCCNCC#C 1P007LT5 [1,0,0,0,0,0|1,0,2]=4 496 B6R0.6 OCCNCC=C 1P01AJHW [1,0,0,0,0,0|1,0,2]=4 497 B6R0.6 OCCNCCCl 1P0033AW [1,0,0,0,0,0|2,0,0]=3 498 B6R0.6 OCCNCCO 1P001JNQ [1,0,0,0,0,0|2,0,0]=3 499 B6R0.6 OCCNCCO 1P00356F [1,0,0,0,0,0|2,0,0]=3 500 B6R0.6 OCCNCN=O 1P007MV1 [1,0,0,0,0,0|3,0,0]=4 501 B6R0.6 OCCOCC#C 1P0035ZZ [1,0,0,0,0,0|1,0,2]=4 502 B6R0.6 OCCOCC#N 1P027RW6 [1,0,0,0,0,0|2,0,1]=4 503 B6R0.6 OCCOCC=C 1P003BMO [1,0,0,0,0,0|1,0,2]=4 504 B6R0.6 OCCOCCBr 1P00F1SN [1,0,0,0,0,0|2,0,0]=3 505 B6R0.6 OCCOCCCl 1P0033B8 [1,0,0,0,0,0|2,0,0]=3 506 B6R0.6 OCCOCCF 1P003B11 [1,0,0,0,0,0|2,0,0]=3 507 B6R0.6 OCCOCCI 1P000V2G [1,0,0,0,0,0|2,0,0]=3 508 B6R0.6 OCCOCCO 1P002O7R [1,0,0,0,0,0|2,0,0]=3 509 B6R0.6 OCCOCCO 1P0038F2 [1,0,0,0,0,0|2,0,0]=3 510 B6R0.6 OCCOCCO 1P00IMXM [1,0,0,0,0,0|2,0,0]=3 511 B6R0.6 OCCOCCS 1P002557 [1,0,0,0,0,0|2,0,0]=3 512 B6R0.6 OCCSCC#C 1P00E16I [1,0,0,0,0,0|1,0,2]=4 513 B6R0.6 OCCSCC#N 1P0285JU [1,0,0,0,0,0|2,0,1]=4 514 B6R0.6 OCCSCCS 1P01BG7O [1,0,0,0,0,0|2,0,0]=3 515 B6R0.6 OCC\C=C/CC 1P00377Y [1,0,0,0,0,0|0,0,2]=3 516 B6R0.6 OCC\C=C\CC 1P003VE0 [1,0,0,0,0,0|0,0,2]=3 517 B6R0.6 SCCCCCS 1P003E7N [1,0,0,0,0,0|1,1,0]=3 518 B6R0.6 SCCCOCC 1P0291GZ [1,0,0,0,0,0|1,1,0]=3 519 B6R0.6 SCCOCCS 1P002GBQ [1,0,0,0,0,0|2,1,0]=4 520 B6R0.6 SCCSCCS 1P003OPG [1,0,0,0,0,0|2,1,0]=4 521 B6R0.6 [C-]#[N+]CCCOC 1P00I8P6 [1,0,0,0,0,0|3,0,0]=4 522 B6R0.6 [C-]#[N+]CCCSC 1P01HNOK [1,0,0,0,0,0|3,0,0]=4 523 B6R0.6 [C-]#[N+]CCOCC 1P0287SY [1,0,0,0,0,0|3,0,0]=4 524 B6R0.6 [N-]=[N+]=NCCCO 1P005IPR [1,0,0,0,0,0|3,0,0]=4 525 B8R0.1 CCCC(=O)CCC=C 1P01A9QO [0,1,0,0,0,0|1,1,1]=4 526 B8R0.1 CCCC(=O)OCCO 1P00CZ6O [0,1,0,0,0,0|0,1,1]=3 527 B8R0.1 CCCC(CCC=C)O 1P003BA2 [0,1,0,0,0,0|1,1,0]=3 528 B8R0.1 CCCC(CCCBr)C 1P004CP0 [0,1,0,0,0,0|2,0,0]=3 529 B8R0.1 CCCC(CCCO)C 1P008LVT [0,1,0,0,0,0|1,0,0]=2 530 B8R0.1 CCCC(CCCS)O 1P01BRI8 [0,1,0,0,0,0|0,2,0]=3 531 B8R0.1 CCCCC(=CCO)C 1P028DVK [0,1,0,0,0,0|1,0,2]=4 532 B8R0.1 CCCCC(CCC)Br 1P003VZU [0,1,0,0,0,0|2,0,0]=3 533 B8R0.1 CCCCC(CCC)N 1P019UGO [0,1,0,0,0,0|2,0,0]=3 534 B8R0.1 CCCCC(CCC)O 1P003MEF [0,1,0,0,0,0|1,1,0]=3 535 B8R0.1 CCCCC(CCO)C 1P007BT8 [0,1,0,0,0,0|1,0,0]=2 536 B8R0.1 CCCCC(COC)N 1P01AJYQ [0,1,0,0,0,0|3,0,0]=4 537 B8R0.1 CCCCN(CCN)C 1P00VWVQ [0,1,0,0,0,0|3,0,0]=4 538 B8R0.1 CCCCN(CCO)C 1P002XLB [0,1,0,0,0,0|2,0,0]=3 539 B8R0.1 CCCNC(=O)CCN 1P019WVF [0,1,0,0,0,0|1,1,1]=4 540 B8R0.1 CCCOC(=O)CCN 1P01ABXD [0,1,0,0,0,0|1,1,1]=4 541 B8R0.1 CCNC[C@H](CCC)N 1P028M7C [0,1,0,0,0,0|2,0,0]=3 542 B8R0.1 CCOCC(OCC)C 1P0007EZ [0,1,0,0,0,0|3,0,0]=4 543 B8R0.1 CNCC(CCC=C)O 1P0293AJ [0,1,0,0,0,0|2,1,0]=4 544 B8R0.1 CNCC(COCC)O 1P00QFGG [0,1,0,0,0,0|2,1,0]=4 545 B8R0.1 CNCCN(CCO)C 1P01B6VI [0,1,0,0,0,0|2,0,0]=3 546 B8R0.1 COCC(=O)NCCO 1P00FD0D [0,1,0,0,0,0|1,1,1]=4 547 B8R0.1 COCCC(=N)OCC 1P01B9I2 [0,1,0,0,0,0|2,0,1]=4 548 B8R0.1 COCCC(=O)COC 1P01BBCR [0,1,0,0,0,0|1,1,1]=4 549 B8R0.1 COCCC(=O)OCC 1P003K4O [0,1,0,0,0,0|1,1,1]=4 550 B8R0.1 COCCC(CCBr)C 1P01BL5A [0,1,0,0,0,0|2,0,0]=3 551 B8R0.1 COCCC(COC)N 1P01BCP5 [0,1,0,0,0,0|2,0,0]=3 552 B8R0.1 COCCN(CCN)C 1P01AA5F [0,1,0,0,0,0|3,0,0]=4 553 B8R0.1 COCCN(CCO)C 1P00BFW6 [0,1,0,0,0,0|2,0,0]=3 554 B8R0.1 COCCS(=O)CCN 1P028UXH [0,1,0,0,0,0|2,1,0]=4 555 B8R0.1 CSCCC(CCO)N 1P02933J [0,1,0,0,0,0|1,0,0]=2 556 B8R0.1 ClCCCC(=CCO)C 1P028GIM [0,1,0,0,0,0|1,0,2]=4 557 B8R0.1 NCCC(CCC#C)O 1P01B9W5 [0,1,0,0,0,0|1,1,1]=4 558 B8R0.1 NCCN(CCCF)C 1P027YCD [0,1,0,0,0,0|3,0,0]=4 559 B8R0.1 OCCC(=O)CCC#C 1P001L00 [0,1,0,0,0,0|0,1,2]=4 560 B8R0.1 OCCCC(=O)OCC 1P003B8W [0,1,0,0,0,0|1,1,1]=4 561 B8R0.1 OCCC[C@H](CCO)C 1P0283YB [0,1,0,0,0,0|1,0,0]=2 562 B8R0.1 OCCN(CCCF)C 1P028FIT [0,1,0,0,0,0|2,0,0]=3 563 B8R0.1 OCCNC(=O)CCO 1P01DWXU [0,1,0,0,0,0|1,1,1]=4 564 B8R0.1 OCCNC(=O)CCS 1P01PPE7 [0,1,0,0,0,0|1,1,1]=4 565 B8R0.1 OCCNC(=O)NCC 1P002YKZ [0,1,0,0,0,0|1,1,1]=4 566 B8R0.1 OCCOC(=O)CCS 1P00DCES [0,1,0,0,0,0|1,1,1]=4 567 B8R0.3 CCCC(=O)C(CC)C 1P001PTA [0,1,0,0,0,0|1,1,1]=4 568 B8R0.3 CCCC(=O)C(CO)N 1P01EQG5 [0,1,0,0,0,0|0,1,1]=3 569 B8R0.3 CCCC(C(=NO)O)N 1P00COV0 [0,1,0,0,0,0|2,0,1]=4 570 B8R0.3 CCCC(C(=O)CC)C 1P00ECOZ [0,1,0,0,0,0|2,0,1]=4 571 B8R0.3 CCCC(C(CO)N)C 1P01C4P6 [0,1,0,0,0,0|1,0,0]=2 572 B8R0.3 CCOC(=O)C(CO)C 1P00IG82 [0,1,0,0,0,0|1,1,1]=4 573 B8R0.3 CCOC(=O)C(CO)F 1P00ACGP [0,1,0,0,0,0|1,1,1]=4 574 B8R0.3 CCOC(=O)C(CO)N 1P00C8YR [0,1,0,0,0,0|1,1,1]=4 575 B8R0.3 CCOC(=O)[C@@H](CO)N 1P008V4Z [0,1,0,0,0,0|1,1,1]=4 576 B8R0.3 CCOC(=O)[C@H](CO)N 1P002TB2 [0,1,0,0,0,0|1,1,1]=4 577 B8R0.3 NCCC(C(CC)C)C 1P02812C [0,1,0,0,0,0|2,0,0]=3 578 B8R0.3 NCCC(N(CC)C)C 1P0091AI [0,1,0,0,0,0|3,0,0]=4 579 B8R0.3 NCCN(C(CC)C)C 1P01AAB3 [0,1,0,0,0,0|3,0,0]=4 580 B8R0.3 OCCC(C(CC)C)O 1P027U1U [0,1,0,0,0,0|0,1,0]=2 581 B8R0.3 OCCC(C(CC)O)O 1P028QN1 [0,1,0,0,0,0|0,1,0]=2 582 B8R0.3 O[C@H]([C@@H](CO)O)CC=O 1P00I9ZA [0,1,0,0,0,0|1,1,1]=4 583 B8R0.5 CC(NCC)CC(=O)O 1P01AA3H [0,1,0,0,0,0|2,0,1]=4 584 B8R0.5 CC(NCC)CC(=O)O 1P01AA3Q [0,1,0,0,0,0|2,0,1]=4 585 B8R0.5 CC(SCC)CC(=O)O 1P01E65K [0,1,0,0,0,0|2,0,1]=4 586 B8R0.5 CCCC(=C)CC(=O)O 1P01GCQY [0,1,0,0,0,0|1,0,2]=4 587 B8R0.5 CCCC(=O)CC(=O)O 1P0073KJ [0,1,0,0,0,0|0,1,2]=4 588 B8R0.5 CCCC(=O)CC(C)C 1P003I60 [0,1,0,0,0,0|1,1,1]=4 589 B8R0.5 CCCC(CC(=O)C)C 1P00ECOX [0,1,0,0,0,0|1,0,2]=4 590 B8R0.5 CCCC(CC(=O)O)C 1P00C0ML [0,1,0,0,0,0|1,0,1]=3 591 B8R0.5 CCCC(CC(=O)O)N 1P00EBTZ [0,1,0,0,0,0|1,0,1]=3 592 B8R0.5 CCCC(CC(=O)O)O 1P0006E4 [0,1,0,0,0,0|0,1,1]=3 593 B8R0.5 CCCC(CC(C)C)C 1P003GB5 [0,1,0,0,0,0|2,0,0]=3 594 B8R0.5 CCCC(CC(O)C)C 1P00ECQ1 [0,1,0,0,0,0|1,0,0]=2 595 B8R0.5 CCCN(CC(=O)O)C 1P01ABNR [0,1,0,0,0,0|2,0,1]=4 596 B8R0.5 CCCS(=O)CC(=O)O 1P0013O1 [0,1,0,0,0,0|1,1,1]=4 597 B8R0.5 CCC[C@@H](CC(=O)O)N 1P006D2E [0,1,0,0,0,0|1,0,1]=3 598 B8R0.5 CCC[C@@H](CC(=O)O)N 1P00EM67 [0,1,0,0,0,0|1,0,1]=3 599 B8R0.5 CCC[C@@H](CC(=O)O)O 1P006NFR [0,1,0,0,0,0|0,1,1]=3 600 B8R0.5 CCNC(=O)CC(O)C 1P01C20H [0,1,0,0,0,0|1,1,1]=4 601 B8R0.5 CCOC(=O)CC(O)C 1P0035AE [0,1,0,0,0,0|1,1,1]=4 602 B8R0.5 CCOC(=O)C[C@@H](O)C 1P003QGQ [0,1,0,0,0,0|1,1,1]=4 603 B8R0.5 CNCC(CC(=O)O)O 1P01APWE [0,1,0,0,0,0|1,1,1]=4 604 B8R0.5 COCC(CC(=O)O)C 1P019ZSS [0,1,0,0,0,0|2,0,1]=4 605 B8R0.5 COCC(CC(C)C)O 1P01AH2Y [0,1,0,0,0,0|2,1,0]=4 606 B8R0.5 COC[C@@H](CC(=O)O)N 1P01FISX [0,1,0,0,0,0|2,0,1]=4 607 B8R0.5 COC[C@@H](CC(C)C)N 1P020KUC [0,1,0,0,0,0|3,0,0]=4 608 B8R0.5 FCCN(C[C@@H](O)C)C 1P028RF1 [0,1,0,0,0,0|3,0,0]=4 609 B8R0.5 NCCC(CC(=O)O)C 1P01A1JJ [0,1,0,0,0,0|2,0,1]=4 610 B8R0.5 NCCC(CC(=O)O)O 1P01DIXB [0,1,0,0,0,0|1,1,1]=4 611 B8R0.5 NCC[C@@H](CC(=O)O)N 1P028LAX [0,1,0,0,0,0|2,0,1]=4 612 B8R0.5 NCC[C@@H](CC(=O)O)O 1P028UKC [0,1,0,0,0,0|1,1,1]=4 613 B8R0.5 NCC[C@H](CC(=O)O)C 1P0283UC [0,1,0,0,0,0|2,0,1]=4 614 B8R0.5 NCC[C@H](CC(C)C)N 1P029380 [0,1,0,0,0,0|2,0,0]=3 615 B8R0.5 OCCC(=O)NC(C)C 1P01AIZ8 [0,1,0,0,0,0|1,1,1]=4 616 B8R0.5 OCCC(CC(=O)[O-])C 1P028TXY [0,1,0,0,0,0|2,0,1]=4 617 B8R0.5 OCCC(CC(=O)[O-])O 1P027UD9 [0,1,0,0,0,0|1,1,1]=4 618 B8R0.5 OCCC(CC(C)C)C 1P01G4HE [0,1,0,0,0,0|1,0,0]=2 619 B8R0.5 OCCC(CC(C)C)N 1P01DXAC [0,1,0,0,0,0|1,0,0]=2 620 B8R0.5 OCCN(CC(=O)C)C 1P00C2MY [0,1,0,0,0,0|2,0,1]=4 621 B8R0.5 OCC[C@H](CC(C)C)N 1P01E19E [0,1,0,0,0,0|1,0,0]=2 622 B8R0.22 CCCC(C#N)CCC 1P0014QQ [0,1,0,0,0,0|2,0,0]=3 623 B8R0.22 CCCC(C=O)CCC 1P0024QQ [0,1,0,0,0,0|1,1,0]=3 624 B8R0.22 CCCC(CC=O)CC 1P02938V [0,1,0,0,0,0|1,0,2]=4 625 B8R0.22 CCCC(CCC)CBr 1P0005KA [0,1,0,0,0,0|2,0,0]=3 626 B8R0.22 CCCC(CCC)CN 1P0075UN [0,1,0,0,0,0|2,0,0]=3 627 B8R0.22 CCCC(CCC)CO 1P003IDB [0,1,0,0,0,0|1,1,0]=3 628 B8R0.22 CCCC(CCO)CC 1P028A18 [0,1,0,0,0,0|1,0,0]=2 629 B8R0.22 CCCC(CCO)CN 1P019TAW [0,1,0,0,0,0|1,0,0]=2 630 B8R0.22 CCCC(CCO)SC 1P003IPX [0,1,0,0,0,0|0,0,0]=1 631 B8R0.22 CCCC(OCC)CN 1P01BVJV [0,1,0,0,0,0|3,0,0]=4 632 B8R0.22 CCCN(C=O)CCC 1P0035S9 [0,1,0,0,0,0|2,1,0]=4 633 B8R0.22 CCCN(CCC)CC 1P002IWW [0,1,0,0,0,0|3,0,0]=4 634 B8R0.22 CCCN(CCCl)CC 1P01EM91 [0,1,0,0,0,0|3,0,0]=4 635 B8R0.22 CCCN(CCN)CC 1P019TYF [0,1,0,0,0,0|3,0,0]=4 636 B8R0.22 CCCN(N=O)CCC 1P003TPO [0,1,0,0,0,0|2,1,0]=4 637 B8R0.22 COCC(CCN)OC 1P01B4HF [0,1,0,0,0,0|2,1,0]=4 638 B8R0.22 NCCN(CCO)CC 1P01AD71 [0,1,0,0,0,0|3,0,0]=4 639 B8R0.22 OCCC(CCO)CO 1P003WL3 [0,1,0,0,0,0|1,1,0]=3 640 B8R0.22 OCCN(CCO)CC 1P003TGW [0,1,0,0,0,0|3,0,0]=4 641 B8R0.22 OCCN(N=O)CCO 1P003TPL [0,1,0,0,0,0|2,1,0]=4 642 B8R0.30 BrCCC(CCBr)(C)C 1P00C6P8 [0,1,0,0,0,0|3,0,0]=4 643 B8R0.30 CCCS(=O)(=O)CCC 1P00EEGD [0,1,0,0,0,0|2,1,0]=4 644 B8R0.30 CCCS(=O)(=O)CCCl 1P019XCY [0,1,0,0,0,0|2,1,0]=4 645 B8R0.30 CCCS(=O)(=O)CCO 1P01DWPN [0,1,0,0,0,0|1,1,0]=3 646 B8R0.30 CCC[Si](CCC)(Cl)Cl 1P002M4C [0,1,0,0,0,0|2,1,0]=4 647 B8R0.30 CCC[Sn](CCC)(Cl)Cl 1P003AC2 [0,1,0,0,0,0|3,0,0]=4 648 B8R0.30 CNCC(CCO)(C)C 1P01A4BB [0,1,0,0,0,0|2,0,0]=3 649 B8R0.30 CNCC(CCO)(C)C 1P01AF47 [0,1,0,0,0,0|2,0,0]=3 650 B8R0.30 COCC(CCN)(C)C 1P01BU1F [0,1,0,0,0,0|3,0,0]=4 651 B8R0.30 COCC(CCO)(N)C 1P019YSF [0,1,0,0,0,0|2,0,0]=3 652 B8R0.30 COCC(CCO)(N)C 1P028OTU [0,1,0,0,0,0|2,0,0]=3 653 B8R0.30 CSCC(CCN)(C)C 1P028ZWE [0,1,0,0,0,0|3,0,0]=4 654 B8R0.30 NCCS(=O)(=O)CCO 1P007ZTJ [0,1,0,0,0,0|2,1,0]=4 655 B8R0.30 OCCC(CCO)(C)C 1P00DGTX [0,1,0,0,0,0|2,0,0]=3 656 B8R0.30 OCCC(CCO)(F)F 1P01FFQN [0,1,0,0,0,0|2,0,0]=3 657 B8R0.30 OCCP(=O)(OCC)C 1P027UQM [0,1,0,0,0,0|2,1,0]=4 658 B8R0.30 OCCS(=O)(=N)CCO 1P0290IP [0,1,0,0,0,0|2,1,0]=4 659 B8R0.30 OCCS(=O)(=O)CCBr 1P028IKM [0,1,0,0,0,0|2,1,0]=4 660 B8R0.30 OCCS(=O)(=O)CCO 1P003FQ4 [0,1,0,0,0,0|2,1,0]=4 661 B8R0.30 OCCS(=O)(=O)OCC 1P00ETSO [0,1,0,0,0,0|2,1,0]=4 662 B8R0.30 OCC[N+](CCO)(C)C 1P00C933 [0,1,0,0,0,0|3,0,0]=4 663 B8R1.4 BrC1CCCS(=O)C1 1P01B829 [0,0,0,1,0,0|2,0,1]=4 664 B8R1.4 BrC1CCOC(C1)C 1P00A1PZ [0,0,0,1,0,0|1,0,0]=2 665 B8R1.4 Br[C@@H]1CCO[C@@H](C1)C 1P028WUG [0,0,0,1,0,0|1,0,0]=2 666 B8R1.4 CC1=CC(CCC1)O 1P003K5T [0,0,0,1,0,0|1,0,2]=4 667 B8R1.4 CC1CCCC(=O)C1 1P003K7S [0,0,0,1,0,0|1,0,2]=4 668 B8R1.4 CC1CCCC(C1)Br 1P001AJR [0,0,0,1,0,0|2,0,0]=3 669 B8R1.4 CC1CCCC(C1)I 1P01C3DO [0,0,0,1,0,0|2,0,0]=3 670 B8R1.4 CC1CCCC(C1)N 1P003K7T [0,0,0,1,0,0|2,0,0]=3 671 B8R1.4 CC1CCCC(C1)N 1P00IGBE [0,0,0,1,0,0|2,0,0]=3 672 B8R1.4 CC1CCCC(C1)O 1P003K7R [0,0,0,1,0,0|1,0,0]=2 673 B8R1.4 CC1CCCC(C1)S 1P01A9X3 [0,0,0,1,0,0|1,0,0]=2 674 B8R1.4 CC1CCCC(N1)C 1P003A3M [0,0,0,1,0,0|3,0,0]=4 675 B8R1.4 CC1CCCC(N1)C 1P019LMS [0,0,0,1,0,0|3,0,0]=4 676 B8R1.4 CC1CCOC(=O)C1 1P00978J [0,0,0,1,0,0|2,0,1]=4 677 B8R1.4 CC1CNCC(C1)C 1P00340A [0,0,0,1,0,0|3,0,0]=4 678 B8R1.4 CC1CNCC(C1)N 1P01BD3G [0,0,0,1,0,0|3,0,0]=4 679 B8R1.4 CC1CNCC(C1)O 1P01C2FP [0,0,0,1,0,0|2,0,0]=3 680 B8R1.4 CC1NCCC(=O)C1 1P0013IP [0,0,0,1,0,0|1,1,1]=4 681 B8R1.4 CC1NCCC(=O)C1 1P01EKA7 [0,0,0,1,0,0|1,1,1]=4 682 B8R1.4 CC1NCCS(=O)C1 1P01AKAX [0,0,0,1,0,0|2,1,0]=4 683 B8R1.4 CC1NCCS(=O)C1 1P028FPS [0,0,0,1,0,0|2,1,0]=4 684 B8R1.4 CN1CCCC(C1)Br 1P00A61O [0,0,0,1,0,0|3,0,0]=4 685 B8R1.4 CN1CCCC(C1)N 1P00C61U [0,0,0,1,0,0|3,0,0]=4 686 B8R1.4 CN1CCCC(C1)N 1P00GWCG [0,0,0,1,0,0|3,0,0]=4 687 B8R1.4 CN1CCCC(C1)O 1P003JZS [0,0,0,1,0,0|2,0,0]=3 688 B8R1.4 CN1CCC[C@@H](C1)N 1P000HBR [0,0,0,1,0,0|3,0,0]=4 689 B8R1.4 CN1CCC[C@@H](C1)N 1P00H3FC [0,0,0,1,0,0|3,0,0]=4 690 B8R1.4 CN1CCC[C@@H](C1)O 1P00F5YU [0,0,0,1,0,0|2,0,0]=3 691 B8R1.4 CN1CCC[C@H](C1)N 1P0001IH [0,0,0,1,0,0|3,0,0]=4 692 B8R1.4 CN1CCC[C@H](C1)N 1P000HBS [0,0,0,1,0,0|3,0,0]=4 693 B8R1.4 CN1CCC[C@H](C1)O 1P002X21 [0,0,0,1,0,0|2,0,0]=3 694 B8R1.4 CN1CCNC(C1)C 1P001728 [0,0,0,1,0,0|3,0,0]=4 695 B8R1.4 CN1CCNC(C1)C 1P00BDPC [0,0,0,1,0,0|3,0,0]=4 696 B8R1.4 CN1CCN[C@@H](C1)C 1P000GWR [0,0,0,1,0,0|3,0,0]=4 697 B8R1.4 CN1CCN[C@@H](C1)C 1P0092RN [0,0,0,1,0,0|3,0,0]=4 698 B8R1.4 CN1CCN[C@@H](C1)C 1P01JVC5 [0,0,0,1,0,0|3,0,0]=4 699 B8R1.4 CN1CCN[C@@H](C1)C 1P028J0O [0,0,0,1,0,0|3,0,0]=4 700 B8R1.4 CN1CCN[C@H](C1)C 1P000GWQ [0,0,0,1,0,0|3,0,0]=4 701 B8R1.4 CN1CCN[C@H](C1)C 1P000GY9 [0,0,0,1,0,0|3,0,0]=4 702 B8R1.4 C[C@@H]1CCCC(=O)C1 1P003CM9 [0,0,0,1,0,0|1,0,2]=4 703 B8R1.4 C[C@@H]1CCC[C@@H](C1)N 1P01JVLT [0,0,0,1,0,0|2,0,0]=3 704 B8R1.4 C[C@@H]1CCC[C@@H](N1)C 1P005X8U [0,0,0,1,0,0|3,0,0]=4 705 B8R1.4 C[C@@H]1CCC[C@H](N1)C 1P01BGTS [0,0,0,1,0,0|3,0,0]=4 706 B8R1.4 C[C@@H]1CCN[C@@H](C1)C 1P01C4WU [0,0,0,1,0,0|2,0,0]=3 707 B8R1.4 C[C@@H]1CNC[C@@H](C1)C 1P001K1A [0,0,0,1,0,0|3,0,0]=4 708 B8R1.4 C[C@@H]1NCCC(=O)C1 1P009YI7 [0,0,0,1,0,0|1,1,1]=4 709 B8R1.4 C[C@@H]1NCCC(=O)C1 1P00IDGQ [0,0,0,1,0,0|1,1,1]=4 710 B8R1.4 C[C@H]1CCCC(C1)=O 1P01KFQT [0,0,0,1,0,0|1,0,2]=4 711 B8R1.4 C[C@H]1CCN[C@H](C1)C 1P00ADZG [0,0,0,1,0,0|2,0,0]=3 712 B8R1.4 C[C@H]1CCN[C@H](C1)C 1P01BGSA [0,0,0,1,0,0|2,0,0]=3 713 B8R1.4 C[C@H]1NCCC(=O)C1 1P00HXCI [0,0,0,1,0,0|1,1,1]=4 714 B8R1.4 F[C@@H]1CCN[C@@H](C1)C 1P01XA53 [0,0,0,1,0,0|2,0,0]=3 715 B8R1.4 F[C@@H]1CNC[C@@H](C1)F 1P01JULT [0,0,0,1,0,0|3,0,0]=4 716 B8R1.4 F[C@@H]1CNC[C@H](C1)F 1P02233H [0,0,0,1,0,0|3,0,0]=4 717 B8R1.4 F[C@H]1CNC[C@@H](C1)F 1P01KKDT [0,0,0,1,0,0|3,0,0]=4 718 B8R1.4 NC1CCCC(=O)C1 1P001M8M [0,0,0,1,0,0|1,0,2]=4 719 B8R1.4 NC1CCCC(C1)F 1P01C4GC [0,0,0,1,0,0|2,0,0]=3 720 B8R1.4 NC1CCCC(C1)N 1P003DZC [0,0,0,1,0,0|2,0,0]=3 721 B8R1.4 NC1CCCC(C1)O 1P000T5E [0,0,0,1,0,0|1,0,0]=2 722 B8R1.4 NC1CCCC(C1)O 1P003JE6 [0,0,0,1,0,0|1,0,0]=2 723 B8R1.4 NC1CCNC(C1)C 1P028CNC [0,0,0,1,0,0|2,0,0]=3 724 B8R1.4 NC1CCOC(C1)C 1P003ZKW [0,0,0,1,0,0|1,0,0]=2 725 B8R1.4 NC1CCOC(C1)C 1P00519V [0,0,0,1,0,0|1,0,0]=2 726 B8R1.4 NC1CCSC(C1)C 1P01C7JD [0,0,0,1,0,0|1,1,0]=3 727 B8R1.4 NC1CNCC(C1)O 1P028VR3 [0,0,0,1,0,0|2,0,0]=3 728 B8R1.4 NC1COCC(C1)O 1P00ILO0 [0,0,0,1,0,0|2,0,0]=3 729 B8R1.4 N[C@@H]1CCC[C@@H](C1)N 1P00BFW8 [0,0,0,1,0,0|2,0,0]=3 730 B8R1.4 N[C@@H]1CCC[C@@H](C1)N 1P00DCBD [0,0,0,1,0,0|2,0,0]=3 731 B8R1.4 N[C@@H]1CCC[C@@H](C1)O 1P000MNO [0,0,0,1,0,0|1,0,0]=2 732 B8R1.4 N[C@@H]1CCC[C@H](C1)O 1P00I0S7 [0,0,0,1,0,0|1,0,0]=2 733 B8R1.4 N[C@@H]1CCO[C@@H](C1)C 1P024TYS [0,0,0,1,0,0|1,0,0]=2 734 B8R1.4 N[C@@H]1CNC[C@@H](C1)N 1P01EKHI [0,0,0,1,0,0|3,0,0]=4 735 B8R1.4 N[C@@H]1C[C@H](CCC1)O 1P01JIQE [0,0,0,1,0,0|1,0,0]=2 736 B8R1.4 N[C@H]1CCC[C@@H](C1)F 1P00I3Q0 [0,0,0,1,0,0|2,0,0]=3 737 B8R1.4 N[C@H]1CCC[C@@H](C1)N 1P00C3EE [0,0,0,1,0,0|2,0,0]=3 738 B8R1.4 N[C@H]1CCC[C@@H](C1)O 1P000MNP [0,0,0,1,0,0|1,0,0]=2 739 B8R1.4 N[C@H]1CCC[C@H](C1)O 1P003BY7 [0,0,0,1,0,0|1,0,0]=2 740 B8R1.4 N[C@H]1CCC[C@H](C1)O 1P01BBND [0,0,0,1,0,0|1,0,0]=2 741 B8R1.4 N[C@H]1CCO[C@@H](C1)C 1P024TRY [0,0,0,1,0,0|1,0,0]=2 742 B8R1.4 O=C1CCOC(C1)C 1P000J00 [0,0,0,1,0,0|0,1,1]=3 743 B8R1.4 OC1CCCC(=C)C1 1P028FEV [0,0,0,1,0,0|1,0,1]=3 744 B8R1.4 OC1CCCC(=C1)Br 1P028URX [0,0,0,1,0,0|1,0,2]=4 745 B8R1.4 OC1CCCC(=O)C1 1P008LCR [0,0,0,1,0,0|0,1,1]=3 746 B8R1.4 OC1CCCC(C1)O 1P003B2Q [0,0,0,1,0,0|0,1,0]=2 747 B8R1.4 OC1CCNC(=O)C1 1P003LY9 [0,0,0,1,0,0|1,1,1]=4 748 B8R1.4 OC1CCOC(C1)C 1P00GUYD [0,0,0,1,0,0|0,1,0]=2 749 B8R1.4 O[C@@H]1CCC[C@@H](C1)O 1P00352T [0,0,0,1,0,0|0,1,0]=2 750 B8R1.4 O[C@@H]1CCC[C@@H](C1)S 1P028S6R [0,0,0,1,0,0|0,0,0]=1 751 B8R1.4 O[C@@H]1CCC[C@H](C1)O 1P003VBS [0,0,0,1,0,0|0,1,0]=2 752 B8R1.4 O[C@@H]1CCNC(=O)C1 1P008SOD [0,0,0,1,0,0|1,1,1]=4 753 B8R1.4 O[C@@H]1CCN[C@@H](C1)C 1P00IL7I [0,0,0,1,0,0|1,1,0]=3 754 B8R1.4 O[C@@H]1CCN[C@@H](C1)C 1P01C0LN [0,0,0,1,0,0|1,1,0]=3 755 B8R1.4 O[C@@H]1CCO[C@@H](C1)C 1P01JV7T [0,0,0,1,0,0|0,1,0]=2 756 B8R1.4 O[C@@H]1CCO[C@H](C1)C 1P001WUB [0,0,0,1,0,0|0,1,0]=2 757 B8R1.4 O[C@@H]1CNC[C@@H](C1)F 1P01B6RQ [0,0,0,1,0,0|2,0,0]=3 758 B8R1.4 O[C@@H]1CNC[C@@H](C1)O 1P019TRY [0,0,0,1,0,0|1,1,0]=3 759 B8R1.4 O[C@@H]1CNC[C@H](C1)O 1P01XAGI [0,0,0,1,0,0|1,1,0]=3 760 B8R1.4 O[C@H]1CCNC(=O)C1 1P00DK2M [0,0,0,1,0,0|1,1,1]=4 761 B8R1.4 O[C@H]1CCN[C@H](C1)C 1P009SXG [0,0,0,1,0,0|1,1,0]=3 762 B8R1.4 O[C@H]1CCN[C@H](C1)C 1P021VDU [0,0,0,1,0,0|1,1,0]=3 763 B8R1.4 O[C@H]1CCO[C@H](C1)C 1P00IDOT [0,0,0,1,0,0|0,1,0]=2 764 B8R1.4 O[C@H]1CNC[C@@H](C1)O 1P01X6C1 [0,0,0,1,0,0|1,1,0]=3 765 B8R1.4 O[C@H]1CNC[C@H](C1)F 1P028HEZ [0,0,0,1,0,0|2,0,0]=3 766 B8R1.6 BrCCC1CC(C1)F 1P0290ZR [0,0,0,1,0,0|3,0,0]=4 767 B8R1.6 BrCCC1CC(C1)N 1P028CRB [0,0,0,1,0,0|3,0,0]=4 768 B8R1.6 BrCCC1CC(C1)O 1P028PZQ [0,0,0,1,0,0|2,0,0]=3 769 B8R1.6 BrCCC1CN(C1)C 1P01BGLT [0,0,0,1,0,0|3,0,0]=4 770 B8R1.6 CCCC1CC(=O)C1 1P01DYCU [0,0,0,1,0,0|1,0,2]=4 771 B8R1.6 CCCC1CC(=O)N1 1P002M1S [0,0,0,1,0,0|1,0,2]=4 772 B8R1.6 CCCC1CC(C1)Br 1P027YQY [0,0,0,1,0,0|2,0,0]=3 773 B8R1.6 CCCN1CC(C1)N 1P0290ZL [0,0,0,1,0,0|3,0,0]=4 774 B8R1.6 CCCN1CC(C1)O 1P01A735 [0,0,0,1,0,0|2,0,0]=3 775 B8R1.6 CCOC1CC(C1)Cl 1P00651Z [0,0,0,1,0,0|3,0,0]=4 776 B8R1.6 CCOC1CC(C1)N 1P001DAY [0,0,0,1,0,0|3,0,0]=4 777 B8R1.6 CCOC1CC(C1)O 1P01AGPY [0,0,0,1,0,0|2,0,0]=3 778 B8R1.6 CCOC1CC(C1)S 1P0280WE [0,0,0,1,0,0|2,1,0]=4 779 B8R1.6 CCO[C@@H]1C[C@@H](C1)Br 1P028FWI [0,0,0,1,0,0|3,0,0]=4 780 B8R1.6 CCO[C@@H]1C[C@@H](C1)N 1P001D9W [0,0,0,1,0,0|3,0,0]=4 781 B8R1.6 CCO[C@@H]1C[C@@H](C1)O 1P01BCAV [0,0,0,1,0,0|2,0,0]=3 782 B8R1.6 CCO[C@@H]1C[C@H](C1)Br 1P01BFZJ [0,0,0,1,0,0|3,0,0]=4 783 B8R1.6 CCO[C@@H]1C[C@H](C1)N 1P00HWEG [0,0,0,1,0,0|3,0,0]=4 784 B8R1.6 CCO[C@@H]1C[C@H](C1)O 1P01B34B [0,0,0,1,0,0|2,0,0]=3 785 B8R1.6 CNCC1CC(C1)F 1P01DZDL [0,0,0,1,0,0|3,0,0]=4 786 B8R1.6 CNCC1CC(C1)F 1P027XBT [0,0,0,1,0,0|3,0,0]=4 787 B8R1.6 CNC[C@@H]1C[C@@H](C1)O 1P01C0L9 [0,0,0,1,0,0|2,0,0]=3 788 B8R1.6 COCC1CC(C1)Br 1P028OY7 [0,0,0,1,0,0|3,0,0]=4 789 B8R1.6 COCC1CC(C1)N 1P00HGAQ [0,0,0,1,0,0|3,0,0]=4 790 B8R1.6 COCC1CC(C1)N 1P01BSO9 [0,0,0,1,0,0|3,0,0]=4 791 B8R1.6 COCC1CC(C1)O 1P01BIE0 [0,0,0,1,0,0|2,0,0]=3 792 B8R1.6 COCC1CC(C1)S 1P028I4I [0,0,0,1,0,0|2,1,0]=4 793 B8R1.6 COC[C@@H]1C[C@@H](C1)N 1P00HBC8 [0,0,0,1,0,0|3,0,0]=4 794 B8R1.6 COC[C@@H]1C[C@@H](C1)O 1P027RM3 [0,0,0,1,0,0|2,0,0]=3 795 B8R1.6 COC[C@@H]1C[C@H](C1)N 1P01JUWB [0,0,0,1,0,0|3,0,0]=4 796 B8R1.6 COC[C@@H]1C[C@H](C1)N 1P01K87X [0,0,0,1,0,0|3,0,0]=4 797 B8R1.6 CSCC1CC(C1)Br 1P028WGV [0,0,0,1,0,0|3,0,0]=4 798 B8R1.6 CSCC1CC(C1)N 1P028L71 [0,0,0,1,0,0|3,0,0]=4 799 B8R1.6 CSCC1CC(C1)O 1P0292LP [0,0,0,1,0,0|2,0,0]=3 800 B8R1.6 CSC[C@@H]1C[C@@H](C1)N 1P028JL1 [0,0,0,1,0,0|3,0,0]=4 801 B8R1.6 CSC[C@@H]1C[C@@H](C1)O 1P027ZH6 [0,0,0,1,0,0|2,0,0]=3 802 B8R1.6 CSC[C@@H]1C[C@H](C1)N 1P028FVS [0,0,0,1,0,0|3,0,0]=4 803 B8R1.6 CSC[C@@H]1C[C@H](C1)O 1P028PMS [0,0,0,1,0,0|2,0,0]=3 804 B8R1.6 FCCC1CC(C1)N 1P027XQD [0,0,0,1,0,0|3,0,0]=4 805 B8R1.6 FCCC1CC(C1)O 1P0281TZ [0,0,0,1,0,0|2,0,0]=3 806 B8R1.6 FCCN1CC(C1)O 1P01B7EE [0,0,0,1,0,0|3,0,0]=4 807 B8R1.6 NCCC1CC(C1)C 1P028TEI [0,0,0,1,0,0|2,0,0]=3 808 B8R1.6 NCCC1CC(C1)O 1P01BEP8 [0,0,0,1,0,0|2,0,0]=3 809 B8R1.6 NCCC1CN(C1)C 1P00HYOF [0,0,0,1,0,0|3,0,0]=4 810 B8R1.6 NCCC1CN(C1)C 1P01EJOF [0,0,0,1,0,0|3,0,0]=4 811 B8R1.6 NCCN1CC(C1)O 1P01EQXJ [0,0,0,1,0,0|3,0,0]=4 812 B8R1.6 NCC[C@@H]1C[C@@H](C1)O 1P00J3D4 [0,0,0,1,0,0|2,0,0]=3 813 B8R1.6 NCC[C@@H]1C[C@H](C1)F 1P01FK47 [0,0,0,1,0,0|3,0,0]=4 814 B8R1.6 NCC[C@@H]1C[C@H](C1)O 1P00J3A6 [0,0,0,1,0,0|2,0,0]=3 815 B8R1.6 NNCC1CC(C1)C 1P01EKG1 [0,0,0,1,0,0|3,0,0]=4 816 B8R1.6 OC1CC(C1)CC#N 1P01DYDI [0,0,0,1,0,0|2,0,1]=4 817 B8R1.6 OCCC1CC(=C)C1 1P01FI45 [0,0,0,1,0,0|1,0,2]=4 818 B8R1.6 OCCC1CC(C1)F 1P028XFH [0,0,0,1,0,0|2,0,0]=3 819 B8R1.6 OCCC1CC(C1)N 1P01C7JN [0,0,0,1,0,0|2,0,0]=3 820 B8R1.6 OCCC1CN(C1)C 1P00126A [0,0,0,1,0,0|2,0,0]=3 821 B8R1.6 OCCN1CC(C1)C 1P01C5B7 [0,0,0,1,0,0|2,0,0]=3 822 B8R1.6 OCCN1CC(C1)F 1P01JUS0 [0,0,0,1,0,0|3,0,0]=4 823 B8R1.6 OCCN1CC(C1)N 1P019GHR [0,0,0,1,0,0|3,0,0]=4 824 B8R1.6 O[C@@H]1C[C@@H](C1)CC#N 1P01FLTZ [0,0,0,1,0,0|2,0,1]=4 825 B8R1.6 O[C@@H]1C[C@H](C1)CC#N 1P0208QY [0,0,0,1,0,0|2,0,1]=4 826 B8R1.6 SCCC1CC(C1)F 1P0286GY [0,0,0,1,0,0|2,1,0]=4 827 B8R1.6 SCCC1CC(C1)N 1P0286EB [0,0,0,1,0,0|2,1,0]=4 828 B8R1.8 BrCCC1CCC=C1 1P0285S5 [0,0,0,1,0,0|2,0,1]=4 829 B8R1.8 BrCCC1CCCC1 1P002INC [0,0,0,1,0,0|2,0,0]=3 830 B8R1.8 BrCCC1CCCN1 1P01C2MU [0,0,0,1,0,0|2,0,0]=3 831 B8R1.8 BrCCC1CCCO1 1P01B1LN [0,0,0,1,0,0|1,1,0]=3 832 B8R1.8 BrCCC1COCC1 1P009ECL [0,0,0,1,0,0|2,0,0]=3 833 B8R1.8 BrCCC1OCCO1 1P0033B5 [0,0,0,1,0,0|2,1,0]=4 834 B8R1.8 BrCCC1SCCS1 1P01B6OE [0,0,0,1,0,0|2,0,0]=3 835 B8R1.8 BrCCN1CCCC1 1P005J5S [0,0,0,1,0,0|3,0,0]=4 836 B8R1.8 C#CCC1CCCN1 1P028CW8 [0,0,0,1,0,0|2,0,1]=4 837 B8R1.8 C#CCC1COCC1 1P028FIZ [0,0,0,1,0,0|1,0,2]=4 838 B8R1.8 C=CCC1CCCN1 1P0046LU [0,0,0,1,0,0|2,0,1]=4 839 B8R1.8 C=CCC1CCCN1 1P01EMFA [0,0,0,1,0,0|2,0,1]=4 840 B8R1.8 C=CCC1CCCO1 1P028QA6 [0,0,0,1,0,0|1,1,1]=4 841 B8R1.8 C=CC[C@@H]1CCCN1 1P01DE4Z [0,0,0,1,0,0|2,0,1]=4 842 B8R1.8 CCCC1CCCN1 1P008W0R [0,0,0,1,0,0|2,0,0]=3 843 B8R1.8 CCCC1CNCC1 1P000DDQ [0,0,0,1,0,0|2,0,0]=3 844 B8R1.8 CCCC1NCCS1 1P01AJ74 [0,0,0,1,0,0|2,0,0]=3 845 B8R1.8 CCCN1CCCC1 1P028HDD [0,0,0,1,0,0|3,0,0]=4 846 B8R1.8 CCNC1CCCC1 1P009AIH [0,0,0,1,0,0|3,0,0]=4 847 B8R1.8 CCNC1CCCC1 1P00DDL3 [0,0,0,1,0,0|3,0,0]=4 848 B8R1.8 CCNC1CNCC1 1P003IOT [0,0,0,1,0,0|3,0,0]=4 849 B8R1.8 CCNC1COCC1 1P000ZGK [0,0,0,1,0,0|2,0,0]=3 850 B8R1.8 CCNC1COCC1 1P00HSEO [0,0,0,1,0,0|2,0,0]=3 851 B8R1.8 CCN[C@@H]1CNCC1 1P003C9Z [0,0,0,1,0,0|3,0,0]=4 852 B8R1.8 CCN[C@H]1CNCC1 1P003C9Q [0,0,0,1,0,0|3,0,0]=4 853 B8R1.8 CCOC1CNCC1 1P009OAP [0,0,0,1,0,0|3,0,0]=4 854 B8R1.8 CCO[C@@H]1CNCC1 1P001J3L [0,0,0,1,0,0|3,0,0]=4 855 B8R1.8 CCO[C@H]1CNCC1 1P003CQB [0,0,0,1,0,0|3,0,0]=4 856 B8R1.8 CCO[C@H]1CNCC1 1P00AO4W [0,0,0,1,0,0|3,0,0]=4 857 B8R1.8 CNCC1CCCC1 1P0038B4 [0,0,0,1,0,0|3,0,0]=4 858 B8R1.8 CNCC1CCCC1 1P00FHVW [0,0,0,1,0,0|3,0,0]=4 859 B8R1.8 CNCC1CCCO1 1P00BF9Z [0,0,0,1,0,0|2,1,0]=4 860 B8R1.8 CNCC1CCCS1 1P028XBK [0,0,0,1,0,0|2,0,0]=3 861 B8R1.8 CNCC1CNCC1 1P006E10 [0,0,0,1,0,0|3,0,0]=4 862 B8R1.8 CNCC1CNCC1 1P01WAOO [0,0,0,1,0,0|3,0,0]=4 863 B8R1.8 CNCC1COCC1 1P002DG7 [0,0,0,1,0,0|2,0,0]=3 864 B8R1.8 CNCC1COCC1 1P005FXK [0,0,0,1,0,0|2,0,0]=3 865 B8R1.8 CNCC1CSCC1 1P0289ZF [0,0,0,1,0,0|2,1,0]=4 866 B8R1.8 CNCC1OCCC1 1P01KZ6C [0,0,0,1,0,0|2,1,0]=4 867 B8R1.8 CNC[C@@H]1CCCN1 1P00HC7R [0,0,0,1,0,0|3,0,0]=4 868 B8R1.8 CNC[C@@H]1CCCN1 1P01KLT3 [0,0,0,1,0,0|3,0,0]=4 869 B8R1.8 CNC[C@@H]1CCCO1 1P01ACR6 [0,0,0,1,0,0|2,1,0]=4 870 B8R1.8 CNC[C@H]1CCCN1 1P00ICBY [0,0,0,1,0,0|3,0,0]=4 871 B8R1.8 COCC1CCCN1 1P005S8H [0,0,0,1,0,0|3,0,0]=4 872 B8R1.8 COCC1CCCN1 1P00ABF5 [0,0,0,1,0,0|3,0,0]=4 873 B8R1.8 COCC1CNCC1 1P00379K [0,0,0,1,0,0|3,0,0]=4 874 B8R1.8 COCC1CNCC1 1P009A42 [0,0,0,1,0,0|3,0,0]=4 875 B8R1.8 COC[C@@H]1CCCN1 1P003CWQ [0,0,0,1,0,0|3,0,0]=4 876 B8R1.8 COC[C@@H]1CCCN1 1P00IJG4 [0,0,0,1,0,0|3,0,0]=4 877 B8R1.8 COC[C@@H]1CNCC1 1P00HWSL [0,0,0,1,0,0|3,0,0]=4 878 B8R1.8 COC[C@H]1CCCN1 1P003CJ7 [0,0,0,1,0,0|3,0,0]=4 879 B8R1.8 COC[C@H]1CCCN1 1P009KFB [0,0,0,1,0,0|3,0,0]=4 880 B8R1.8 COC[C@H]1CNCC1 1P00ILDC [0,0,0,1,0,0|3,0,0]=4 881 B8R1.8 CSCC1CCCN1 1P01A1NJ [0,0,0,1,0,0|3,0,0]=4 882 B8R1.8 CSCC1CNCC1 1P0198RF [0,0,0,1,0,0|3,0,0]=4 883 B8R1.8 CSC[C@@H]1CCCN1 1P0285GO [0,0,0,1,0,0|3,0,0]=4 884 B8R1.8 CSC[C@H]1CCCN1 1P0285HN [0,0,0,1,0,0|3,0,0]=4 885 B8R1.8 ClCCC1CCCC1 1P004S0A [0,0,0,1,0,0|2,0,0]=3 886 B8R1.8 ClCCC1CCCO1 1P01ALGS [0,0,0,1,0,0|1,1,0]=3 887 B8R1.8 ClCCC1COCC1 1P01DVS4 [0,0,0,1,0,0|2,0,0]=3 888 B8R1.8 ClCCN1CCCC1 1P003DAG [0,0,0,1,0,0|3,0,0]=4 889 B8R1.8 ClCCN1CCCC1 1P00D8EJ [0,0,0,1,0,0|3,0,0]=4 890 B8R1.8 ClCOC1CCCC1 1P01BBS7 [0,0,0,1,0,0|3,0,0]=4 891 B8R1.8 FCCC1CNCC1 1P028FR2 [0,0,0,1,0,0|3,0,0]=4 892 B8R1.8 FCCC1CNCC1 1P028ILN [0,0,0,1,0,0|3,0,0]=4 893 B8R1.8 ICCC1CCCC1 1P01RJJX [0,0,0,1,0,0|2,0,0]=3 894 B8R1.8 ICCC1OCCO1 1P01JMOE [0,0,0,1,0,0|2,1,0]=4 895 B8R1.8 ICCN1CCCC1 1P01BWAS [0,0,0,1,0,0|3,0,0]=4 896 B8R1.8 N#CCC1CCCC1 1P00EEC1 [0,0,0,1,0,0|2,0,1]=4 897 B8R1.8 N#CCC1CCCO1 1P003FLJ [0,0,0,1,0,0|1,1,1]=4 898 B8R1.8 N#CCC1COCC1 1P00DDOA [0,0,0,1,0,0|2,0,1]=4 899 B8R1.8 N#CC[C@@H]1CCCN1 1P020KTO [0,0,0,1,0,0|2,0,1]=4 900 B8R1.8 N#CC[C@H]1CCCN1 1P021VGQ [0,0,0,1,0,0|2,0,1]=4 901 B8R1.8 NCCC1=CCCC1 1P01A2TS [0,0,0,1,0,0|2,0,1]=4 902 B8R1.8 NCCC1CCC=C1 1P01DGR5 [0,0,0,1,0,0|2,0,1]=4 903 B8R1.8 NCCC1CCCC1 1P00ECJ1 [0,0,0,1,0,0|2,0,0]=3 904 B8R1.8 NCCC1CCCC1 1P00FFSC [0,0,0,1,0,0|2,0,0]=3 905 B8R1.8 NCCC1CCCN1 1P01B8X0 [0,0,0,1,0,0|2,0,0]=3 906 B8R1.8 NCCC1CCCO1 1P00IKIT [0,0,0,1,0,0|1,1,0]=3 907 B8R1.8 NCCC1CCCO1 1P01A9VX [0,0,0,1,0,0|1,1,0]=3 908 B8R1.8 NCCC1CCCS1 1P01BS3A [0,0,0,1,0,0|1,0,0]=2 909 B8R1.8 NCCC1COCC1 1P00G54P [0,0,0,1,0,0|2,0,0]=3 910 B8R1.8 NCCC1COCC1 1P00ICAQ [0,0,0,1,0,0|2,0,0]=3 911 B8R1.8 NCCC1OCCO1 1P003F7G [0,0,0,1,0,0|2,1,0]=4 912 B8R1.8 NCCC1SCCS1 1P01B7A8 [0,0,0,1,0,0|2,0,0]=3 913 B8R1.8 NCCN1CCCC1 1P0032YZ [0,0,0,1,0,0|3,0,0]=4 914 B8R1.8 NCCN1CCCC1 1P00EB7N [0,0,0,1,0,0|3,0,0]=4 915 B8R1.8 NCCN1CCCO1 1P028SFN [0,0,0,1,0,0|2,1,0]=4 916 B8R1.8 NCC[C@H]1CCCO1 1P01E940 [0,0,0,1,0,0|1,1,0]=3 917 B8R1.8 NNCC1CCCC1 1P019UY3 [0,0,0,1,0,0|3,0,0]=4 918 B8R1.8 NNCC1CCCO1 1P0170AD [0,0,0,1,0,0|2,1,0]=4 919 B8R1.8 NNCC1COCC1 1P00HH46 [0,0,0,1,0,0|3,0,0]=4 920 B8R1.8 NOCC1CCCC1 1P004KEF [0,0,0,1,0,0|3,0,0]=4 921 B8R1.8 NOCC1CCCO1 1P027U2C [0,0,0,1,0,0|2,1,0]=4 922 B8R1.8 NOCC1COCC1 1P01BD5H [0,0,0,1,0,0|3,0,0]=4 923 B8R1.8 O=C=NC1CCCS1 1P028HYA [0,0,0,1,0,0|1,0,2]=4 924 B8R1.8 O=CCC1CCCC1 1P00DFNH [0,0,0,1,0,0|1,0,2]=4 925 B8R1.8 O=CCC1CCCO1 1P00C3IA [0,0,0,1,0,0|0,1,2]=4 926 B8R1.8 O=CCC1COCC1 1P008WA7 [0,0,0,1,0,0|2,0,1]=4 927 B8R1.8 OCCC1CCC=C1 1P005JRE [0,0,0,1,0,0|1,0,1]=3 928 B8R1.8 OCCC1CCCC1 1P003BOA [0,0,0,1,0,0|1,0,0]=2 929 B8R1.8 OCCC1CCCN1 1P00172G [0,0,0,1,0,0|1,0,0]=2 930 B8R1.8 OCCC1CCCN1 1P00ABNB [0,0,0,1,0,0|1,0,0]=2 931 B8R1.8 OCCC1CCCO1 1P00CKW0 [0,0,0,1,0,0|0,1,0]=2 932 B8R1.8 OCCC1CCCS1 1P02869V [0,0,0,1,0,0|0,0,0]=1 933 B8R1.8 OCCC1CNCC1 1P006IRK [0,0,0,1,0,0|2,0,0]=3 934 B8R1.8 OCCC1CNCC1 1P00FCZN [0,0,0,1,0,0|2,0,0]=3 935 B8R1.8 OCCC1COCC1 1P009EEF [0,0,0,1,0,0|2,0,0]=3 936 B8R1.8 OCCC1OCCO1 1P01E6KU [0,0,0,1,0,0|1,1,0]=3 937 B8R1.8 OCCN1CCC=N1 1P003FB8 [0,0,0,1,0,0|2,0,1]=4 938 B8R1.8 OCCN1CCCC1 1P002Z7F [0,0,0,1,0,0|2,0,0]=3 939 B8R1.8 OCCN1COCC1 1P002DF3 [0,0,0,1,0,0|3,0,0]=4 940 B8R1.8 OCC[C@@H]1CNCC1 1P01B5C4 [0,0,0,1,0,0|2,0,0]=3 941 B8R1.8 OCC[C@H]1CCCN1 1P01JCWU [0,0,0,1,0,0|1,0,0]=2 942 B8R1.8 OCC[C@H]1CNCC1 1P00HWSF [0,0,0,1,0,0|2,0,0]=3 943 B8R1.8 ON=CC1CCCO1 1P01B7CC [0,0,0,1,0,0|1,1,1]=4 944 B8R1.8 SCCC1CCCC1 1P0289B7 [0,0,0,1,0,0|1,1,0]=3 945 B8R1.8 SCCC1CCCO1 1P028WJL [0,0,0,1,0,0|0,2,0]=3 946 B8R1.8 SCCC1COCC1 1P024UL3 [0,0,0,1,0,0|2,0,0]=3 947 B8R1.8 SCCN1CCCC1 1P00CLYU [0,0,0,1,0,0|2,1,0]=4 948 B8R1.8 [C-]#[N+]CC1CCCO1 1P00DGDT [0,0,0,1,0,0|2,1,0]=4 949 B8R1.11 BrC[C@@H]1CCCN1C 1P0291QH [0,0,0,1,0,0|3,0,0]=4 950 B8R1.11 BrC[C@H]1CCCN1C 1P0291SD [0,0,0,1,0,0|3,0,0]=4 951 B8R1.11 C#CC1CCCC1O 1P0033RL [0,0,0,1,0,0|1,1,1]=4 952 B8R1.11 C#C[C@H]1CCC[C@H]1N 1P028QUR [0,0,0,1,0,0|2,0,1]=4 953 B8R1.11 C=C[C@@H]1CCC[C@H]1O 1P0290KZ [0,0,0,1,0,0|1,1,1]=4 954 B8R1.11 CC1NCCC1CO 1P01B26Q [0,0,0,1,0,0|2,0,0]=3 955 B8R1.11 CC1OCCC1CBr 1P01B9LM [0,0,0,1,0,0|3,0,0]=4 956 B8R1.11 CC1OCCC1CN 1P028ZV3 [0,0,0,1,0,0|3,0,0]=4 957 B8R1.11 CCC1CCCC1=O 1P00DBGE [0,0,0,1,0,0|1,1,1]=4 958 B8R1.11 CCC1CCCC1N 1P019ZZ8 [0,0,0,1,0,0|2,0,0]=3 959 B8R1.11 CCC1CCNC1C 1P01AFW4 [0,0,0,1,0,0|3,0,0]=4 960 B8R1.11 CCC1CNCC1O 1P01A3NT [0,0,0,1,0,0|2,1,0]=4 961 B8R1.11 CCC1COCC1N 1P01B6KU [0,0,0,1,0,0|3,0,0]=4 962 B8R1.11 CCC1NCCC1C 1P01AFTA [0,0,0,1,0,0|2,0,0]=3 963 B8R1.11 CC[C@@H]1CCCC1=O 1P01BUQW [0,0,0,1,0,0|1,1,1]=4 964 B8R1.11 CC[C@@H]1CCC[C@H]1N 1P01DTR8 [0,0,0,1,0,0|2,0,0]=3 965 B8R1.11 CC[C@@H]1CNC[C@@H]1F 1P027UW4 [0,0,0,1,0,0|3,0,0]=4 966 B8R1.11 CC[C@@H]1NCC[C@@H]1O 1P028AJJ [0,0,0,1,0,0|1,1,0]=3 967 B8R1.11 CC[C@H]1NCC[C@H]1O 1P028BJY [0,0,0,1,0,0|1,1,0]=3 968 B8R1.11 CNC1CCCC1C 1P028IRX [0,0,0,1,0,0|3,0,0]=4 969 B8R1.11 CN[C@@H]1CCC[C@@H]1O 1P01KL2I [0,0,0,1,0,0|2,1,0]=4 970 B8R1.11 CN[C@@H]1CCC[C@H]1O 1P00PKEU [0,0,0,1,0,0|2,1,0]=4 971 B8R1.11 COC1CCCC1N 1P01A7QP [0,0,0,1,0,0|3,0,0]=4 972 B8R1.11 CO[C@@H]1CCC[C@@H]1N 1P00M2PV [0,0,0,1,0,0|3,0,0]=4 973 B8R1.11 CO[C@@H]1CCC[C@@H]1N 1P01JVEJ [0,0,0,1,0,0|3,0,0]=4 974 B8R1.11 CO[C@@H]1CCC[C@H]1N 1P019FM8 [0,0,0,1,0,0|3,0,0]=4 975 B8R1.11 CO[C@@H]1CCC[C@H]1N 1P01C1J4 [0,0,0,1,0,0|3,0,0]=4 976 B8R1.11 CO[C@@H]1CCC[C@H]1O 1P005MYW [0,0,0,1,0,0|2,1,0]=4 977 B8R1.11 CO[C@H]1CCC[C@@H]1N 1P01A85P [0,0,0,1,0,0|3,0,0]=4 978 B8R1.11 CO[C@H]1CCC[C@@H]1N 1P024KNM [0,0,0,1,0,0|3,0,0]=4 979 B8R1.11 CO[C@H]1CCC[C@@H]1O 1P01EN49 [0,0,0,1,0,0|2,1,0]=4 980 B8R1.11 CSC1CCCC1N 1P018ST6 [0,0,0,1,0,0|3,0,0]=4 981 B8R1.11 CS[C@@H]1CCC[C@@H]1Cl 1P028W07 [0,0,0,1,0,0|3,0,0]=4 982 B8R1.11 CS[C@@H]1CCC[C@H]1N 1P01GTIJ [0,0,0,1,0,0|3,0,0]=4 983 B8R1.11 CS[C@@H]1CCC[C@H]1O 1P0288RF [0,0,0,1,0,0|2,1,0]=4 984 B8R1.11 C[C@@H]1CNC[C@H]1CO 1P0205OR [0,0,0,1,0,0|2,0,0]=3 985 B8R1.11 C[C@H]1CNC[C@@H]1CO 1P00IIT8 [0,0,0,1,0,0|2,0,0]=3 986 B8R1.11 C[C@H]1CNC[C@@H]1CO 1P01JUVJ [0,0,0,1,0,0|2,0,0]=3 987 B8R1.11 C[C@H]1NCC[C@H]1CO 1P00I1MI [0,0,0,1,0,0|2,0,0]=3 988 B8R1.11 C[C@H]1OCC[C@H]1CO 1P00I2AV [0,0,0,1,0,0|2,0,0]=3 989 B8R1.11 ClCC1CCCN1C 1P00DKB8 [0,0,0,1,0,0|3,0,0]=4 990 B8R1.11 ClC[C@@H]1CCC[NH+]1C 1P006JDD [0,0,0,1,0,0|3,0,0]=4 991 B8R1.11 ClC[C@H]1CCCN1C 1P01C5ZS [0,0,0,1,0,0|3,0,0]=4 992 B8R1.11 ICC1CCCN1C 1P01EZRR [0,0,0,1,0,0|3,0,0]=4 993 B8R1.11 ICC1OCCC1F 1P028HC4 [0,0,0,1,0,0|2,0,0]=3 994 B8R1.11 N#CC1CCCC1C 1P01A6NY [0,0,0,1,0,0|2,0,1]=4 995 B8R1.11 N#CC1CCCC1N 1P0052ZS [0,0,0,1,0,0|2,0,1]=4 996 B8R1.11 N#CC1CCCC1O 1P01A8RR [0,0,0,1,0,0|1,1,1]=4 997 B8R1.11 N#C[C@@H]1CCC[C@@H]1N 1P00IL6T [0,0,0,1,0,0|2,0,1]=4 998 B8R1.11 N#C[C@@H]1CCC[C@H]1O 1P01DX23 [0,0,0,1,0,0|1,1,1]=4 999 B8R1.11 N#C[C@@H]1OCC[C@H]1Br 1P028QJ1 [0,0,0,1,0,0|2,0,1]=4 1000 B8R1.11 NC1COCC1CO 1P01UNLN [0,0,0,1,0,0|2,0,0]=3 1001 B8R1.11 NCC1CCCC1=O 1P01AVGC [0,0,0,1,0,0|1,1,1]=4 1002 B8R1.11 NCC1CCCC1C 1P005QZ9 [0,0,0,1,0,0|2,0,0]=3 1003 B8R1.11 NCC1CCCC1N 1P007QKI [0,0,0,1,0,0|2,0,0]=3 1004 B8R1.11 NCC1CCCC1O 1P018HNZ [0,0,0,1,0,0|1,1,0]=3 1005 B8R1.11 NCC1CCCN1C 1P002SFQ [0,0,0,1,0,0|3,0,0]=4 1006 B8R1.11 NCC1OCCC1F 1P0293OA [0,0,0,1,0,0|2,0,0]=3 1007 B8R1.11 NC[C@@H]1CCCN1C 1P00BIQW [0,0,0,1,0,0|3,0,0]=4 1008 B8R1.11 NC[C@@H]1CCCN1C 1P00FHK8 [0,0,0,1,0,0|3,0,0]=4 1009 B8R1.11 NC[C@@H]1CCC[C@H]1O 1P01C2CU [0,0,0,1,0,0|1,1,0]=3 1010 B8R1.11 NC[C@@H]1COC[C@@H]1O 1P001U6T [0,0,0,1,0,0|2,1,0]=4 1011 B8R1.11 NC[C@@H]1COC[C@@H]1O 1P01BIYU [0,0,0,1,0,0|2,1,0]=4 1012 B8R1.11 NC[C@@H]1COC[C@H]1O 1P00HZBF [0,0,0,1,0,0|2,1,0]=4 1013 B8R1.11 NC[C@H]1CCCN1C 1P00FY6Q [0,0,0,1,0,0|3,0,0]=4 1014 B8R1.11 NC[C@H]1CCC[C@H]1O 1P028MV0 [0,0,0,1,0,0|1,1,0]=3 1015 B8R1.11 NN[C@@H]1CCC[C@H]1O 1P00J2NB [0,0,0,1,0,0|2,1,0]=4 1016 B8R1.11 NN[C@@H]1CCC[C@H]1O 1P01C4AJ [0,0,0,1,0,0|2,1,0]=4 1017 B8R1.11 N[C@@H]1COC[C@@H]1CO 1P01JJ53 [0,0,0,1,0,0|2,0,0]=3 1018 B8R1.11 N[C@@H]1CSC[C@H]1CO 1P027Q14 [0,0,0,1,0,0|2,0,0]=3 1019 B8R1.11 O=CC1CCCC1C 1P01DZBJ [0,0,0,1,0,0|1,0,2]=4 1020 B8R1.11 OCC1=C(C)CCC1 1P0291Q3 [0,0,0,1,0,0|1,0,2]=4 1021 B8R1.11 OCC1CCCC1=O 1P002B0X [0,0,0,1,0,0|0,1,1]=3 1022 B8R1.11 OCC1CCCC1O 1P01DQ2T [0,0,0,1,0,0|0,1,0]=2 1023 B8R1.11 OCC1CCCN1C 1P0031J1 [0,0,0,1,0,0|2,0,0]=3 1024 B8R1.11 OCC1CCCN1N 1P01C3WP [0,0,0,1,0,0|2,0,0]=3 1025 B8R1.11 OCC1CCNC1=O 1P00GGRU [0,0,0,1,0,0|1,1,1]=4 1026 B8R1.11 OCC1CNCC1O 1P01C28L [0,0,0,1,0,0|1,1,0]=3 1027 B8R1.11 OCC1NCCC1C 1P01B1O4 [0,0,0,1,0,0|2,0,0]=3 1028 B8R1.11 OCC1OCCC1C 1P020LVX [0,0,0,1,0,0|2,0,0]=3 1029 B8R1.11 OCC1OCCC1F 1P0286XN [0,0,0,1,0,0|2,0,0]=3 1030 B8R1.11 OCN1CCCC1=O 1P0197YC [0,0,0,1,0,0|1,1,1]=4 1031 B8R1.11 OC[C@@H]1CCCN1C 1P00I79C [0,0,0,1,0,0|2,0,0]=3 1032 B8R1.11 OC[C@@H]1CCC[C@@H]1N 1P0077RK [0,0,0,1,0,0|1,0,0]=2 1033 B8R1.11 OC[C@@H]1CCC[C@H]1N 1P028SBL [0,0,0,1,0,0|1,0,0]=2 1034 B8R1.11 OC[C@@H]1CNC[C@H]1F 1P024UMY [0,0,0,1,0,0|2,0,0]=3 1035 B8R1.11 OC[C@H]1CCCN1C 1P003TOB [0,0,0,1,0,0|2,0,0]=3 1036 B8R1.11 OC[C@H]1CCC[C@@H]1N 1P028E10 [0,0,0,1,0,0|1,0,0]=2 1037 B8R1.11 OC[C@H]1CNC[C@H]1O 1P00J2QQ [0,0,0,1,0,0|1,1,0]=3 1038 B8R1.11 OC[C@H]1NCC[C@@H]1O 1P01DI87 [0,0,0,1,0,0|1,1,0]=3 1039 B8R1.11 OC[C@H]1OCC[C@@H]1O 1P0069N6 [0,0,0,1,0,0|1,1,0]=3 1040 B8R1.14 OC[C@@H]1C(=C)[C@H]1CO 1P01HICH [0,0,0,1,0,0|2,0,1]=4 1041 B8R1.16 COC1[C@@H](O)C[C@@H]1O 1P027Y82 [0,0,0,1,0,0|1,1,0]=3 1042 B8R1.16 CO[C@@H]1C(N)C[C@H]1O 1P028BEW [0,0,0,1,0,0|2,0,0]=3 1043 B8R1.17 BrCC[C@H]1C[C@H]1CC 1P028V5Z [0,0,0,1,0,0|2,0,0]=3 1044 B8R1.17 CCOC1CC1CO 1P01B1YH [0,0,0,1,0,0|2,0,0]=3 1045 B8R1.17 COC[C@@H]1C[C@H]1CN 1P028EYD [0,0,0,1,0,0|3,0,0]=4 1046 B8R1.17 COC[C@@H]1C[C@H]1CN 1P028R1A [0,0,0,1,0,0|3,0,0]=4 1047 B8R1.17 NCC[C@@H]1C[C@H]1CC 1P028DT2 [0,0,0,1,0,0|2,0,0]=3 1048 B8R1.17 OCC[C@@H]1C[C@@H]1CC 1P01IGWQ [0,0,0,1,0,0|1,0,0]=2 1049 B8R1.18 CC1OC(C(C1)N)C 1P01C0Y6 [0,0,0,1,0,0|3,0,0]=4 1050 B8R1.18 CN1CC(C(C1)C)N 1P019T5O [0,0,0,1,0,0|3,0,0]=4 1051 B8R1.18 CN1C[C@@H]([C@@H](C1)O)F 1P022357 [0,0,0,1,0,0|3,0,0]=4 1052 B8R1.18 CN1C[C@@H]([C@H](C1)N)O 1P00J2I0 [0,0,0,1,0,0|3,0,0]=4 1053 B8R1.18 CN1C[C@H]([C@@H](C1)N)O 1P00J39D [0,0,0,1,0,0|3,0,0]=4 1054 B8R1.18 CN1C[C@H]([C@H](C1)N)O 1P002J64 [0,0,0,1,0,0|3,0,0]=4 1055 B8R1.18 N[C@@H]1C[C@@H]([C@@H](C1)O)O 1P01PZB9 [0,0,0,1,0,0|2,0,0]=3 1056 B8R1.18 N[C@@H]1C[C@H]([C@H](C1)N)N 1P027YQN [0,0,0,1,0,0|3,0,0]=4 1057 B8R1.18 N[C@H]1C[C@@H]([C@H](C1)O)F 1P02808W [0,0,0,1,0,0|2,0,0]=3 1058 B8R1.18 O=C1CC(C(N1)C)O 1P0201AH [0,0,0,1,0,0|1,1,1]=4 1059 B8R1.18 O=C1C[C@@H]([C@@H](N1)C)O 1P01JUQ0 [0,0,0,1,0,0|1,1,1]=4 1060 B8R1.18 OC1CN(C(C1)C)C 1P027VTJ [0,0,0,1,0,0|2,1,0]=4 1061 B8R1.18 O[C@@H]1CN(C[C@@H]1O)C 1P028STH [0,0,0,1,0,0|3,0,0]=4 1062 B8R1.18 O[C@@H]1C[C@H]([C@@H](C1)N)O 1P028BP5 [0,0,0,1,0,0|1,1,0]=3 1063 B8R1.18 O[C@H]1C[C@H]([C@@H](C1)N)O 1P028DR1 [0,0,0,1,0,0|1,1,0]=3 1064 B8R1.18 SC1CC(=O)N(C1)C 1P00CGQP [0,0,0,1,0,0|1,0,2]=4 1065 B8R1.22 BrC1CCCCCC1 1P007OQF [0,0,0,1,0,0|2,0,0]=3 1066 B8R1.22 BrC1CCOCCC1 1P01EM8F [0,0,0,1,0,0|1,0,0]=2 1067 B8R1.22 CC1CCCCCN1 1P008OVV [0,0,0,1,0,0|3,0,0]=4 1068 B8R1.22 CC1CCCCCN1 1P00C32A [0,0,0,1,0,0|3,0,0]=4 1069 B8R1.22 CC1CCCCNC1 1P00I0FI [0,0,0,1,0,0|3,0,0]=4 1070 B8R1.22 CC1CCNCCC1 1P00C94U [0,0,0,1,0,0|2,0,0]=3 1071 B8R1.22 CC1CCNCCC1 1P00IHD9 [0,0,0,1,0,0|2,0,0]=3 1072 B8R1.22 CC1CCNCCS1 1P018HIP [0,0,0,1,0,0|3,0,0]=4 1073 B8R1.22 CC1NCCNCC1 1P00C4D1 [0,0,0,1,0,0|3,0,0]=4 1074 B8R1.22 CC1NCCNCC1 1P01EKIU [0,0,0,1,0,0|3,0,0]=4 1075 B8R1.22 CC1NCCOCC1 1P01EJHE [0,0,0,1,0,0|2,0,0]=3 1076 B8R1.22 CC1NCCSCC1 1P01BE0S [0,0,0,1,0,0|2,1,0]=4 1077 B8R1.22 CC1NCCSCC1 1P01BE1B [0,0,0,1,0,0|2,1,0]=4 1078 B8R1.22 CN1CCNCCC1 1P0037W1 [0,0,0,1,0,0|3,0,0]=4 1079 B8R1.22 C[C@@H]1CCCCCN1 1P01JUX2 [0,0,0,1,0,0|3,0,0]=4 1080 B8R1.22 C[C@@H]1NCCNCC1 1P027TQ9 [0,0,0,1,0,0|3,0,0]=4 1081 B8R1.22 C[C@@H]1NCCOCC1 1P0281GJ [0,0,0,1,0,0|2,0,0]=3 1082 B8R1.22 C[C@H]1CCCCCN1 1P01XA6P [0,0,0,1,0,0|3,0,0]=4 1083 B8R1.22 C[C@H]1NCCNCC1 1P028Y2N [0,0,0,1,0,0|3,0,0]=4 1084 B8R1.22 C[C@H]1NCCOCC1 1P0281UY [0,0,0,1,0,0|2,0,0]=3 1085 B8R1.22 ClC1CCCCCC1 1P002OX5 [0,0,0,1,0,0|2,0,0]=3 1086 B8R1.22 FC1CCCCNC1 1P00HXB3 [0,0,0,1,0,0|3,0,0]=4 1087 B8R1.22 FC1CCNCCC1 1P00IL8X [0,0,0,1,0,0|2,0,0]=3 1088 B8R1.22 F[C@H]1CCCCNC1 1P027OGS [0,0,0,1,0,0|3,0,0]=4 1089 B8R1.22 NC1CCCCCC1 1P003PL3 [0,0,0,1,0,0|2,0,0]=3 1090 B8R1.22 NC1CCCCNC1 1P003OEK [0,0,0,1,0,0|3,0,0]=4 1091 B8R1.22 NC1CCNCCC1 1P007UL9 [0,0,0,1,0,0|2,0,0]=3 1092 B8R1.22 NC1CCSCCC1 1P01B4G9 [0,0,0,1,0,0|1,1,0]=3 1093 B8R1.22 NC1CCSCCC1 1P01FJXN [0,0,0,1,0,0|1,1,0]=3 1094 B8R1.22 NN1CCCCCC1 1P003EEN [0,0,0,1,0,0|3,0,0]=4 1095 B8R1.22 N[C@@H]1CCCCNC1 1P000ND4 [0,0,0,1,0,0|3,0,0]=4 1096 B8R1.22 N[C@H]1CCCCNC1 1P007W19 [0,0,0,1,0,0|3,0,0]=4 1097 B8R1.22 O=C1CCCCCC1 1P0036IB [0,0,0,1,0,0|1,1,1]=4 1098 B8R1.22 O=C1CCNCCC1 1P003MFC [0,0,0,1,0,0|1,1,1]=4 1099 B8R1.22 O=C1CCOCCC1 1P00ED4O [0,0,0,1,0,0|0,1,1]=3 1100 B8R1.22 O=C1CCSCCC1 1P01B2XA [0,0,0,1,0,0|0,2,1]=4 1101 B8R1.22 O=C1NCCOCC1 1P00333S [0,0,0,1,0,0|1,1,1]=4 1102 B8R1.22 O=C1OCCOCC1 1P003E79 [0,0,0,1,0,0|1,1,1]=4 1103 B8R1.22 O=S1CCNCCC1 1P007CJU [0,0,0,1,0,0|2,1,0]=4 1104 B8R1.22 OC1CCC=CCC1 1P0291Q6 [0,0,0,1,0,0|1,1,1]=4 1105 B8R1.22 OC1CCCC=CC1 1P01H9BB [0,0,0,1,0,0|1,1,1]=4 1106 B8R1.22 OC1CCCCCC1 1P003542 [0,0,0,1,0,0|1,1,0]=3 1107 B8R1.22 OC1CCCCNC1 1P005JRI [0,0,0,1,0,0|2,1,0]=4 1108 B8R1.22 OC1CCCCNC1 1P00I3PF [0,0,0,1,0,0|2,1,0]=4 1109 B8R1.22 OC1CCNCCC1 1P000HRL [0,0,0,1,0,0|1,1,0]=3 1110 B8R1.22 OC1CCNCCC1 1P00BYE2 [0,0,0,1,0,0|1,1,0]=3 1111 B8R1.22 OC1CCOCCC1 1P00IAAC [0,0,0,1,0,0|0,1,0]=2 1112 B8R1.22 O[C@@H]1CCCCNC1 1P01DL5C [0,0,0,1,0,0|2,1,0]=4 1113 B8R1.22 O[C@@H]1CCCCNC1 1P01K6XU [0,0,0,1,0,0|2,1,0]=4 1114 B8R1.22 O[C@@H]1CCNCCC1 1P01KXI4 [0,0,0,1,0,0|1,1,0]=3 1115 B8R1.22 O[C@H]1CCCCNC1 1P01K6XJ [0,0,0,1,0,0|2,1,0]=4 1116 B8R1.22 O[C@H]1CCNCCC1 1P01K4JY [0,0,0,1,0,0|1,1,0]=3 1117 B8R1.22 SC1CCCCCC1 1P01DTFG [0,0,0,1,0,0|1,0,0]=2 1118 B8R1.22 SC1CCNCCC1 1P02915A [0,0,0,1,0,0|1,0,0]=2 1119 B8R1.37 C=CCC(C1CC1)N 1P028F24 [0,0,0,1,0,0|2,0,1]=4 1120 B8R1.37 CCCC(=O)C1CC1 1P006N1Q [0,0,0,1,0,0|1,1,1]=4 1121 B8R1.37 CCCC(C1CC1)N 1P027UFE [0,0,0,1,0,0|2,0,0]=3 1122 B8R1.37 CCCC(C1CC1)O 1P0283FS [0,0,0,1,0,0|1,1,0]=3 1123 B8R1.37 CCNC(C1CC1)C 1P01FKWF [0,0,0,1,0,0|3,0,0]=4 1124 B8R1.37 CCOC(=O)C1CO1 1P0035AR [0,0,0,1,0,0|1,1,1]=4 1125 B8R1.37 CCOC(=O)[C@@H]1CO1 1P0038FS [0,0,0,1,0,0|1,1,1]=4 1126 B8R1.37 CCOC(=O)[C@H]1CO1 1P007UAP [0,0,0,1,0,0|1,1,1]=4 1127 B8R1.37 CNCC(C1CC1)O 1P019YZ9 [0,0,0,1,0,0|2,1,0]=4 1128 B8R1.37 COCC(C1CC1)N 1P0095A9 [0,0,0,1,0,0|3,0,0]=4 1129 B8R1.37 COCC(C1CC1)N 1P009NAL [0,0,0,1,0,0|3,0,0]=4 1130 B8R1.37 COCC(C1CC1)O 1P01A2B3 [0,0,0,1,0,0|2,1,0]=4 1131 B8R1.37 NC(C1CC1)CC#C 1P028S29 [0,0,0,1,0,0|2,0,1]=4 1132 B8R1.37 NC(C1CC1)CC#N 1P01JV73 [0,0,0,1,0,0|2,0,1]=4 1133 B8R1.37 NCCC(C1CC1)O 1P01AQPH [0,0,0,1,0,0|1,1,0]=3 1134 B8R1.37 NCCN(C1CC1)C 1P019XU8 [0,0,0,1,0,0|3,0,0]=4 1135 B8R1.37 NCC[C@@H](C1CC1)O 1P028YBF [0,0,0,1,0,0|1,1,0]=3 1136 B8R1.37 NCC[C@H](C1CC1)O 1P027ZE7 [0,0,0,1,0,0|1,1,0]=3 1137 B8R1.37 NNCC(C1CC1)C 1P027ZJY [0,0,0,1,0,0|3,0,0]=4 1138 B8R1.37 NNCC(C1CC1)C 1P028O8T [0,0,0,1,0,0|3,0,0]=4 1139 B8R1.37 OC(C1CC1)CC#C 1P019YXV [0,0,0,1,0,0|1,1,1]=4 1140 B8R1.37 OC(C1CC1)CC#N 1P01B5RU [0,0,0,1,0,0|1,1,1]=4 1141 B8R1.37 OCCC(C1CC1)N 1P018SRG [0,0,0,1,0,0|1,0,0]=2 1142 B8R1.37 OCCN(C1CC1)C 1P01BFY1 [0,0,0,1,0,0|2,0,0]=3 1143 B8R1.37 OCC[C@H](C1CC1)N 1P028M7P [0,0,0,1,0,0|1,0,0]=2 1144 B8R1.66 BrCCC1(F)CCC1 1P028GTP [0,0,0,1,0,0|2,0,0]=3 1145 B8R1.66 BrCCC1(O)CCC1 1P01C2WF [0,0,0,1,0,0|1,1,0]=3 1146 B8R1.66 C#CCC1(N)CCC1 1P01EN44 [0,0,0,1,0,0|2,0,1]=4 1147 B8R1.66 C#CCC1(O)CCC1 1P00CLXL [0,0,0,1,0,0|1,1,1]=4 1148 B8R1.66 C=CCC1(N)CCC1 1P01FIK0 [0,0,0,1,0,0|2,0,1]=4 1149 B8R1.66 C=CCC1(O)CCC1 1P01BVB1 [0,0,0,1,0,0|1,1,1]=4 1150 B8R1.66 CC1(CCC)CCN1 1P0290VS [0,0,0,1,0,0|2,0,0]=3 1151 B8R1.66 CC1(CCN)CCO1 1P02801A [0,0,0,1,0,0|2,0,0]=3 1152 B8R1.66 CC1(CCO)CCN1 1P028W2L [0,0,0,1,0,0|2,0,0]=3 1153 B8R1.66 CC1(CCO)CCO1 1P027V69 [0,0,0,1,0,0|2,0,0]=3 1154 B8R1.66 CC1(COC)CCN1 1P028IMA [0,0,0,1,0,0|3,0,0]=4 1155 B8R1.66 CCCC1(O)CNC1 1P028IRS [0,0,0,1,0,0|2,1,0]=4 1156 B8R1.66 CNCC1(C)CCC1 1P029389 [0,0,0,1,0,0|3,0,0]=4 1157 B8R1.66 CNCC1(F)CCC1 1P028JB7 [0,0,0,1,0,0|3,0,0]=4 1158 B8R1.66 CNCC1(O)CCC1 1P01AC1W [0,0,0,1,0,0|2,1,0]=4 1159 B8R1.66 COCC1(N)CCC1 1P009KI9 [0,0,0,1,0,0|3,0,0]=4 1160 B8R1.66 CSCC1(N)CCC1 1P027ZBQ [0,0,0,1,0,0|3,0,0]=4 1161 B8R1.66 FCCC1(N)CCC1 1P0288ZK [0,0,0,1,0,0|2,0,0]=3 1162 B8R1.66 N#CCC1(Br)CCC1 1P027UNW [0,0,0,1,0,0|2,0,1]=4 1163 B8R1.66 N#CCC1(N)CCC1 1P01DYAV [0,0,0,1,0,0|2,0,1]=4 1164 B8R1.66 N#CCC1(O)CCC1 1P01BGW5 [0,0,0,1,0,0|1,1,1]=4 1165 B8R1.66 NCCC1(C)CCC1 1P028HX5 [0,0,0,1,0,0|2,0,0]=3 1166 B8R1.66 NCCC1(C)COC1 1P00II1X [0,0,0,1,0,0|3,0,0]=4 1167 B8R1.66 NCCC1(C)COC1 1P01JMEI [0,0,0,1,0,0|3,0,0]=4 1168 B8R1.66 NCCC1(F)CCC1 1P01B8WC [0,0,0,1,0,0|2,0,0]=3 1169 B8R1.66 NCCC1(O)CCC1 1P018SPV [0,0,0,1,0,0|1,1,0]=3 1170 B8R1.66 NCCC1(O)CNC1 1P01A66O [0,0,0,1,0,0|2,1,0]=4 1171 B8R1.66 NCCC1(O)COC1 1P01BNJF [0,0,0,1,0,0|2,1,0]=4 1172 B8R1.66 NCCC1(O)COC1 1P027OL1 [0,0,0,1,0,0|2,1,0]=4 1173 B8R1.66 NNCC1(C)CCC1 1P01C5Q1 [0,0,0,1,0,0|3,0,0]=4 1174 B8R1.66 NOCC1(C)CCC1 1P029359 [0,0,0,1,0,0|3,0,0]=4 1175 B8R1.66 NOCC1(F)CCC1 1P028IZ9 [0,0,0,1,0,0|3,0,0]=4 1176 B8R1.66 OCCC1(C)CNC1 1P027TZC [0,0,0,1,0,0|2,0,0]=3 1177 B8R1.66 OCCC1(C)COC1 1P00H3D1 [0,0,0,1,0,0|2,0,0]=3 1178 B8R1.66 OCCC1(F)CCC1 1P028XJ8 [0,0,0,1,0,0|1,0,0]=2 1179 B8R1.66 OCCC1(F)COC1 1P0095VH [0,0,0,1,0,0|2,0,0]=3 1180 B8R1.66 OCCC1(N)CCC1 1P00ILL2 [0,0,0,1,0,0|1,0,0]=2 1181 B8R1.66 OCCC1(N)CCC1 1P019UAY [0,0,0,1,0,0|1,0,0]=2 1182 B8R1.66 OCCC1(N)COC1 1P00IL9P [0,0,0,1,0,0|2,0,0]=3 1183 B8R1.66 OCCC1(N)COC1 1P01EJS4 [0,0,0,1,0,0|2,0,0]=3 1184 B8R1.66 OCCC1(O)CCC1 1P00GAMR [0,0,0,1,0,0|0,1,0]=2 1185 B8R1.66 OCCC1(O)CNC1 1P01SVWQ [0,0,0,1,0,0|1,1,0]=3 1186 B8R1.66 OCCC1(O)CNC1 1P027X2C [0,0,0,1,0,0|1,1,0]=3 1187 B8R1.66 OCCC1(O)COC1 1P00ILG3 [0,0,0,1,0,0|1,1,0]=3 1188 B8R1.80 CC1(COC)CC1Br 1P01B7VM [0,0,0,1,0,0|3,0,0]=4 1189 B5R0.1 BrCCC(Br)C 1P007W1R [2,0,0,0,0,0|2,0,0]=4 1190 B5R0.1 BrCCC(C)C 1P003EL0 [2,0,0,0,0,0|2,0,0]=4 1191 B5R0.1 CC(=C)CCO 1P003K67 [2,0,0,0,0,0|1,0,1]=4 1192 B5R0.1 CC(=O)CCO 1P0034IJ [2,0,0,0,0,0|0,1,1]=4 1193 B5R0.1 CC(CCBr)F 1P01BH5M [2,0,0,0,0,0|2,0,0]=4 1194 B5R0.1 CC(CCBr)O 1P00EBF3 [2,0,0,0,0,0|1,1,0]=4 1195 B5R0.1 CC(CCCl)N 1P01BYC3 [2,0,0,0,0,0|2,0,0]=4 1196 B5R0.1 CC(CCCl)O 1P01B263 [2,0,0,0,0,0|1,1,0]=4 1197 B5R0.1 CC(CCN)Br 1P028AQ0 [2,0,0,0,0,0|2,0,0]=4 1198 B5R0.1 CC(CCN)F 1P01BCXC [2,0,0,0,0,0|2,0,0]=4 1199 B5R0.1 CC(CCN)O 1P00C8Q0 [2,0,0,0,0,0|1,1,0]=4 1200 B5R0.1 CC(CCN)S 1P01BU4X [2,0,0,0,0,0|1,0,0]=3 1201 B5R0.1 CC(CCO)Cl 1P01AV14 [2,0,0,0,0,0|1,0,0]=3 1202 B5R0.1 CC(CCO)F 1P0280HC [2,0,0,0,0,0|1,0,0]=3 1203 B5R0.1 CC(CCO)N 1P002WI2 [2,0,0,0,0,0|1,0,0]=3 1204 B5R0.1 CC(CCO)S 1P019RAT [2,0,0,0,0,0|0,0,0]=2 1205 B5R0.1 CC(CCS)N 1P028S04 [2,0,0,0,0,0|1,1,0]=4 1206 B5R0.1 CCCB(O)O 1P0025SU [2,0,0,0,0,0|1,1,0]=4 1207 B5R0.1 CCCC(=C)C 1P003I23 [2,0,0,0,0,0|1,0,1]=4 1208 B5R0.1 CCCC(=O)C 1P0038PH [2,0,0,0,0,0|0,1,1]=4 1209 B5R0.1 CCCC(=O)O 1P0038GU [2,0,0,0,0,0|0,1,1]=4 1210 B5R0.1 CCCC(=S)O 1P003K88 [2,0,0,0,0,0|0,0,2]=4 1211 B5R0.1 CCCC(Br)C 1P003BNB [2,0,0,0,0,0|1,0,0]=3 1212 B5R0.1 CCCC(N)C 1P003H0I [2,0,0,0,0,0|1,0,0]=3 1213 B5R0.1 CCCC(N)C 1P019VIM [2,0,0,0,0,0|1,0,0]=3 1214 B5R0.1 CCCC(O)C 1P00F3M1 [2,0,0,0,0,0|0,1,0]=3 1215 B5R0.1 CCCC(S)C 1P002K5F [2,0,0,0,0,0|0,0,0]=2 1216 B5R0.1 CCC[C@@H](N)C 1P003AOE [2,0,0,0,0,0|1,0,0]=3 1217 B5R0.1 CCC[C@@H](O)C 1P002SLB [2,0,0,0,0,0|0,1,0]=3 1218 B5R0.1 CCC[C@H](N)C 1P01DUMC [2,0,0,0,0,0|1,0,0]=3 1219 B5R0.1 CCC[C@H](O)C 1P0032K0 [2,0,0,0,0,0|0,1,0]=3 1220 B5R0.1 CCNC(C)C 1P002CP2 [2,0,0,0,0,0|2,0,0]=4 1221 B5R0.1 CCOC(C)C 1P003QW6 [2,0,0,0,0,0|2,0,0]=4 1222 B5R0.1 CCOC(Cl)C 1P00FMJI [2,0,0,0,0,0|2,0,0]=4 1223 B5R0.1 CCSC(C)C 1P003QW7 [2,0,0,0,0,0|2,0,0]=4 1224 B5R0.1 CN(CCO)N 1P028MN5 [2,0,0,0,0,0|2,0,0]=4 1225 B5R0.1 CNCC(C)C 1P003TOH [2,0,0,0,0,0|2,0,0]=4 1226 B5R0.1 CNCC(C)C 1P01A81L [2,0,0,0,0,0|2,0,0]=4 1227 B5R0.1 CNCC(N)C 1P019ZXS [2,0,0,0,0,0|2,0,0]=4 1228 B5R0.1 CNCC(O)C 1P001XCL [2,0,0,0,0,0|1,1,0]=4 1229 B5R0.1 CNC[C@@H](O)C 1P00FID0 [2,0,0,0,0,0|1,1,0]=4 1230 B5R0.1 CNC[C@@H](O)C 1P01BB67 [2,0,0,0,0,0|1,1,0]=4 1231 B5R0.1 CNC[C@H](O)C 1P00A1NI [2,0,0,0,0,0|1,1,0]=4 1232 B5R0.1 CNC[C@H](O)C 1P01BAVA [2,0,0,0,0,0|1,1,0]=4 1233 B5R0.1 COCC(Br)C 1P007OXE [2,0,0,0,0,0|2,0,0]=4 1234 B5R0.1 COCC(I)C 1P01C0MQ [2,0,0,0,0,0|2,0,0]=4 1235 B5R0.1 COCC(N)C 1P00IC7T [2,0,0,0,0,0|2,0,0]=4 1236 B5R0.1 COCC(O)C 1P003399 [2,0,0,0,0,0|1,1,0]=4 1237 B5R0.1 COCC(S)C 1P0289F0 [2,0,0,0,0,0|1,0,0]=3 1238 B5R0.1 COC[C@@H](N)C 1P019T8E [2,0,0,0,0,0|2,0,0]=4 1239 B5R0.1 COC[C@@H](O)C 1P002U54 [2,0,0,0,0,0|1,1,0]=4 1240 B5R0.1 COC[C@H](N)C 1P003741 [2,0,0,0,0,0|2,0,0]=4 1241 B5R0.1 COC[C@H](N)C 1P003CJ4 [2,0,0,0,0,0|2,0,0]=4 1242 B5R0.1 COC[C@H](O)C 1P003960 [2,0,0,0,0,0|1,1,0]=4 1243 B5R0.1 CSCC(N)C 1P018SKQ [2,0,0,0,0,0|2,0,0]=4 1244 B5R0.1 CSCC(O)C 1P00FVJJ [2,0,0,0,0,0|1,1,0]=4 1245 B5R0.1 CSC[C@@H](N)C 1P024Q9Z [2,0,0,0,0,0|2,0,0]=4 1246 B5R0.1 CSC[C@H](N)C 1P028CDR [2,0,0,0,0,0|2,0,0]=4 1247 B5R0.1 C[C@@H](CCBr)F 1P028154 [2,0,0,0,0,0|2,0,0]=4 1248 B5R0.1 C[C@@H](CCBr)N 1P028GC5 [2,0,0,0,0,0|2,0,0]=4 1249 B5R0.1 C[C@@H](CCCl)N 1P027XJN [2,0,0,0,0,0|2,0,0]=4 1250 B5R0.1 C[C@@H](CCF)O 1P027YW7 [2,0,0,0,0,0|1,1,0]=4 1251 B5R0.1 C[C@@H](CCN)F 1P028TPL [2,0,0,0,0,0|2,0,0]=4 1252 B5R0.1 C[C@@H](CCN)O 1P01A1MV [2,0,0,0,0,0|1,1,0]=4 1253 B5R0.1 C[C@@H](CCO)F 1P027U2B [2,0,0,0,0,0|1,0,0]=3 1254 B5R0.1 C[C@@H](CCO)N 1P00392C [2,0,0,0,0,0|1,0,0]=3 1255 B5R0.1 C[C@H](CCBr)F 1P02825X [2,0,0,0,0,0|2,0,0]=4 1256 B5R0.1 C[C@H](CCBr)N 1P028G9E [2,0,0,0,0,0|2,0,0]=4 1257 B5R0.1 C[C@H](CCCl)N 1P028D19 [2,0,0,0,0,0|2,0,0]=4 1258 B5R0.1 C[C@H](CCF)N 1P0285P3 [2,0,0,0,0,0|2,0,0]=4 1259 B5R0.1 C[C@H](CCF)O 1P027YXB [2,0,0,0,0,0|1,1,0]=4 1260 B5R0.1 C[C@H](CCN)O 1P00I0QG [2,0,0,0,0,0|1,1,0]=4 1261 B5R0.1 C[C@H](CCN)O 1P01A1MU [2,0,0,0,0,0|1,1,0]=4 1262 B5R0.1 C[C@H](CCO)F 1P0280GN [2,0,0,0,0,0|1,0,0]=3 1263 B5R0.1 C[C@H](CCO)N 1P003CQ7 [2,0,0,0,0,0|1,0,0]=3 1264 B5R0.1 ClCCC(C)C 1P003EON [2,0,0,0,0,0|2,0,0]=4 1265 B5R0.1 ClCCC(Cl)C 1P000PH8 [2,0,0,0,0,0|2,0,0]=4 1266 B5R0.1 ICCC(C)C 1P0035I5 [2,0,0,0,0,0|2,0,0]=4 1267 B5R0.1 NCCC(C)C 1P0035IO [2,0,0,0,0,0|2,0,0]=4 1268 B5R0.1 NCCC(C)C 1P00DNHQ [2,0,0,0,0,0|2,0,0]=4 1269 B5R0.1 NCCC(N)C 1P01AKTL [2,0,0,0,0,0|2,0,0]=4 1270 B5R0.1 OCCC(=C)C 1P008NDS [2,0,0,0,0,0|1,0,1]=4 1271 B5R0.1 OCCC(C)C 1P000KDR [2,0,0,0,0,0|1,0,0]=3 1272 B5R0.1 OCCC(F)F 1P01JVBV [2,0,0,0,0,0|2,0,0]=4 1273 B5R0.1 OCCC(O)C 1P003BUN [2,0,0,0,0,0|0,1,0]=3 1274 B5R0.1 OCCN(C)C 1P002QJK [2,0,0,0,0,0|2,0,0]=4 1275 B5R0.1 OCCN(C)C 1P0033C5 [2,0,0,0,0,0|2,0,0]=4 1276 B5R0.1 OCCN(C)C 1P00379C [2,0,0,0,0,0|2,0,0]=4 1277 B5R0.1 OCC[C@@H](O)C 1P002PAL [2,0,0,0,0,0|0,1,0]=3 1278 B5R0.1 OCC[C@H](O)C 1P0032U4 [2,0,0,0,0,0|0,1,0]=3 1279 B5R0.1 SCCC(C)C 1P003K55 [2,0,0,0,0,0|1,1,0]=4 1280 B5R0.2 BrCCCCBr 1P00333E [2,0,0,0,0,0|2,0,0]=4 1281 B5R0.2 BrCCNCC 1P028CH9 [2,0,0,0,0,0|2,0,0]=4 1282 B5R0.2 BrCCOCC 1P00IAZI [2,0,0,0,0,0|2,0,0]=4 1283 B5R0.2 BrCCSCC 1P01A541 [2,0,0,0,0,0|2,0,0]=4 1284 B5R0.2 CC#CCCO 1P0007L9 [2,0,0,0,0,0|0,0,2]=4 1285 B5R0.2 CCC#CCO 1P003BQ5 [2,0,0,0,0,0|0,0,2]=4 1286 B5R0.2 CCCCC#C 1P003EUT [2,0,0,0,0,0|0,0,2]=4 1287 B5R0.2 CCCCC#N 1P0039FZ [2,0,0,0,0,0|1,0,1]=4 1288 B5R0.2 CCCCC=O 1P003VQU [2,0,0,0,0,0|0,0,2]=4 1289 B5R0.2 CCCCCCl 1P003EPF [2,0,0,0,0,0|1,0,0]=3 1290 B5R0.2 CCCCCF 1P003ET1 [2,0,0,0,0,0|1,0,0]=3 1291 B5R0.2 CCCCCI 1P003EWK [2,0,0,0,0,0|1,0,0]=3 1292 B5R0.2 CCCCCN 1P003OCQ [2,0,0,0,0,0|1,0,0]=3 1293 B5R0.2 CCCCCN 1P01XEUV [2,0,0,0,0,0|1,0,0]=3 1294 B5R0.2 CCCCCS 1P003F1Y [2,0,0,0,0,0|0,1,0]=3 1295 B5R0.2 CCCCNC 1P003TNV [2,0,0,0,0,0|1,0,0]=3 1296 B5R0.2 CCCCNN 1P00CJP0 [2,0,0,0,0,0|2,0,0]=4 1297 B5R0.2 CCCCNO 1P01BKUP [2,0,0,0,0,0|1,0,0]=3 1298 B5R0.2 CCCCON 1P003TWH [2,0,0,0,0,0|2,0,0]=4 1299 B5R0.2 CCCCON 1P003TWI [2,0,0,0,0,0|2,0,0]=4 1300 B5R0.2 CCCC[Mg]Cl 1P00351G [2,0,0,0,0,0|2,0,0]=4 1301 B5R0.2 CCCNOC 1P02867D [2,0,0,0,0,0|2,0,0]=4 1302 B5R0.2 CCCOCBr 1P019UI6 [2,0,0,0,0,0|2,0,0]=4 1303 B5R0.2 CCCOCCl 1P01C0RR [2,0,0,0,0,0|2,0,0]=4 1304 B5R0.2 CCCSSC 1P003SIY [2,0,0,0,0,0|2,0,0]=4 1305 B5R0.2 CCNCCC 1P003THE [2,0,0,0,0,0|1,0,0]=3 1306 B5R0.2 CCSCCC 1P003QWW [2,0,0,0,0,0|1,0,0]=3 1307 B5R0.2 CCSSCC 1P00356X [2,0,0,0,0,0|2,0,0]=4 1308 B5R0.2 CC[Se][Se]CC 1P00E95V [2,0,0,0,0,0|2,0,0]=4 1309 B5R0.2 CC\C=C/CO 1P001Q0D [2,0,0,0,0,0|0,0,2]=4 1310 B5R0.2 CNCCCBr 1P01BI71 [2,0,0,0,0,0|2,0,0]=4 1311 B5R0.2 CNCCCCl 1P0038YX [2,0,0,0,0,0|2,0,0]=4 1312 B5R0.2 CNCCCF 1P01BITB [2,0,0,0,0,0|2,0,0]=4 1313 B5R0.2 CNCCCN 1P0035UU [2,0,0,0,0,0|2,0,0]=4 1314 B5R0.2 CNCCCO 1P003IPD [2,0,0,0,0,0|1,0,0]=3 1315 B5R0.2 CNCCNC 1P003312 [2,0,0,0,0,0|2,0,0]=4 1316 B5R0.2 CNCCOC 1P0035QY [2,0,0,0,0,0|2,0,0]=4 1317 B5R0.2 CNCCOC 1P009AD0 [2,0,0,0,0,0|2,0,0]=4 1318 B5R0.2 CNCCSC 1P003TMW [2,0,0,0,0,0|2,0,0]=4 1319 B5R0.2 CNCCSC 1P00C2IC [2,0,0,0,0,0|2,0,0]=4 1320 B5R0.2 COCCCBr 1P00336E [2,0,0,0,0,0|2,0,0]=4 1321 B5R0.2 COCCCCl 1P00337F [2,0,0,0,0,0|2,0,0]=4 1322 B5R0.2 COCCCI 1P00EKFX [2,0,0,0,0,0|2,0,0]=4 1323 B5R0.2 COCCCN 1P0038DG [2,0,0,0,0,0|2,0,0]=4 1324 B5R0.2 COCCCO 1P001RGO [2,0,0,0,0,0|1,0,0]=3 1325 B5R0.2 COCCCS 1P01AA5Q [2,0,0,0,0,0|1,1,0]=4 1326 B5R0.2 COCCNO 1P0285VP [2,0,0,0,0,0|2,0,0]=4 1327 B5R0.2 COCCOC 1P002VSH [2,0,0,0,0,0|2,0,0]=4 1328 B5R0.2 COCCOC 1P00331J [2,0,0,0,0,0|2,0,0]=4 1329 B5R0.2 COCCOC 1P00C2HL [2,0,0,0,0,0|2,0,0]=4 1330 B5R0.2 COCCSC 1P01HW79 [2,0,0,0,0,0|2,0,0]=4 1331 B5R0.2 CONCCO 1P01DWXD [2,0,0,0,0,0|2,0,0]=4 1332 B5R0.2 CSCCCBr 1P01ALFA [2,0,0,0,0,0|2,0,0]=4 1333 B5R0.2 CSCCCCl 1P000UI5 [2,0,0,0,0,0|2,0,0]=4 1334 B5R0.2 CSCCCN 1P003IQ4 [2,0,0,0,0,0|2,0,0]=4 1335 B5R0.2 CSCCCN 1P01JMHA [2,0,0,0,0,0|2,0,0]=4 1336 B5R0.2 CSCCCO 1P00I9J4 [2,0,0,0,0,0|1,0,0]=3 1337 B5R0.2 CSCCCS 1P01C2PP [2,0,0,0,0,0|1,1,0]=4 1338 B5R0.2 C\C=C\CCO 1P008QP2 [2,0,0,0,0,0|0,0,2]=4 1339 B5R0.2 ClCCCCBr 1P00336I [2,0,0,0,0,0|2,0,0]=4 1340 B5R0.2 ClCCCCCl 1P00333I [2,0,0,0,0,0|2,0,0]=4 1341 B5R0.2 ClCCCCI 1P003BI5 [2,0,0,0,0,0|2,0,0]=4 1342 B5R0.2 ClCCNCC 1P01C5GK [2,0,0,0,0,0|2,0,0]=4 1343 B5R0.2 ClCCOCC 1P0033PX [2,0,0,0,0,0|2,0,0]=4 1344 B5R0.2 ClCCSCC 1P003HIZ [2,0,0,0,0,0|2,0,0]=4 1345 B5R0.2 FCCCCBr 1P0032OZ [2,0,0,0,0,0|2,0,0]=4 1346 B5R0.2 FCCNCC 1P00GMCK [2,0,0,0,0,0|2,0,0]=4 1347 B5R0.2 ICCCCI 1P00IBJX [2,0,0,0,0,0|2,0,0]=4 1348 B5R0.2 ICCOCC 1P01BFOP [2,0,0,0,0,0|2,0,0]=4 1349 B5R0.2 NCCCCBr 1P002P1X [2,0,0,0,0,0|2,0,0]=4 1350 B5R0.2 NCCCCCl 1P00IBTD [2,0,0,0,0,0|2,0,0]=4 1351 B5R0.2 NCCCCF 1P01ALJC [2,0,0,0,0,0|2,0,0]=4 1352 B5R0.2 NCCCCN 1P003337 [2,0,0,0,0,0|2,0,0]=4 1353 B5R0.2 NCCCCO 1P0014XR [2,0,0,0,0,0|1,0,0]=3 1354 B5R0.2 NCCCCS 1P002LKU [2,0,0,0,0,0|1,1,0]=4 1355 B5R0.2 NCCCNO 1P01BDE6 [2,0,0,0,0,0|2,0,0]=4 1356 B5R0.2 NCCNCC 1P003TGX [2,0,0,0,0,0|2,0,0]=4 1357 B5R0.2 NCCOCC 1P0033R7 [2,0,0,0,0,0|2,0,0]=4 1358 B5R0.2 NCCSCC 1P003FIX [2,0,0,0,0,0|2,0,0]=4 1359 B5R0.2 NCCSCC 1P003FIY [2,0,0,0,0,0|2,0,0]=4 1360 B5R0.2 NNCCCO 1P00HJ6S [2,0,0,0,0,0|2,0,0]=4 1361 B5R0.2 NOCCCO 1P00D5H1 [2,0,0,0,0,0|2,0,0]=4 1362 B5R0.2 OCCCC#C 1P0034LD [2,0,0,0,0,0|0,0,2]=4 1363 B5R0.2 OCCCC#C 1P005XW2 [2,0,0,0,0,0|0,0,2]=4 1364 B5R0.2 OCCCC#N 1P00EBTB [2,0,0,0,0,0|1,0,1]=4 1365 B5R0.2 OCCCC=C 1P004WX4 [2,0,0,0,0,0|0,0,2]=4 1366 B5R0.2 OCCCC=O 1P00BGD0 [2,0,0,0,0,0|1,0,1]=4 1367 B5R0.2 OCCCCBr 1P0037UC [2,0,0,0,0,0|1,0,0]=3 1368 B5R0.2 OCCCCCl 1P0034FN [2,0,0,0,0,0|1,0,0]=3 1369 B5R0.2 OCCCCF 1P00C0MQ [2,0,0,0,0,0|1,0,0]=3 1370 B5R0.2 OCCCCI 1P00CN85 [2,0,0,0,0,0|1,0,0]=3 1371 B5R0.2 OCCCCO 1P01HWSN [2,0,0,0,0,0|1,0,0]=3 1372 B5R0.2 OCCCCS 1P001MEH [2,0,0,0,0,0|1,0,0]=3 1373 B5R0.2 OCCNCC 1P0033C9 [2,0,0,0,0,0|1,0,0]=3 1374 B5R0.2 OCCNCC 1P01AHV6 [2,0,0,0,0,0|1,0,0]=3 1375 B5R0.2 OCCOCC 1P0032R3 [2,0,0,0,0,0|1,0,0]=3 1376 B5R0.2 OCCSCC 1P003QKZ [2,0,0,0,0,0|1,0,0]=3 1377 B5R0.2 OCNCCO 1P003GOV [2,0,0,0,0,0|2,0,0]=4 1378 B5R0.2 SCCCCS 1P000INJ [2,0,0,0,0,0|1,1,0]=4 1379 B5R0.2 SCCNCC 1P028BVX [2,0,0,0,0,0|1,1,0]=4 1380 B5R0.2 SCCOCC 1P001ZJN [2,0,0,0,0,0|1,1,0]=4 1381 B5R0.2 SCCSCC 1P007L7A [2,0,0,0,0,0|1,1,0]=4 1382 B5R0.2 [C-]#[N+]CCCC 1P002UXG [2,0,0,0,0,0|1,0,1]=4 1383 B5R0.3 BrC[C@@H](CC)C 1P01FWR0 [2,0,0,0,0,0|2,0,0]=4 1384 B5R0.3 CC(NC)CO 1P002USE [2,0,0,0,0,0|2,0,0]=4 1385 B5R0.3 CC(OC)CO 1P001RGP [2,0,0,0,0,0|2,0,0]=4 1386 B5R0.3 CC(SC)CO 1P002A2F [2,0,0,0,0,0|2,0,0]=4 1387 B5R0.3 CCC(=C)CC 1P003HND [2,0,0,0,0,0|1,0,1]=4 1388 B5R0.3 CCC(=C)CO 1P019TC3 [2,0,0,0,0,0|1,0,1]=4 1389 B5R0.3 CCC(=O)CC 1P003KBG [2,0,0,0,0,0|0,1,1]=4 1390 B5R0.3 CCC(=O)CO 1P00DBTG [2,0,0,0,0,0|0,1,1]=4 1391 B5R0.3 CCC(CBr)Br 1P003DUE [2,0,0,0,0,0|2,0,0]=4 1392 B5R0.3 CCC(CBr)C 1P0032OY [2,0,0,0,0,0|2,0,0]=4 1393 B5R0.3 CCC(CBr)N 1P028IUT [2,0,0,0,0,0|2,0,0]=4 1394 B5R0.3 CCC(CBr)O 1P002Q0C [2,0,0,0,0,0|1,1,0]=4 1395 B5R0.3 CCC(CC)Br 1P0022X3 [2,0,0,0,0,0|1,0,0]=3 1396 B5R0.3 CCC(CC)I 1P0022X4 [2,0,0,0,0,0|1,0,0]=3 1397 B5R0.3 CCC(CC)N 1P003JEI [2,0,0,0,0,0|1,0,0]=3 1398 B5R0.3 CCC(CC)O 1P003KBF [2,0,0,0,0,0|0,1,0]=3 1399 B5R0.3 CCC(CC)S 1P00F3I5 [2,0,0,0,0,0|0,0,0]=2 1400 B5R0.3 CCC(CCl)C 1P00EBG7 [2,0,0,0,0,0|2,0,0]=4 1401 B5R0.3 CCC(CCl)Cl 1P003DUP [2,0,0,0,0,0|2,0,0]=4 1402 B5R0.3 CCC(CCl)O 1P00AYVS [2,0,0,0,0,0|1,1,0]=4 1403 B5R0.3 CCC(CF)N 1P01BA0M [2,0,0,0,0,0|2,0,0]=4 1404 B5R0.3 CCC(CI)C 1P00E9YB [2,0,0,0,0,0|2,0,0]=4 1405 B5R0.3 CCC(CI)N 1P028G3P [2,0,0,0,0,0|2,0,0]=4 1406 B5R0.3 CCC(CI)O 1P000N6V [2,0,0,0,0,0|1,1,0]=4 1407 B5R0.3 CCC(CN)C 1P00IK6S [2,0,0,0,0,0|2,0,0]=4 1408 B5R0.3 CCC(CN)C 1P01C477 [2,0,0,0,0,0|2,0,0]=4 1409 B5R0.3 CCC(CN)F 1P019UMD [2,0,0,0,0,0|2,0,0]=4 1410 B5R0.3 CCC(CN)N 1P01AB6T [2,0,0,0,0,0|2,0,0]=4 1411 B5R0.3 CCC(CN)O 1P003EEI [2,0,0,0,0,0|1,1,0]=4 1412 B5R0.3 CCC(CN)S 1P01EJ6L [2,0,0,0,0,0|1,0,0]=3 1413 B5R0.3 CCC(CO)Br 1P006XVW [2,0,0,0,0,0|1,0,0]=3 1414 B5R0.3 CCC(CO)C 1P001351 [2,0,0,0,0,0|1,0,0]=3 1415 B5R0.3 CCC(CO)Cl 1P01AMF6 [2,0,0,0,0,0|1,0,0]=3 1416 B5R0.3 CCC(CO)N 1P003GSS [2,0,0,0,0,0|1,0,0]=3 1417 B5R0.3 CCC(CO)O 1P003BGJ [2,0,0,0,0,0|0,1,0]=3 1418 B5R0.3 CCC(CS)C 1P002GYX [2,0,0,0,0,0|1,1,0]=4 1419 B5R0.3 CCC(CS)N 1P01A3ND [2,0,0,0,0,0|1,1,0]=4 1420 B5R0.3 CCC(CS)O 1P01BIJJ [2,0,0,0,0,0|0,2,0]=4 1421 B5R0.3 CCC(CS)S 1P001SRO [2,0,0,0,0,0|0,1,0]=3 1422 B5R0.3 CCC(NC)C 1P003FJM [2,0,0,0,0,0|2,0,0]=4 1423 B5R0.3 CCC(NC)C 1P005R74 [2,0,0,0,0,0|2,0,0]=4 1424 B5R0.3 CCC(OC)C 1P003UOY [2,0,0,0,0,0|2,0,0]=4 1425 B5R0.3 CCN(CC)C 1P00E9VL [2,0,0,0,0,0|2,0,0]=4 1426 B5R0.3 CCN(CC)O 1P0035RT [2,0,0,0,0,0|1,1,0]=4 1427 B5R0.3 CCP(=O)CC 1P00357C [2,0,0,0,0,0|1,1,0]=4 1428 B5R0.3 CCS(=O)CC 1P006ANF [2,0,0,0,0,0|1,1,0]=4 1429 B5R0.3 CC[C@@H](CCl)N 1P028G0F [2,0,0,0,0,0|2,0,0]=4 1430 B5R0.3 CC[C@@H](CI)C 1P002YPR [2,0,0,0,0,0|2,0,0]=4 1431 B5R0.3 CC[C@@H](CN)C 1P002IUT [2,0,0,0,0,0|2,0,0]=4 1432 B5R0.3 CC[C@@H](CN)C 1P0201XK [2,0,0,0,0,0|2,0,0]=4 1433 B5R0.3 CC[C@@H](CN)O 1P01B9RT [2,0,0,0,0,0|1,1,0]=4 1434 B5R0.3 CC[C@@H](CO)C 1P001P8L [2,0,0,0,0,0|1,0,0]=3 1435 B5R0.3 CC[C@@H](CO)N 1P003CWW [2,0,0,0,0,0|1,0,0]=3 1436 B5R0.3 CC[C@@H](CO)O 1P003709 [2,0,0,0,0,0|0,1,0]=3 1437 B5R0.3 CC[C@@H](CS)N 1P028FQI [2,0,0,0,0,0|1,1,0]=4 1438 B5R0.3 CC[C@@H](NC)C 1P02859U [2,0,0,0,0,0|2,0,0]=4 1439 B5R0.3 CC[C@H](CBr)O 1P0292ZO [2,0,0,0,0,0|1,1,0]=4 1440 B5R0.3 CC[C@H](CCl)N 1P028FOW [2,0,0,0,0,0|2,0,0]=4 1441 B5R0.3 CC[C@H](CN)O 1P00J2QC [2,0,0,0,0,0|1,1,0]=4 1442 B5R0.3 CC[C@H](CO)C 1P00EBJG [2,0,0,0,0,0|1,0,0]=3 1443 B5R0.3 CC[C@H](CO)N 1P0032U5 [2,0,0,0,0,0|1,0,0]=3 1444 B5R0.3 CC[C@H](CO)O 1P00I8DI [2,0,0,0,0,0|0,1,0]=3 1445 B5R0.3 CC[C@H](CS)N 1P028YXX [2,0,0,0,0,0|1,1,0]=4 1446 B5R0.3 CC[C@H](NC)C 1P01R96I [2,0,0,0,0,0|2,0,0]=4 1447 B5R0.3 CC[SiH](CC)C 1P0058VP [2,0,0,0,0,0|1,1,0]=4 1448 B5R0.3 C[C@@H](NC)CO 1P01B9ZG [2,0,0,0,0,0|2,0,0]=4 1449 B5R0.3 C[C@@H](NC)CO 1P01BA5X [2,0,0,0,0,0|2,0,0]=4 1450 B5R0.3 C[C@@H](OC)CO 1P0037UW [2,0,0,0,0,0|2,0,0]=4 1451 B5R0.3 C[C@H](NC)CO 1P01B9S4 [2,0,0,0,0,0|2,0,0]=4 1452 B5R0.3 C[C@H](NC)CO 1P01B9VN [2,0,0,0,0,0|2,0,0]=4 1453 B5R0.3 C[C@H](OC)CO 1P000CX7 [2,0,0,0,0,0|2,0,0]=4 1454 B5R0.3 NCC(CO)C 1P001O5X [2,0,0,0,0,0|2,0,0]=4 1455 B5R0.3 NCC(CO)C 1P006JX9 [2,0,0,0,0,0|2,0,0]=4 1456 B5R0.3 NCC(CO)F 1P0053A7 [2,0,0,0,0,0|2,0,0]=4 1457 B5R0.3 NCC(CO)F 1P021X21 [2,0,0,0,0,0|2,0,0]=4 1458 B5R0.3 NCC(CO)N 1P01AG38 [2,0,0,0,0,0|2,0,0]=4 1459 B5R0.3 NCC(CO)O 1P0032RQ [2,0,0,0,0,0|1,1,0]=4 1460 B5R0.3 NC[C@@H](CO)C 1P00IFOF [2,0,0,0,0,0|2,0,0]=4 1461 B5R0.3 NC[C@@H](CO)F 1P00ILF4 [2,0,0,0,0,0|2,0,0]=4 1462 B5R0.3 NC[C@@H](CO)F 1P023OS0 [2,0,0,0,0,0|2,0,0]=4 1463 B5R0.3 NC[C@@H](CO)N 1P01A5TP [2,0,0,0,0,0|2,0,0]=4 1464 B5R0.3 NC[C@@H](CO)O 1P002KW4 [2,0,0,0,0,0|1,1,0]=4 1465 B5R0.3 NC[C@@H](CO)O 1P003VXC [2,0,0,0,0,0|1,1,0]=4 1466 B5R0.3 NC[C@H](CO)C 1P007F3A [2,0,0,0,0,0|2,0,0]=4 1467 B5R0.3 NC[C@H](CO)C 1P028ZRU [2,0,0,0,0,0|2,0,0]=4 1468 B5R0.3 NC[C@H](CO)F 1P00ILHM [2,0,0,0,0,0|2,0,0]=4 1469 B5R0.3 NC[C@H](CO)N 1P01A7EX [2,0,0,0,0,0|2,0,0]=4 1470 B5R0.3 NC[C@H](CO)O 1P003CQ6 [2,0,0,0,0,0|1,1,0]=4 1471 B5R0.3 OCC(CBr)Br 1P006T5M [2,0,0,0,0,0|2,0,0]=4 1472 B5R0.3 OCC(CBr)C 1P0075IM [2,0,0,0,0,0|2,0,0]=4 1473 B5R0.3 OCC(CBr)F 1P01E7KF [2,0,0,0,0,0|2,0,0]=4 1474 B5R0.3 OCC(CBr)O 1P00DF5A [2,0,0,0,0,0|1,1,0]=4 1475 B5R0.3 OCC(CCl)Cl 1P003FXP [2,0,0,0,0,0|2,0,0]=4 1476 B5R0.3 OCC(CCl)O 1P0036LI [2,0,0,0,0,0|1,1,0]=4 1477 B5R0.3 OCC(CF)F 1P01PCWA [2,0,0,0,0,0|2,0,0]=4 1478 B5R0.3 OCC(CO)C 1P003I1Q [2,0,0,0,0,0|2,0,0]=4 1479 B5R0.3 OCC(CO)Cl 1P00DFIC [2,0,0,0,0,0|2,0,0]=4 1480 B5R0.3 OCC(CO)N 1P0033JG [2,0,0,0,0,0|2,0,0]=4 1481 B5R0.3 OCC(CO)N 1P003UPC [2,0,0,0,0,0|2,0,0]=4 1482 B5R0.3 OCC(CO)O 1P002TPL [2,0,0,0,0,0|1,1,0]=4 1483 B5R0.3 OCC(CO)O 1P0035FJ [2,0,0,0,0,0|1,1,0]=4 1484 B5R0.3 OCC(CO)O 1P00GV8Q [2,0,0,0,0,0|1,1,0]=4 1485 B5R0.3 OCC(CS)C 1P019SMR [2,0,0,0,0,0|2,0,0]=4 1486 B5R0.3 OCC(CS)O 1P006SH0 [2,0,0,0,0,0|1,1,0]=4 1487 B5R0.3 OCC(CS)S 1P003FZZ [2,0,0,0,0,0|1,0,0]=3 1488 B5R0.3 OC[C@@H](CBr)C 1P003CXU [2,0,0,0,0,0|2,0,0]=4 1489 B5R0.3 OC[C@@H](CBr)O 1P0013UE [2,0,0,0,0,0|1,1,0]=4 1490 B5R0.3 OC[C@@H](CCl)O 1P00IB7Z [2,0,0,0,0,0|1,1,0]=4 1491 B5R0.3 OC[C@@H](CF)N 1P02032H [2,0,0,0,0,0|2,0,0]=4 1492 B5R0.3 OC[C@@H](CF)O 1P00I73B [2,0,0,0,0,0|1,1,0]=4 1493 B5R0.3 OC[C@@H](CS)O 1P008RHS [2,0,0,0,0,0|1,1,0]=4 1494 B5R0.3 OC[C@H](CBr)C 1P003CKN [2,0,0,0,0,0|2,0,0]=4 1495 B5R0.3 OC[C@H](CBr)O 1P001JW1 [2,0,0,0,0,0|1,1,0]=4 1496 B5R0.3 OC[C@H](CCl)O 1P003CJQ [2,0,0,0,0,0|1,1,0]=4 1497 B5R0.3 OC[C@H](CF)N 1P02032G [2,0,0,0,0,0|2,0,0]=4 1498 B5R0.3 OC[C@H](CF)O 1P00D1EW [2,0,0,0,0,0|1,1,0]=4 1499 B5R0.3 OC[C@H](CS)O 1P001VNE [2,0,0,0,0,0|1,1,0]=4 1500 B7R0.2 BrCC(CC(C)C)C 1P00FEPV [1,1,0,0,0,0|2,0,0]=4 1501 B7R0.2 CC(=C)CC(CO)N 1P01BIQ2 [1,1,0,0,0,0|1,0,1]=4 1502 B7R0.2 CC(CC)CC(=O)O 1P00359B [1,1,0,0,0,0|1,0,1]=4 1503 B7R0.2 CC(CN)CC(O)C 1P01AKSU [1,1,0,0,0,0|2,0,0]=4 1504 B7R0.2 CCC(=O)CC(C)C 1P003NCQ [1,1,0,0,0,0|0,1,1]=4 1505 B7R0.2 CCC(CB(O)O)C 1P01B2LX [1,1,0,0,0,0|2,0,0]=4 1506 B7R0.2 CCC(CC(=O)C)C 1P0038PR [1,1,0,0,0,0|1,0,1]=4 1507 B7R0.2 CCC(CC(=O)O)N 1P003ANY [1,1,0,0,0,0|1,0,1]=4 1508 B7R0.2 CCC(CC(=O)O)N 1P00AQ4O [1,1,0,0,0,0|1,0,1]=4 1509 B7R0.2 CCC(CC(=O)O)O 1P0007RC [1,1,0,0,0,0|0,1,1]=4 1510 B7R0.2 CCC(CC(C)C)C 1P003BLN [1,1,0,0,0,0|1,0,0]=3 1511 B7R0.2 CCC(CC(N)C)C 1P0018C1 [1,1,0,0,0,0|1,0,0]=3 1512 B7R0.2 CCC(CC(O)C)N 1P01BRXC [1,1,0,0,0,0|1,0,0]=3 1513 B7R0.2 CCC(CN(C)C)N 1P00FDJ9 [1,1,0,0,0,0|2,0,0]=4 1514 B7R0.2 CCC(CN(C)C)O 1P01C0YO [1,1,0,0,0,0|1,1,0]=4 1515 B7R0.2 CC[C@@H](CC(=O)O)N 1P001J1T [1,1,0,0,0,0|1,0,1]=4 1516 B7R0.2 CC[C@@H](CC(=O)O)N 1P01DTYS [1,1,0,0,0,0|1,0,1]=4 1517 B7R0.2 CC[C@@H](CC(=O)O)O 1P01EKL5 [1,1,0,0,0,0|0,1,1]=4 1518 B7R0.2 CC[C@@H](CN(C)C)N 1P01JM52 [1,1,0,0,0,0|2,0,0]=4 1519 B7R0.2 CC[C@H](CC(=O)O)N 1P00IJD7 [1,1,0,0,0,0|1,0,1]=4 1520 B7R0.2 CC[C@H](CC(=O)O)O 1P01EKMU [1,1,0,0,0,0|0,1,1]=4 1521 B7R0.2 CNC(CC(C)C)C 1P00C91A [1,1,0,0,0,0|2,0,0]=4 1522 B7R0.2 CNC(CC(C)C)C 1P00H2IP [1,1,0,0,0,0|2,0,0]=4 1523 B7R0.2 CNC(CC(O)C)C 1P023Q4W [1,1,0,0,0,0|2,0,0]=4 1524 B7R0.2 COC(CC(O)C)C 1P00H37K [1,1,0,0,0,0|2,0,0]=4 1525 B7R0.2 C[C@@H](CC)CC(=O)O 1P007CFN [1,1,0,0,0,0|1,0,1]=4 1526 B7R0.2 C[C@H](CC)CC(=O)O 1P00AQ4A [1,1,0,0,0,0|1,0,1]=4 1527 B7R0.2 NCC(CC(C)C)C 1P001EUF [1,1,0,0,0,0|2,0,0]=4 1528 B7R0.2 NCC(CC(C)C)N 1P01AHNN [1,1,0,0,0,0|2,0,0]=4 1529 B7R0.2 NCC(CC(C)C)N 1P027ZZ1 [1,1,0,0,0,0|2,0,0]=4 1530 B7R0.2 NCC(CC(C)C)O 1P01AKJN [1,1,0,0,0,0|1,1,0]=4 1531 B7R0.2 NC[C@H](CC(C)C)O 1P02843Z [1,1,0,0,0,0|1,1,0]=4 1532 B7R0.2 OCC(CC(C)C)C 1P00EBG5 [1,1,0,0,0,0|1,0,0]=3 1533 B7R0.2 OCC(CC(C)C)N 1P001US9 [1,1,0,0,0,0|1,0,0]=3 1534 B7R0.2 OCC(CC(F)F)C 1P01C339 [1,1,0,0,0,0|2,0,0]=4 1535 B7R0.2 OCC(CC(F)F)N 1P01BDL3 [1,1,0,0,0,0|2,0,0]=4 1536 B7R0.2 OCC(CN(C)C)C 1P00C907 [1,1,0,0,0,0|2,0,0]=4 1537 B7R0.2 OCC(CN(C)C)F 1P028TBJ [1,1,0,0,0,0|2,0,0]=4 1538 B7R0.2 OCC(CN(C)C)N 1P01BBOU [1,1,0,0,0,0|2,0,0]=4 1539 B7R0.2 OCC(CN(C)C)O 1P003JTV [1,1,0,0,0,0|1,1,0]=4 1540 B7R0.2 OC[C@@H](CC(C)C)N 1P00IA06 [1,1,0,0,0,0|1,0,0]=3 1541 B7R0.2 OC[C@@H](CC(F)F)O 1P028BR6 [1,1,0,0,0,0|1,1,0]=4 1542 B7R0.2 OC[C@@H](CN(C)C)N 1P028NX5 [1,1,0,0,0,0|2,0,0]=4 1543 B7R0.2 OC[C@@H](CN(C)C)O 1P00G1XW [1,1,0,0,0,0|1,1,0]=4 1544 B7R0.2 OC[C@@H](NC(C)C)C 1P000ZDO [1,1,0,0,0,0|2,0,0]=4 1545 B7R0.2 OC[C@H](CC(C)C)N 1P003CX1 [1,1,0,0,0,0|1,0,0]=3 1546 B7R0.2 OC[C@H](CC(F)F)O 1P028CDS [1,1,0,0,0,0|1,1,0]=4 1547 B7R0.2 OC[C@H](CN(C)C)N 1P02924Y [1,1,0,0,0,0|2,0,0]=4 1548 B7R0.2 OC[C@H](NC(C)C)C 1P0292CN [1,1,0,0,0,0|2,0,0]=4 1549 B7R0.2 SC[C@@H](CC(C)C)N 1P028HH1 [1,1,0,0,0,0|1,1,0]=4 1550 B7R0.3 BrCCCC(=O)CC 1P0029WY [1,1,0,0,0,0|0,1,1]=4 1551 B7R0.3 CC#CCC(CO)N 1P01C5I3 [1,1,0,0,0,0|1,0,1]=4 1552 B7R0.3 CC(CN)CCOC 1P01C3CP [1,1,0,0,0,0|2,0,0]=4 1553 B7R0.3 CC(CO)CCNC 1P02823V [1,1,0,0,0,0|1,0,0]=3 1554 B7R0.3 CC(CO)CCNC 1P0282JF [1,1,0,0,0,0|1,0,0]=3 1555 B7R0.3 CC(NC)CCCO 1P0282T6 [1,1,0,0,0,0|2,0,0]=4 1556 B7R0.3 CCC(CCC#C)O 1P01A0SZ [1,1,0,0,0,0|0,1,1]=4 1557 B7R0.3 CCC(CCC=C)O 1P002BKB [1,1,0,0,0,0|0,1,1]=4 1558 B7R0.3 CCCCC(=C)CC 1P001UBV [1,1,0,0,0,0|1,0,1]=4 1559 B7R0.3 CCCCC(=O)CC 1P003JZ2 [1,1,0,0,0,0|0,1,1]=4 1560 B7R0.3 CCCCC(CBr)Br 1P003DUJ [1,1,0,0,0,0|2,0,0]=4 1561 B7R0.3 CCCCC(CBr)C 1P0004JR [1,1,0,0,0,0|2,0,0]=4 1562 B7R0.3 CCCCC(CBr)O 1P006UE4 [1,1,0,0,0,0|1,1,0]=4 1563 B7R0.3 CCCCC(CC)Br 1P002BA2 [1,1,0,0,0,0|1,0,0]=3 1564 B7R0.3 CCCCC(CC)C 1P003K82 [1,1,0,0,0,0|1,0,0]=3 1565 B7R0.3 CCCCC(CC)I 1P01HTHG [1,1,0,0,0,0|1,0,0]=3 1566 B7R0.3 CCCCC(CC)N 1P01EIJ3 [1,1,0,0,0,0|1,0,0]=3 1567 B7R0.3 CCCCC(CC)O 1P003RBN [1,1,0,0,0,0|0,1,0]=3 1568 B7R0.3 CCCCC(CCl)Cl 1P00BE4X [1,1,0,0,0,0|2,0,0]=4 1569 B7R0.3 CCCCC(CN)N 1P001A1X [1,1,0,0,0,0|2,0,0]=4 1570 B7R0.3 CCCCC(CN)O 1P01APZ7 [1,1,0,0,0,0|1,1,0]=4 1571 B7R0.3 CCCCC(CO)C 1P00EBF2 [1,1,0,0,0,0|1,0,0]=3 1572 B7R0.3 CCCCC(CO)N 1P01S6TK [1,1,0,0,0,0|1,0,0]=3 1573 B7R0.3 CCCCC(CO)O 1P003Q98 [1,1,0,0,0,0|0,1,0]=3 1574 B7R0.3 CCCCC(NC)C 1P01BCWR [1,1,0,0,0,0|2,0,0]=4 1575 B7R0.3 CCCC[C@@H](CO)N 1P003CWX [1,1,0,0,0,0|1,0,0]=3 1576 B7R0.3 CCCC[C@H](CO)N 1P001RA5 [1,1,0,0,0,0|1,0,0]=3 1577 B7R0.3 CCCC[C@H](CO)N 1P003QBM [1,1,0,0,0,0|1,0,0]=3 1578 B7R0.3 CCCNC(=O)CC 1P00CZT8 [1,1,0,0,0,0|0,1,1]=4 1579 B7R0.3 CCCNC(CC)C 1P003TSU [1,1,0,0,0,0|1,0,0]=3 1580 B7R0.3 CCCNC(CO)C 1P006VOO [1,1,0,0,0,0|1,0,0]=3 1581 B7R0.3 CCCOC(=O)CC 1P0035ZU [1,1,0,0,0,0|0,1,1]=4 1582 B7R0.3 CCCOC(CN)C 1P00IFIO [1,1,0,0,0,0|2,0,0]=4 1583 B7R0.3 CCNCC(CC)C 1P019U8V [1,1,0,0,0,0|1,0,0]=3 1584 B7R0.3 CCNCC(CC)C 1P019UAI [1,1,0,0,0,0|1,0,0]=3 1585 B7R0.3 CCNCC(CC)O 1P005O12 [1,1,0,0,0,0|0,1,0]=3 1586 B7R0.3 CCNCC(CF)O 1P0290C8 [1,1,0,0,0,0|1,1,0]=4 1587 B7R0.3 CCNCC(CO)O 1P002B9E [1,1,0,0,0,0|0,1,0]=3 1588 B7R0.3 CCNCC(OC)C 1P01BD24 [1,1,0,0,0,0|2,0,0]=4 1589 B7R0.3 CCNC[C@@H](CC)O 1P0286VM [1,1,0,0,0,0|0,1,0]=3 1590 B7R0.3 CCNC[C@H](CC)N 1P028M6K [1,1,0,0,0,0|1,0,0]=3 1591 B7R0.3 CCNC[C@H](CC)O 1P028WZV [1,1,0,0,0,0|0,1,0]=3 1592 B7R0.3 CCOCC(CN)C 1P028P90 [1,1,0,0,0,0|2,0,0]=4 1593 B7R0.3 CCOCC(CN)O 1P00C90W [1,1,0,0,0,0|1,1,0]=4 1594 B7R0.3 CCOCC(CN)O 1P01FP7U [1,1,0,0,0,0|1,1,0]=4 1595 B7R0.3 CCOCC(CO)O 1P0038O5 [1,1,0,0,0,0|0,1,0]=3 1596 B7R0.3 CCOC[C@H](CO)N 1P01ALKF [1,1,0,0,0,0|1,0,0]=3 1597 B7R0.3 CCOC[C@H](CO)O 1P0281M0 [1,1,0,0,0,0|0,1,0]=3 1598 B7R0.3 CCSCC(NC)C 1P019THP [1,1,0,0,0,0|2,0,0]=4 1599 B7R0.3 CCSC[C@H](CO)N 1P0281AQ [1,1,0,0,0,0|1,0,0]=3 1600 B7R0.3 CCSC[C@H](CO)N 1P0288M7 [1,1,0,0,0,0|1,0,0]=3 1601 B7R0.3 CC[C@@H](CCC=C)O 1P028G66 [1,1,0,0,0,0|0,1,1]=4 1602 B7R0.3 CC[C@H](CCC=C)O 1P028FU3 [1,1,0,0,0,0|0,1,1]=4 1603 B7R0.3 CNCCC(CO)O 1P02862J [1,1,0,0,0,0|0,1,0]=3 1604 B7R0.3 CNCCN(CC)C 1P00J29G [1,1,0,0,0,0|2,0,0]=4 1605 B7R0.3 COCCC(CC)N 1P019ZIH [1,1,0,0,0,0|1,0,0]=3 1606 B7R0.3 COCCC(CC)O 1P01A2YR [1,1,0,0,0,0|0,1,0]=3 1607 B7R0.3 COCCC(CN)O 1P028YZ4 [1,1,0,0,0,0|1,1,0]=4 1608 B7R0.3 COCCC(CO)N 1P018SNU [1,1,0,0,0,0|1,0,0]=3 1609 B7R0.3 COCC[C@@H](CO)O 1P01INA6 [1,1,0,0,0,0|0,1,0]=3 1610 B7R0.3 CSCCC(CN)O 1P01BVQ4 [1,1,0,0,0,0|1,1,0]=4 1611 B7R0.3 CSCCC(CO)N 1P001XOC [1,1,0,0,0,0|1,0,0]=3 1612 B7R0.3 CSCCC(NC)C 1P01AJZ1 [1,1,0,0,0,0|2,0,0]=4 1613 B7R0.3 CSCC[C@@H](CN)N 1P01BVRW [1,1,0,0,0,0|2,0,0]=4 1614 B7R0.3 CSCC[C@@H](CO)N 1P002VLL [1,1,0,0,0,0|1,0,0]=3 1615 B7R0.3 CSCC[C@H](CO)N 1P004S8I [1,1,0,0,0,0|1,0,0]=3 1616 B7R0.3 C[C@@H](OCOC)CO 1P001R35 [1,1,0,0,0,0|2,0,0]=4 1617 B7R0.3 ClCCCC(=O)CC 1P01AC2E [1,1,0,0,0,0|0,1,1]=4 1618 B7R0.3 ClCCCC(CCl)O 1P01A3N7 [1,1,0,0,0,0|1,1,0]=4 1619 B7R0.3 ClCCCC(CN)Cl 1P003GE8 [1,1,0,0,0,0|2,0,0]=4 1620 B7R0.3 ClCCCN(CC)C 1P00J2I9 [1,1,0,0,0,0|2,0,0]=4 1621 B7R0.3 ICCCC(=O)CC 1P0292M5 [1,1,0,0,0,0|0,1,1]=4 1622 B7R0.3 NC(CO)CCC=C 1P003YA9 [1,1,0,0,0,0|1,0,1]=4 1623 B7R0.3 NCC(CCOC)N 1P01FJCW [1,1,0,0,0,0|2,0,0]=4 1624 B7R0.3 NCC(CCSC)N 1P01A4TF [1,1,0,0,0,0|2,0,0]=4 1625 B7R0.3 NCCCC(CC)O 1P01AEDS [1,1,0,0,0,0|0,1,0]=3 1626 B7R0.3 NCCCC(CC)O 1P01AL9N [1,1,0,0,0,0|0,1,0]=3 1627 B7R0.3 NCCCC(CN)C 1P001O67 [1,1,0,0,0,0|2,0,0]=4 1628 B7R0.3 NCCCC(CO)C 1P01A3F4 [1,1,0,0,0,0|1,0,0]=3 1629 B7R0.3 NCCCC(CO)O 1P0079Z5 [1,1,0,0,0,0|0,1,0]=3 1630 B7R0.3 OCCCC(CC)C 1P005IA8 [1,1,0,0,0,0|1,0,0]=3 1631 B7R0.3 OCCCC(CC)N 1P01EMRN [1,1,0,0,0,0|1,0,0]=3 1632 B7R0.3 OCCCC(CC)O 1P001V9W [1,1,0,0,0,0|0,1,0]=3 1633 B7R0.3 OCCCC(CN)C 1P01ANWP [1,1,0,0,0,0|2,0,0]=4 1634 B7R0.3 OCCCC(CO)C 1P0071T5 [1,1,0,0,0,0|1,0,0]=3 1635 B7R0.3 OCCCC(CO)N 1P00BLI5 [1,1,0,0,0,0|1,0,0]=3 1636 B7R0.3 OCCCC(CO)O 1P003DS5 [1,1,0,0,0,0|0,1,0]=3 1637 B7R0.3 OCCCN(CC)C 1P00DD5J [1,1,0,0,0,0|2,0,0]=4 1638 B7R0.3 OCCC[C@@H](CN)O 1P028ASN [1,1,0,0,0,0|1,1,0]=4 1639 B7R0.3 OCCC[C@@H](CO)N 1P028S2F [1,1,0,0,0,0|1,0,0]=3 1640 B7R0.3 OCCC[C@H](CN)C 1P01KYDD [1,1,0,0,0,0|2,0,0]=4 1641 B7R0.3 OCCC[C@H](CN)C 1P024H7Z [1,1,0,0,0,0|2,0,0]=4 1642 B7R0.3 OCCC[C@H](CO)N 1P028Y8G [1,1,0,0,0,0|1,0,0]=3 1643 B7R0.3 OCCNC(=O)CC 1P0024IT [1,1,0,0,0,0|0,1,1]=4 1644 B7R0.3 OCCNC(CC)C 1P007EEJ [1,1,0,0,0,0|1,0,0]=3 1645 B7R0.3 OCCOC(=O)CC 1P002P1Q [1,1,0,0,0,0|0,1,1]=4 1646 B7R0.3 OCCOC(CN)C 1P027W0B [1,1,0,0,0,0|2,0,0]=4 1647 B7R0.5 CC(=O)C(CCO)Cl 1P000UWG [1,1,0,0,0,0|1,0,1]=4 1648 B7R0.5 CC(C(=O)O)CCC 1P0033V6 [1,1,0,0,0,0|1,0,1]=4 1649 B7R0.5 CCCC(=O)C(C)C 1P003I37 [1,1,0,0,0,0|0,1,1]=4 1650 B7R0.5 CCCC(C(=O)C)Br 1P002ZAM [1,1,0,0,0,0|1,0,1]=4 1651 B7R0.5 CCCC(C(=O)O)Br 1P003H9U [1,1,0,0,0,0|1,0,1]=4 1652 B7R0.5 CCCC(C(=O)O)F 1P00B18T [1,1,0,0,0,0|1,0,1]=4 1653 B7R0.5 CCCC(C(=O)O)N 1P0036YR [1,1,0,0,0,0|1,0,1]=4 1654 B7R0.5 CCCC(C(=O)O)O 1P00EBYM [1,1,0,0,0,0|0,1,1]=4 1655 B7R0.5 CCCC(C(=O)O)S 1P00KF9S [1,1,0,0,0,0|0,0,1]=3 1656 B7R0.5 CCCC(C(Br)C)Br 1P003FXM [1,1,0,0,0,0|1,0,0]=3 1657 B7R0.5 CCCC(C(N)C)C 1P01KJEJ [1,1,0,0,0,0|1,0,0]=3 1658 B7R0.5 CCCC(C(O)C)C 1P002MQU [1,1,0,0,0,0|1,0,0]=3 1659 B7R0.5 CCC[C@@H](C(=O)O)Br 1P00C8EN [1,1,0,0,0,0|1,0,1]=4 1660 B7R0.5 CCC[C@@H](C(=O)O)N 1P003RTO [1,1,0,0,0,0|1,0,1]=4 1661 B7R0.5 CCC[C@@H](C(=O)O)O 1P00C8CR [1,1,0,0,0,0|0,1,1]=4 1662 B7R0.5 CCC[C@@H](C(F)F)N 1P0286UJ [1,1,0,0,0,0|2,0,0]=4 1663 B7R0.5 CCC[C@H](C(=O)O)Br 1P01HPLB [1,1,0,0,0,0|1,0,1]=4 1664 B7R0.5 CCC[C@H](C(=O)O)N 1P002DST [1,1,0,0,0,0|1,0,1]=4 1665 B7R0.5 CCC[C@H](C(=O)O)O 1P00CDG2 [1,1,0,0,0,0|0,1,1]=4 1666 B7R0.5 CCC[C@H](C(F)F)N 1P0288WI [1,1,0,0,0,0|2,0,0]=4 1667 B7R0.5 CCNC(C(C)C)C 1P019YMP [1,1,0,0,0,0|2,0,0]=4 1668 B7R0.5 CCNC(C(C)C)C 1P01A7Z8 [1,1,0,0,0,0|2,0,0]=4 1669 B7R0.5 CNCC(C(C)C)C 1P0286QD [1,1,0,0,0,0|2,0,0]=4 1670 B7R0.5 CNCC(C(C)C)N 1P01AGJ3 [1,1,0,0,0,0|2,0,0]=4 1671 B7R0.5 COCC(C(C)C)N 1P01ALEA [1,1,0,0,0,0|2,0,0]=4 1672 B7R0.5 COCC(C(C)C)O 1P019TYD [1,1,0,0,0,0|1,1,0]=4 1673 B7R0.5 COCC(C(N)C)C 1P01BCYE [1,1,0,0,0,0|2,0,0]=4 1674 B7R0.5 C[C@@H]([C@@H](N)C)CCO 1P0284LV [1,1,0,0,0,0|1,0,0]=3 1675 B7R0.5 ClCCC(C(C)C)O 1P01BID9 [1,1,0,0,0,0|1,1,0]=4 1676 B7R0.5 NCCC(C(C)C)C 1P028EH9 [1,1,0,0,0,0|2,0,0]=4 1677 B7R0.5 NCCC(C(C)C)O 1P00VUK8 [1,1,0,0,0,0|1,1,0]=4 1678 B7R0.5 OCCC(=C)C(C)C 1P028T6A [1,1,0,0,0,0|1,0,1]=4 1679 B7R0.5 OCCC(=O)C(C)C 1P009DD1 [1,1,0,0,0,0|0,1,1]=4 1680 B7R0.5 OCCC(C(C)C)C 1P006Q5G [1,1,0,0,0,0|1,0,0]=3 1681 B7R0.5 OCCC(C(C)C)N 1P003JCG [1,1,0,0,0,0|1,0,0]=3 1682 B7R0.5 OCCC(C(C)C)N 1P028YZD [1,1,0,0,0,0|1,0,0]=3 1683 B7R0.5 OCCC(C(C)C)O 1P01C5VJ [1,1,0,0,0,0|0,1,0]=3 1684 B7R0.5 OCCC(C(C)C)S 1P028DQX [1,1,0,0,0,0|0,0,0]=2 1685 B7R0.5 OCCC(C(F)F)C 1P028OUJ [1,1,0,0,0,0|2,0,0]=4 1686 B7R0.5 OCCC(N(C)C)C 1P002XL9 [1,1,0,0,0,0|2,0,0]=4 1687 B7R0.5 OCCN(C(C)C)C 1P002XLA [1,1,0,0,0,0|2,0,0]=4 1688 B7R0.5 OCC[C@@H](C(C)C)N 1P021KGS [1,1,0,0,0,0|1,0,0]=3 1689 B7R0.5 OCC[C@@H](N(C)C)C 1P02825A [1,1,0,0,0,0|2,0,0]=4 1690 B7R0.5 OCC[C@H](C(C)C)N 1P021KGU [1,1,0,0,0,0|1,0,0]=3 1691 B7R0.5 OCC[C@H](C(C)C)O 1P028S7O [1,1,0,0,0,0|0,1,0]=3 1692 B7R0.5 OCC[C@H](N(C)C)C 1P0282QH [1,1,0,0,0,0|2,0,0]=4 1693 B7R0.10 CCC(=O)C(CC)O 1P003UFW [1,1,0,0,0,0|0,1,1]=4 1694 B7R0.10 CCC(C(=O)OC)S 1P0289SO [1,1,0,0,0,0|1,0,1]=4 1695 B7R0.10 CCC(C(CC)C)C 1P003IZH [1,1,0,0,0,0|1,0,0]=3 1696 B7R0.10 CCC(C(CC)C)O 1P00EBFY [1,1,0,0,0,0|0,1,0]=3 1697 B7R0.10 CCC(C(CC)N)O 1P01C22W [1,1,0,0,0,0|0,1,0]=3 1698 B7R0.10 CCC(C(CC)O)O 1P0062IW [1,1,0,0,0,0|0,1,0]=3 1699 B7R0.10 CCC(C(CN)C)C 1P028R2E [1,1,0,0,0,0|2,0,0]=4 1700 B7R0.10 CCC(C(CN)O)C 1P01AI5U [1,1,0,0,0,0|1,1,0]=4 1701 B7R0.10 CCC(C(CO)C)O 1P001LSY [1,1,0,0,0,0|0,1,0]=3 1702 B7R0.10 CCC(C(CO)C)O 1P01GGEC [1,1,0,0,0,0|0,1,0]=3 1703 B7R0.10 CCC(C(CO)C)S 1P00347C [1,1,0,0,0,0|0,0,0]=2 1704 B7R0.10 CCC(C(CO)Cl)C 1P01C4AF [1,1,0,0,0,0|1,0,0]=3 1705 B7R0.10 CCC(C(CO)N)C 1P01AKY4 [1,1,0,0,0,0|1,0,0]=3 1706 B7R0.10 CC[C@@H]([C@@H](CO)N)C 1P002PBQ [1,1,0,0,0,0|1,0,0]=3 1707 B7R0.10 CO[C@@H]([C@@H](CO)N)C 1P01C9Z0 [1,1,0,0,0,0|2,0,0]=4 1708 B7R0.10 OCC(C(=C)CC)C 1P028X8L [1,1,0,0,0,0|1,0,1]=4 1709 B7R0.10 OCC(C(=O)CC)C 1P01HOP8 [1,1,0,0,0,0|0,1,1]=4 1710 B7R0.10 OCC(N(CC)C)C 1P008W3R [1,1,0,0,0,0|2,0,0]=4 1711 B7R0.10 OC[C@@H](N(CC)C)C 1P027OYC [1,1,0,0,0,0|2,0,0]=4 1712 B7R0.10 OC[C@@H]([C@H](CO)O)O 1P003RU6 [1,1,0,0,0,0|1,1,0]=4 1713 B7R0.10 OC[C@H](N(CC)C)C 1P027OKS [1,1,0,0,0,0|2,0,0]=4 1714 B7R0.10 OC[C@H]([C@@H](CO)Br)Br 1P003FXF [1,1,0,0,0,0|2,0,0]=4 1715 B7R0.10 OC[C@H]([C@@H](CO)O)O 1P00I546 [1,1,0,0,0,0|1,1,0]=4 1716 B7R0.10 OC[C@H]([C@H](CO)O)O 1P001LSX [1,1,0,0,0,0|1,1,0]=4 1717 B7R0.11 BrCCC(CC)(C)C 1P00EBFP [1,1,0,0,0,0|2,0,0]=4 1718 B7R0.11 BrCCC(CC)(F)F 1P024H4D [1,1,0,0,0,0|2,0,0]=4 1719 B7R0.11 CC(CO)(COC)N 1P019YQE [1,1,0,0,0,0|2,0,0]=4 1720 B7R0.11 CC(CO)(COC)N 1P01C0I7 [1,1,0,0,0,0|2,0,0]=4 1721 B7R0.11 CC(CO)(CSC)N 1P028RDX [1,1,0,0,0,0|2,0,0]=4 1722 B7R0.11 CCCC(CC)(N)C 1P0282OG [1,1,0,0,0,0|1,0,0]=3 1723 B7R0.11 CCCC(CN)(C)C 1P024M5A [1,1,0,0,0,0|2,0,0]=4 1724 B7R0.11 CCCC(CN)(N)C 1P01AKU0 [1,1,0,0,0,0|2,0,0]=4 1725 B7R0.11 CCCC(CN)(O)C 1P01AI6D [1,1,0,0,0,0|1,1,0]=4 1726 B7R0.11 CCCC(CO)(C)C 1P002ONM [1,1,0,0,0,0|1,0,0]=3 1727 B7R0.11 CCCC(CO)(N)C 1P01AJBB [1,1,0,0,0,0|1,0,0]=3 1728 B7R0.11 CCCC(CO)(S)C 1P007O0M [1,1,0,0,0,0|0,0,0]=2 1729 B7R0.11 CCNC(CO)(C)C 1P00G55J [1,1,0,0,0,0|2,0,0]=4 1730 B7R0.11 CCNC(CO)(C)C 1P00J3H2 [1,1,0,0,0,0|2,0,0]=4 1731 B7R0.11 CCOC(CC)(C)C 1P00GT0Z [1,1,0,0,0,0|2,0,0]=4 1732 B7R0.11 CCOC(CO)(C)C 1P01DWPL [1,1,0,0,0,0|2,0,0]=4 1733 B7R0.11 CNCC(CC)(F)F 1P028OQD [1,1,0,0,0,0|2,0,0]=4 1734 B7R0.11 COCC(CC)(N)C 1P028RY8 [1,1,0,0,0,0|2,0,0]=4 1735 B7R0.11 ClCCC(CC)(C)C 1P00C0MT [1,1,0,0,0,0|2,0,0]=4 1736 B7R0.11 ClCCC(CC)(F)F 1P01E7HR [1,1,0,0,0,0|2,0,0]=4 1737 B7R0.11 FCCC(CO)(N)C 1P01BV4Q [1,1,0,0,0,0|2,0,0]=4 1738 B7R0.11 NCCC(CC)(C)C 1P01C117 [1,1,0,0,0,0|2,0,0]=4 1739 B7R0.11 NCCC(CC)(F)F 1P028DRY [1,1,0,0,0,0|2,0,0]=4 1740 B7R0.11 NCCC(CC)(O)C 1P01ALUA [1,1,0,0,0,0|1,1,0]=4 1741 B7R0.11 NCCC(CO)(C)C 1P01ANTY [1,1,0,0,0,0|2,0,0]=4 1742 B7R0.11 NCCC(CO)(F)F 1P028WD4 [1,1,0,0,0,0|2,0,0]=4 1743 B7R0.11 OCC(CNC)(C)C 1P001SF0 [1,1,0,0,0,0|2,0,0]=4 1744 B7R0.11 OCC(CNC)(F)F 1P01DVGV [1,1,0,0,0,0|2,0,0]=4 1745 B7R0.11 OCC(COC)(C)C 1P00EGBQ [1,1,0,0,0,0|2,0,0]=4 1746 B7R0.11 OCC(COC)(F)F 1P01BJFW [1,1,0,0,0,0|2,0,0]=4 1747 B7R0.11 OCC(CSC)(C)C 1P01AMHB [1,1,0,0,0,0|2,0,0]=4 1748 B7R0.11 OCC(CSC)(F)F 1P028CM4 [1,1,0,0,0,0|2,0,0]=4 1749 B7R0.11 OCCC(CBr)(C)C 1P028GVY [1,1,0,0,0,0|2,0,0]=4 1750 B7R0.11 OCCC(CC)(C)C 1P002GN9 [1,1,0,0,0,0|1,0,0]=3 1751 B7R0.11 OCCC(CC)(F)F 1P0290RR [1,1,0,0,0,0|1,0,0]=3 1752 B7R0.11 OCCC(CC)(O)C 1P01C8KN [1,1,0,0,0,0|0,1,0]=3 1753 B7R0.11 OCCC(CN)(C)C 1P019TC5 [1,1,0,0,0,0|2,0,0]=4 1754 B7R0.11 OCCC(CN)(C)C 1P024N4Q [1,1,0,0,0,0|2,0,0]=4 1755 B7R0.11 OCCC(CN)(O)C 1P028L6M [1,1,0,0,0,0|1,1,0]=4 1756 B7R0.11 OCCC(CO)(C)C 1P007J71 [1,1,0,0,0,0|2,0,0]=4 1757 B7R0.11 OCCC(CO)(F)F 1P01DXR1 [1,1,0,0,0,0|2,0,0]=4 1758 B7R0.11 OCCC(CO)(O)C 1P003I5J [1,1,0,0,0,0|1,1,0]=4 1759 B7R0.11 OCCC(NC)(C)C 1P019T0U [1,1,0,0,0,0|2,0,0]=4 1760 B7R0.11 OCCC(OC)(C)C 1P003K6C [1,1,0,0,0,0|2,0,0]=4 1761 B7R0.11 OCCC(SC)(C)C 1P0089FS [1,1,0,0,0,0|2,0,0]=4 1762 B7R0.11 OCC[C@@](CO)(O)C 1P01EIRB [1,1,0,0,0,0|1,1,0]=4 1763 B7R0.11 SCCC(CC)(F)F 1P028E6U [1,1,0,0,0,0|1,1,0]=4 1764 B7R0.12 BrCCC(CC)CC 1P00AKRM [1,1,0,0,0,0|2,0,0]=4 1765 B7R0.12 BrCCC(CO)CO 1P024WLU [1,1,0,0,0,0|1,1,0]=4 1766 B7R0.12 CCCC(C#N)OC 1P01AFVE [1,1,0,0,0,0|2,0,0]=4 1767 B7R0.12 CCCC(C=O)CC 1P00BGAL [1,1,0,0,0,0|0,1,0]=3 1768 B7R0.12 CCCC(C=O)OC 1P01ANSK [1,1,0,0,0,0|1,1,0]=4 1769 B7R0.12 CCCC(CBr)CC 1P01BL6A [1,1,0,0,0,0|1,0,0]=3 1770 B7R0.12 CCCC(CC)CC 1P00ECQ9 [1,1,0,0,0,0|1,0,0]=3 1771 B7R0.12 CCCC(CO)CO 1P002S7Z [1,1,0,0,0,0|0,1,0]=3 1772 B7R0.12 CCCC(OC)CN 1P01ANP8 [1,1,0,0,0,0|1,1,0]=4 1773 B7R0.12 CCCC(OC)CO 1P01ANRS [1,1,0,0,0,0|0,1,0]=3 1774 B7R0.12 CCCC(OC)CS 1P0290A7 [1,1,0,0,0,0|1,0,0]=3 1775 B7R0.12 CCCC(OC)OC 1P003DPA [1,1,0,0,0,0|1,1,0]=4 1776 B7R0.12 CCCN(CC)CC 1P00DF7N [1,1,0,0,0,0|2,0,0]=4 1777 B7R0.12 CCCN(N=O)CC 1P00BDS0 [1,1,0,0,0,0|1,1,0]=4 1778 B7R0.12 CCNC(CO)CO 1P0291JP [1,1,0,0,0,0|1,1,0]=4 1779 B7R0.12 CCN[C@H](CO)CC 1P0056F3 [1,1,0,0,0,0|1,1,0]=4 1780 B7R0.12 CCOC(C#N)CC 1P01AFVC [1,1,0,0,0,0|2,0,0]=4 1781 B7R0.12 CCOC(CBr)CO 1P027VUQ [1,1,0,0,0,0|2,0,0]=4 1782 B7R0.12 CCOC(CCl)CO 1P027VHO [1,1,0,0,0,0|2,0,0]=4 1783 B7R0.12 CCOC(CN)CC 1P00J2G3 [1,1,0,0,0,0|2,0,0]=4 1784 B7R0.12 CCOC(CO)CN 1P01A220 [1,1,0,0,0,0|2,0,0]=4 1785 B7R0.12 CNCC(OC)CC 1P028R7V [1,1,0,0,0,0|1,1,0]=4 1786 B7R0.12 COCC(NC)CC 1P020LMR [1,1,0,0,0,0|2,0,0]=4 1787 B7R0.12 COC[C@@H](CO)OC 1P01EN7E [1,1,0,0,0,0|1,1,0]=4 1788 B7R0.12 COC[C@H](CO)OC 1P01DW5X [1,1,0,0,0,0|1,1,0]=4 1789 B7R0.12 CSCC(NC)CC 1P01A4UP [1,1,0,0,0,0|2,0,0]=4 1790 B7R0.12 NCCC(CO)CC 1P027UYA [1,1,0,0,0,0|1,1,0]=4 1791 B7R0.12 NCCC(CO)CO 1P008504 [1,1,0,0,0,0|1,1,0]=4 1792 B7R0.12 NCCC(CO)CO 1P01XFH7 [1,1,0,0,0,0|1,1,0]=4 1793 B7R0.12 OCC(CNC)CO 1P01A4DE [1,1,0,0,0,0|1,1,0]=4 1794 B7R0.12 OCC(CNC)CO 1P01FKW5 [1,1,0,0,0,0|1,1,0]=4 1795 B7R0.12 OCC(COC)CO 1P027XP3 [1,1,0,0,0,0|1,1,0]=4 1796 B7R0.12 OCCC(=CC)CC 1P028FVX [1,1,0,0,0,0|1,0,1]=4 1797 B7R0.12 OCCC(CC)CC 1P00FCD9 [1,1,0,0,0,0|1,0,0]=3 1798 B7R0.12 OCCC(CN)CC 1P019ZGA [1,1,0,0,0,0|1,0,0]=3 1799 B7R0.12 OCCC(OC)CN 1P028KFS [1,1,0,0,0,0|1,1,0]=4 1800 B7R0.12 OCCC(OC)CN 1P028M1L [1,1,0,0,0,0|1,1,0]=4 1801 B7R0.12 OCCN(CC)CC 1P001JNR [1,1,0,0,0,0|2,0,0]=4 1802 B7R0.12 OCCN(CC)CC 1P003PYE [1,1,0,0,0,0|2,0,0]=4 1803 B7R0.12 OCCN(N=O)CC 1P000WQ8 [1,1,0,0,0,0|1,1,0]=4 1804 B7R0.12 SCCC(CC)CC 1P028LP9 [1,1,0,0,0,0|1,1,0]=4 1805 B7R0.1 BrCCCCC#CC 1P028WYM [1,1,0,0,0,0|1,0,1]=4 1806 B7R0.1 BrCCCCCC#C 1P01EXYW [1,1,0,0,0,0|1,0,1]=4 1807 B7R0.1 BrCCCCCC#N 1P003NLE [1,1,0,0,0,0|1,0,1]=4 1808 B7R0.1 BrCCCCCC=C 1P0034UK [1,1,0,0,0,0|1,0,1]=4 1809 B7R0.1 BrCCCCCCBr 1P003342 [1,1,0,0,0,0|1,0,0]=3 1810 B7R0.1 BrCCCCCNC 1P027WGZ [1,1,0,0,0,0|1,0,0]=3 1811 B7R0.1 BrCCCCCOC 1P009DCM [1,1,0,0,0,0|1,0,0]=3 1812 B7R0.1 BrCCCCOCC 1P01BL3O [1,1,0,0,0,0|1,0,0]=3 1813 B7R0.1 C=CCCCNCC 1P01EMH2 [1,1,0,0,0,0|1,0,1]=4 1814 B7R0.1 CCCC#CCCO 1P001LVY [1,1,0,0,0,0|0,0,1]=3 1815 B7R0.1 CCCC=CCCCl 1P01A3F9 [1,1,0,0,0,0|1,0,1]=4 1816 B7R0.1 CCCC=CCCN 1P028EP1 [1,1,0,0,0,0|1,0,1]=4 1817 B7R0.1 CCCCCC#CBr 1P0283LN [1,1,0,0,0,0|1,0,1]=4 1818 B7R0.1 CCCCCCC#C 1P003F1Q [1,1,0,0,0,0|1,0,0]=3 1819 B7R0.1 CCCCCCC#N 1P00E98Y [1,1,0,0,0,0|1,0,0]=3 1820 B7R0.1 CCCCCCC=C 1P0033AH [1,1,0,0,0,0|1,0,0]=3 1821 B7R0.1 CCCCCCC=O 1P003RBK [1,1,0,0,0,0|0,0,1]=3 1822 B7R0.1 CCCCCCCBr 1P00336U [1,1,0,0,0,0|1,0,0]=3 1823 B7R0.1 CCCCCCCN 1P003TIH [1,1,0,0,0,0|1,0,0]=3 1824 B7R0.1 CCCCCCCO 1P003RBM [1,1,0,0,0,0|0,0,0]=2 1825 B7R0.1 CCCCCCCS 1P001UZQ [1,1,0,0,0,0|0,1,0]=3 1826 B7R0.1 CCCCCCNC 1P003TIY [1,1,0,0,0,0|1,0,0]=3 1827 B7R0.1 CCCCCCNC 1P0071Q4 [1,1,0,0,0,0|1,0,0]=3 1828 B7R0.1 CCCCCCNO 1P01BKU4 [1,1,0,0,0,0|0,0,0]=2 1829 B7R0.1 CCCCCCOC 1P003TIU [1,1,0,0,0,0|0,0,0]=2 1830 B7R0.1 CCCCCCSC 1P0028ZM [1,1,0,0,0,0|0,1,0]=3 1831 B7R0.1 CCCCCC[N+]#[C-] 1P001OR9 [1,1,0,0,0,0|1,0,0]=3 1832 B7R0.1 CCCCCN=C=O 1P003U2Z [1,1,0,0,0,0|0,0,2]=4 1833 B7R0.1 CCCCCN=[N+]=[N-] 1P002T8M [1,1,0,0,0,0|2,0,0]=4 1834 B7R0.1 CCCCNCCN 1P003T4G [1,1,0,0,0,0|1,0,0]=3 1835 B7R0.1 CCCCNCCO 1P003BJ4 [1,1,0,0,0,0|0,0,0]=2 1836 B7R0.1 CCCCOCC=C 1P003O6A [1,1,0,0,0,0|1,0,1]=4 1837 B7R0.1 CCCCOCC=O 1P002VRW [1,1,0,0,0,0|0,0,2]=4 1838 B7R0.1 CCCCOCCBr 1P00EBMP [1,1,0,0,0,0|1,0,0]=3 1839 B7R0.1 CCCCOCCCl 1P003HJ3 [1,1,0,0,0,0|1,0,0]=3 1840 B7R0.1 CCCCOCCN 1P00ESKH [1,1,0,0,0,0|1,0,0]=3 1841 B7R0.1 CCCCOCCO 1P0033NR [1,1,0,0,0,0|0,0,0]=2 1842 B7R0.1 CCCCOCCS 1P028IOV [1,1,0,0,0,0|0,1,0]=3 1843 B7R0.1 CCCNCCC#N 1P005T29 [1,1,0,0,0,0|1,0,1]=4 1844 B7R0.1 CCCNCCCC 1P0028E7 [1,1,0,0,0,0|1,0,0]=3 1845 B7R0.1 CCCNCCCN 1P003TSH [1,1,0,0,0,0|1,0,0]=3 1846 B7R0.1 CCCNCCCO 1P00D49B [1,1,0,0,0,0|0,0,0]=2 1847 B7R0.1 CCCNCCOC 1P003SQH [1,1,0,0,0,0|1,0,0]=3 1848 B7R0.1 CCCOCCCN 1P001XQD [1,1,0,0,0,0|1,0,0]=3 1849 B7R0.1 CCCOCCCO 1P00D6JL [1,1,0,0,0,0|0,0,0]=2 1850 B7R0.1 CCCSSCCC 1P003UGI [1,1,0,0,0,0|2,0,0]=4 1851 B7R0.1 CCC\C=C/CCC 1P003PG3 [1,1,0,0,0,0|1,0,1]=4 1852 B7R0.1 CCC\C=C\CCC 1P001LFZ [1,1,0,0,0,0|1,0,1]=4 1853 B7R0.1 CCNCCNCC 1P003T0D [1,1,0,0,0,0|2,0,0]=4 1854 B7R0.1 CCNCCOCC 1P00C0IP [1,1,0,0,0,0|2,0,0]=4 1855 B7R0.1 CCOCCCC#N 1P019SSA [1,1,0,0,0,0|1,0,1]=4 1856 B7R0.1 CCSCCCC#C 1P028WX1 [1,1,0,0,0,0|1,0,1]=4 1857 B7R0.1 CCSCCSCC 1P00D8Y4 [1,1,0,0,0,0|2,0,0]=4 1858 B7R0.1 CNCCCCC=C 1P004T6Q [1,1,0,0,0,0|1,0,1]=4 1859 B7R0.1 CNCCCCC=C 1P00DFP1 [1,1,0,0,0,0|1,0,1]=4 1860 B7R0.1 CNCCCCNC 1P001S56 [1,1,0,0,0,0|2,0,0]=4 1861 B7R0.1 CNCCCCOC 1P01C3X5 [1,1,0,0,0,0|1,0,0]=3 1862 B7R0.1 CNCCCOCC 1P028AT8 [1,1,0,0,0,0|2,0,0]=4 1863 B7R0.1 CNCCNCCN 1P01XC4M [1,1,0,0,0,0|2,0,0]=4 1864 B7R0.1 CNCCOCCCl 1P01BS6Q [1,1,0,0,0,0|2,0,0]=4 1865 B7R0.1 CNCCOCCN 1P01B76T [1,1,0,0,0,0|2,0,0]=4 1866 B7R0.1 CNCCOCCO 1P004K7H [1,1,0,0,0,0|1,0,0]=3 1867 B7R0.1 COCCCCC#N 1P01A8B7 [1,1,0,0,0,0|1,0,1]=4 1868 B7R0.1 COCCCCC=O 1P004U88 [1,1,0,0,0,0|0,0,2]=4 1869 B7R0.1 COCCCCOC 1P00107H [1,1,0,0,0,0|1,0,0]=3 1870 B7R0.1 COCCCSCCl 1P01BG9J [1,1,0,0,0,0|2,0,0]=4 1871 B7R0.1 COCCNCCF 1P01B5PV [1,1,0,0,0,0|2,0,0]=4 1872 B7R0.1 COCCNCCN 1P01DQTX [1,1,0,0,0,0|2,0,0]=4 1873 B7R0.1 COCCNCCO 1P01AAJ4 [1,1,0,0,0,0|1,0,0]=3 1874 B7R0.1 COCCOCCBr 1P00335V [1,1,0,0,0,0|2,0,0]=4 1875 B7R0.1 COCCOCCCl 1P00DKC8 [1,1,0,0,0,0|2,0,0]=4 1876 B7R0.1 COCCOCCI 1P007HY7 [1,1,0,0,0,0|2,0,0]=4 1877 B7R0.1 COCCOCCN 1P0039AD [1,1,0,0,0,0|2,0,0]=4 1878 B7R0.1 COCCOCCO 1P00357A [1,1,0,0,0,0|1,0,0]=3 1879 B7R0.1 COCCOCCS 1P003F8T [1,1,0,0,0,0|1,1,0]=4 1880 B7R0.1 COCCSCCN 1P028WE8 [1,1,0,0,0,0|2,0,0]=4 1881 B7R0.1 COCCSCCO 1P00CDXF [1,1,0,0,0,0|1,0,0]=3 1882 B7R0.1 COCOCCCN 1P01AUXU [1,1,0,0,0,0|2,0,0]=4 1883 B7R0.1 CSCCCCC#N 1P00F2JO [1,1,0,0,0,0|1,0,1]=4 1884 B7R0.1 CSCCCCC=O 1P028FY9 [1,1,0,0,0,0|0,0,2]=4 1885 B7R0.1 ClCCCCCC#C 1P002H4X [1,1,0,0,0,0|1,0,1]=4 1886 B7R0.1 ClCCCCCC=O 1P006UWS [1,1,0,0,0,0|0,0,2]=4 1887 B7R0.1 ClCCCCCCBr 1P00336P [1,1,0,0,0,0|1,0,0]=3 1888 B7R0.1 ClCCCCCCCl 1P003343 [1,1,0,0,0,0|1,0,0]=3 1889 B7R0.1 ClCCCCCCI 1P00337I [1,1,0,0,0,0|1,0,0]=3 1890 B7R0.1 ClCCCCCOC 1P006XHG [1,1,0,0,0,0|1,0,0]=3 1891 B7R0.1 ClCCCCOCCl 1P0202F9 [1,1,0,0,0,0|2,0,0]=4 1892 B7R0.1 ClCCNCCCCl 1P00G5FW [1,1,0,0,0,0|2,0,0]=4 1893 B7R0.1 FCCCCCCBr 1P00CM7H [1,1,0,0,0,0|1,0,0]=3 1894 B7R0.1 FCCCOCCBr 1P027X63 [1,1,0,0,0,0|2,0,0]=4 1895 B7R0.1 ICCCCCC#C 1P004KS4 [1,1,0,0,0,0|1,0,1]=4 1896 B7R0.1 ICCCCCC=C 1P00KGQU [1,1,0,0,0,0|1,0,1]=4 1897 B7R0.1 ICCCCCCI 1P003E7X [1,1,0,0,0,0|1,0,0]=3 1898 B7R0.1 NCCCCC#CC 1P028ZFB [1,1,0,0,0,0|1,0,1]=4 1899 B7R0.1 NCCCCCC#N 1P0034S6 [1,1,0,0,0,0|1,0,1]=4 1900 B7R0.1 NCCCCCC=C 1P01BBBF [1,1,0,0,0,0|1,0,1]=4 1901 B7R0.1 NCCCCCCBr 1P001KYE [1,1,0,0,0,0|1,0,0]=3 1902 B7R0.1 NCCCCCCCl 1P02016G [1,1,0,0,0,0|1,0,0]=3 1903 B7R0.1 NCCCCCCN 1P000LTI [1,1,0,0,0,0|1,0,0]=3 1904 B7R0.1 NCCCCCCN 1P002PQY [1,1,0,0,0,0|1,0,0]=3 1905 B7R0.1 NCCCCCCN 1P003BHG [1,1,0,0,0,0|1,0,0]=3 1906 B7R0.1 NCCCCCCO 1P0034S8 [1,1,0,0,0,0|0,0,0]=2 1907 B7R0.1 NCCCCCCS 1P0032KC [1,1,0,0,0,0|0,1,0]=3 1908 B7R0.1 NCCCCCNC 1P0249AX [1,1,0,0,0,0|1,0,0]=3 1909 B7R0.1 NCCCCCNC 1P028GBM [1,1,0,0,0,0|1,0,0]=3 1910 B7R0.1 NCCCCCNO 1P01EIRA [1,1,0,0,0,0|1,0,0]=3 1911 B7R0.1 NCCCCCOC 1P01A8CH [1,1,0,0,0,0|1,0,0]=3 1912 B7R0.1 NCCCCCOC 1P028NFC [1,1,0,0,0,0|1,0,0]=3 1913 B7R0.1 NCCCCCSC 1P00E5BY [1,1,0,0,0,0|1,0,0]=3 1914 B7R0.1 NCCCCOCC 1P019VXX [1,1,0,0,0,0|1,0,0]=3 1915 B7R0.1 NCCCNCCBr 1P002O3J [1,1,0,0,0,0|2,0,0]=4 1916 B7R0.1 NCCCNCCO 1P00720O [1,1,0,0,0,0|1,0,0]=3 1917 B7R0.1 NCCCNCCO 1P027YKI [1,1,0,0,0,0|1,0,0]=3 1918 B7R0.1 NCCCNCCS 1P001EKI [1,1,0,0,0,0|1,1,0]=4 1919 B7R0.1 NCCCNCCS 1P0032KB [1,1,0,0,0,0|1,1,0]=4 1920 B7R0.1 NCCCOCCF 1P027YYF [1,1,0,0,0,0|2,0,0]=4 1921 B7R0.1 NCCCOCCO 1P003AQV [1,1,0,0,0,0|1,0,0]=3 1922 B7R0.1 NCCCSCCO 1P027U19 [1,1,0,0,0,0|1,0,0]=3 1923 B7R0.1 NCCNCCCO 1P003SRO [1,1,0,0,0,0|1,0,0]=3 1924 B7R0.1 NCCOCCCBr 1P028N0O [1,1,0,0,0,0|2,0,0]=4 1925 B7R0.1 NCCOCCCCl 1P028NVK [1,1,0,0,0,0|2,0,0]=4 1926 B7R0.1 NCCOCCCF 1P027XOG [1,1,0,0,0,0|2,0,0]=4 1927 B7R0.1 NCCOCCCO 1P01B9K3 [1,1,0,0,0,0|1,0,0]=3 1928 B7R0.1 NCCOCCCO 1P01BAL9 [1,1,0,0,0,0|1,0,0]=3 1929 B7R0.1 NCCSCCCO 1P01ABKL [1,1,0,0,0,0|1,0,0]=3 1930 B7R0.1 NNCCNCCO 1P00496U [1,1,0,0,0,0|2,0,0]=4 1931 B7R0.1 NOCCCCC#C 1P0292Z7 [1,1,0,0,0,0|0,0,2]=4 1932 B7R0.1 NOCCCCON 1P01ISDD [1,1,0,0,0,0|2,0,0]=4 1933 B7R0.1 NOCCCOCC 1P0290O3 [1,1,0,0,0,0|1,0,0]=3 1934 B7R0.1 NOCCOCCF 1P0285ZK [1,1,0,0,0,0|2,0,0]=4 1935 B7R0.1 NOCCOCCO 1P019ENW [1,1,0,0,0,0|2,0,0]=4 1936 B7R0.1 O=CCCCOCC 1P0281KP [1,1,0,0,0,0|0,0,2]=4 1937 B7R0.1 OCCCCC#CC 1P01A675 [1,1,0,0,0,0|0,0,1]=3 1938 B7R0.1 OCCCCCC#C 1P003NOU [1,1,0,0,0,0|0,0,1]=3 1939 B7R0.1 OCCCCCC=C 1P003NOS [1,1,0,0,0,0|0,0,1]=3 1940 B7R0.1 OCCCCCC=O 1P00CLL5 [1,1,0,0,0,0|0,0,1]=3 1941 B7R0.1 OCCCCCCBr 1P0034SJ [1,1,0,0,0,0|0,0,0]=2 1942 B7R0.1 OCCCCCCCl 1P002DJW [1,1,0,0,0,0|0,0,0]=2 1943 B7R0.1 OCCCCCCF 1P00CAR0 [1,1,0,0,0,0|0,0,0]=2 1944 B7R0.1 OCCCCCCI 1P00CN8B [1,1,0,0,0,0|0,0,0]=2 1945 B7R0.1 OCCCCCCO 1P003345 [1,1,0,0,0,0|0,0,0]=2 1946 B7R0.1 OCCCCCCO 1P008OVF [1,1,0,0,0,0|0,0,0]=2 1947 B7R0.1 OCCCCCCS 1P001UH1 [1,1,0,0,0,0|0,0,0]=2 1948 B7R0.1 OCCCCCNC 1P002UFW [1,1,0,0,0,0|0,0,0]=2 1949 B7R0.1 OCCCCCNC 1P01BG75 [1,1,0,0,0,0|0,0,0]=2 1950 B7R0.1 OCCCCCOC 1P00DC1J [1,1,0,0,0,0|0,0,0]=2 1951 B7R0.1 OCCCCCSC 1P01A7IQ [1,1,0,0,0,0|0,0,0]=2 1952 B7R0.1 OCCCCN=[N+]=[N-] 1P00DDZP [1,1,0,0,0,0|2,0,0]=4 1953 B7R0.1 OCCCCNCC 1P003LSH [1,1,0,0,0,0|0,0,0]=2 1954 B7R0.1 OCCCCOC=C 1P0026EY [1,1,0,0,0,0|0,0,2]=4 1955 B7R0.1 OCCCCOCC 1P009OA8 [1,1,0,0,0,0|0,0,0]=2 1956 B7R0.1 OCCCNCC#C 1P0280KM [1,1,0,0,0,0|0,0,2]=4 1957 B7R0.1 OCCCOCC#C 1P01BNTK [1,1,0,0,0,0|0,0,2]=4 1958 B7R0.1 OCCCOCC#N 1P01DURY [1,1,0,0,0,0|1,0,1]=4 1959 B7R0.1 OCCCOCC=C 1P00EAU7 [1,1,0,0,0,0|0,0,2]=4 1960 B7R0.1 OCCC\C=C/CC 1P003PFW [1,1,0,0,0,0|0,0,1]=3 1961 B7R0.1 OCCNCCC#C 1P027ZYX [1,1,0,0,0,0|0,0,2]=4 1962 B7R0.1 OCCNCCC#N 1P007JA3 [1,1,0,0,0,0|1,0,1]=4 1963 B7R0.1 OCCNCCCO 1P0073JQ [1,1,0,0,0,0|1,0,0]=3 1964 B7R0.1 OCCOCCC#C 1P027Y7P [1,1,0,0,0,0|0,0,2]=4 1965 B7R0.1 OCCOCCC#N 1P00388O [1,1,0,0,0,0|1,0,1]=4 1966 B7R0.1 OCCOCCC=C 1P01DUSW [1,1,0,0,0,0|0,0,2]=4 1967 B7R0.1 OCCOCCCF 1P0279VT [1,1,0,0,0,0|1,0,0]=3 1968 B7R0.1 OCCOCCCO 1P01J991 [1,1,0,0,0,0|1,0,0]=3 1969 B7R0.1 OCCSCCCO 1P01AHF7 [1,1,0,0,0,0|1,0,0]=3 1970 B7R0.1 OCCSSCCO 1P002IIE [1,1,0,0,0,0|2,0,0]=4 1971 B7R0.1 SCCCCCCS 1P000IN9 [1,1,0,0,0,0|0,1,0]=3 1972 B7R0.1 SCCCCOCC 1P0281BW [1,1,0,0,0,0|0,1,0]=3 1973 B7R0.1 [NH3+]CCCCCC[NH3+] 1P0028IV [1,1,0,0,0,0|1,0,0]=3 1974 B7R0.4 BrCCCCB(O)O 1P003CBH [1,1,0,0,0,0|2,0,0]=4 1975 B7R0.4 BrCCCCC(=C)C 1P028CFP [1,1,0,0,0,0|1,0,1]=4 1976 B7R0.4 BrCCCCC(=O)C 1P0007J6 [1,1,0,0,0,0|1,0,1]=4 1977 B7R0.4 BrCCCCC(=O)O 1P002J3W [1,1,0,0,0,0|1,0,1]=4 1978 B7R0.4 BrCCCCC(C)C 1P003EM1 [1,1,0,0,0,0|1,0,0]=3 1979 B7R0.4 BrCCCCC(F)F 1P028I9G [1,1,0,0,0,0|2,0,0]=4 1980 B7R0.4 BrCCCCN(C)C 1P019RGG [1,1,0,0,0,0|2,0,0]=4 1981 B7R0.4 BrCCCOC(C)C 1P01BL5Y [1,1,0,0,0,0|2,0,0]=4 1982 B7R0.4 BrCCOCC(C)C 1P01B1X4 [1,1,0,0,0,0|2,0,0]=4 1983 B7R0.4 C#CCCCC(O)C 1P007NZ8 [1,1,0,0,0,0|0,0,2]=4 1984 B7R0.4 C#CCCC[C@H](O)C 1P01IWL6 [1,1,0,0,0,0|0,0,2]=4 1985 B7R0.4 C=CCCCC(N)C 1P01A557 [1,1,0,0,0,0|1,0,1]=4 1986 B7R0.4 C=CCCCC(O)C 1P00BJLZ [1,1,0,0,0,0|0,0,2]=4 1987 B7R0.4 CC(=O)NCCCO 1P009RY1 [1,1,0,0,0,0|1,0,1]=4 1988 B7R0.4 CC(=O)SCCCO 1P01DU4A [1,1,0,0,0,0|1,0,1]=4 1989 B7R0.4 CCCCCB(O)O 1P003TRG [1,1,0,0,0,0|1,0,0]=3 1990 B7R0.4 CCCCCC(=N)N 1P00J1UF [1,1,0,0,0,0|1,0,1]=4 1991 B7R0.4 CCCCCC(=N)N 1P028M17 [1,1,0,0,0,0|1,0,1]=4 1992 B7R0.4 CCCCCC(=O)C 1P0033SO [1,1,0,0,0,0|0,0,2]=4 1993 B7R0.4 CCCCCC(=O)Cl 1P003RDM [1,1,0,0,0,0|0,0,2]=4 1994 B7R0.4 CCCCCC(=O)N 1P003RDF [1,1,0,0,0,0|0,0,2]=4 1995 B7R0.4 CCCCCC(=O)O 1P0035GM [1,1,0,0,0,0|0,0,1]=3 1996 B7R0.4 CCCCCC(=O)[O-] 1P0002NZ [1,1,0,0,0,0|0,0,2]=4 1997 B7R0.4 CCCCCC(=S)N 1P001WHQ [1,1,0,0,0,0|0,1,1]=4 1998 B7R0.4 CCCCCC(C)C 1P003I61 [1,1,0,0,0,0|1,0,0]=3 1999 B7R0.4 CCCCCC(N)C 1P000KEH [1,1,0,0,0,0|1,0,0]=3 2000 B7R0.4 CCCCCC(O)C 1P00DX8F [1,1,0,0,0,0|0,0,0]=2 2001 B7R0.4 CCCCCN(C)C 1P028LRM [1,1,0,0,0,0|2,0,0]=4 2002 B7R0.4 CCCCC[C@@H](O)C 1P003CX9 [1,1,0,0,0,0|0,0,0]=2 2003 B7R0.4 CCCCC[C@H](O)C 1P003CKJ [1,1,0,0,0,0|0,0,0]=2 2004 B7R0.4 CCCCC[N+](=O)[O-] 1P00EG5W [1,1,0,0,0,0|1,0,1]=4 2005 B7R0.4 CCCCNC(C)C 1P0076ZL [1,1,0,0,0,0|2,0,0]=4 2006 B7R0.4 CCCCOC(C)C 1P00B4WT [1,1,0,0,0,0|2,0,0]=4 2007 B7R0.4 CCCCOC(Cl)Cl 1P003PUG [1,1,0,0,0,0|2,0,0]=4 2008 B7R0.4 CCCNCC(=O)O 1P019WR9 [1,1,0,0,0,0|1,0,1]=4 2009 B7R0.4 CCCNCC(C)C 1P00CLO1 [1,1,0,0,0,0|2,0,0]=4 2010 B7R0.4 CCCNCC(F)F 1P01A8RA [1,1,0,0,0,0|2,0,0]=4 2011 B7R0.4 CCCOCC(=O)O 1P00DDPU [1,1,0,0,0,0|1,0,1]=4 2012 B7R0.4 CCCOCC(O)C 1P001PJO [1,1,0,0,0,0|1,0,0]=3 2013 B7R0.4 CCCSCC(=O)O 1P002AXA [1,1,0,0,0,0|1,0,1]=4 2014 B7R0.4 CCNCCC(=O)O 1P019WSK [1,1,0,0,0,0|1,0,1]=4 2015 B7R0.4 CCOCCC(=O)O 1P003JUP [1,1,0,0,0,0|1,0,1]=4 2016 B7R0.4 CCOCC[C@@H](N)C 1P027VGQ [1,1,0,0,0,0|2,0,0]=4 2017 B7R0.4 CCOCC[C@H](N)C 1P027VGC [1,1,0,0,0,0|2,0,0]=4 2018 B7R0.4 CCSCCC(=O)O 1P00FDIY [1,1,0,0,0,0|1,0,1]=4 2019 B7R0.4 CCSCCC(N)C 1P019TG8 [1,1,0,0,0,0|2,0,0]=4 2020 B7R0.4 CNCCCC(=O)O 1P0034AB [1,1,0,0,0,0|1,0,1]=4 2021 B7R0.4 CNCCCC(=O)O 1P007DUH [1,1,0,0,0,0|1,0,1]=4 2022 B7R0.4 CNCCCC(C)C 1P00VV05 [1,1,0,0,0,0|2,0,0]=4 2023 B7R0.4 CNCCCC(C)C 1P01FKWG [1,1,0,0,0,0|2,0,0]=4 2024 B7R0.4 CNCCCC(O)C 1P003ZKV [1,1,0,0,0,0|1,0,0]=3 2025 B7R0.4 COCCCB(O)O 1P01ADVX [1,1,0,0,0,0|2,0,0]=4 2026 B7R0.4 COCCCC(=O)O 1P002VN5 [1,1,0,0,0,0|1,0,1]=4 2027 B7R0.4 COCCCC(Cl)C 1P01A1Q7 [1,1,0,0,0,0|2,0,0]=4 2028 B7R0.4 CSCCCC(=O)O 1P00MDZI [1,1,0,0,0,0|1,0,1]=4 2029 B7R0.4 ClCCCCB(O)O 1P0291HM [1,1,0,0,0,0|2,0,0]=4 2030 B7R0.4 ClCCCCC(=O)C 1P0007J5 [1,1,0,0,0,0|1,0,1]=4 2031 B7R0.4 ClCCCCC(=O)O 1P0034Q2 [1,1,0,0,0,0|1,0,1]=4 2032 B7R0.4 ClCCCCC(Cl)C 1P01DI9T [1,1,0,0,0,0|1,0,0]=3 2033 B7R0.4 ClCCCCN(C)C 1P01A1HS [1,1,0,0,0,0|2,0,0]=4 2034 B7R0.4 ClCCCOC(C)C 1P00FD05 [1,1,0,0,0,0|2,0,0]=4 2035 B7R0.4 ClCCNCC(Cl)C 1P01BCEC [1,1,0,0,0,0|2,0,0]=4 2036 B7R0.4 ClCCOCC(C)C 1P01Q2DJ [1,1,0,0,0,0|2,0,0]=4 2037 B7R0.4 ClCCSCC(C)C 1P01A2YZ [1,1,0,0,0,0|2,0,0]=4 2038 B7R0.4 FCCNC[C@@H](O)C 1P028D42 [1,1,0,0,0,0|2,0,0]=4 2039 B7R0.4 ICCCCC(=O)O 1P027L56 [1,1,0,0,0,0|1,0,1]=4 2040 B7R0.4 NCCCCC(=O)O 1P00390H [1,1,0,0,0,0|1,0,1]=4 2041 B7R0.4 NCCCCC(=O)O 1P003MVH [1,1,0,0,0,0|1,0,1]=4 2042 B7R0.4 NCCCCC(=O)O 1P00HZV1 [1,1,0,0,0,0|1,0,1]=4 2043 B7R0.4 NCCCCC(=O)O 1P01FNTV [1,1,0,0,0,0|1,0,1]=4 2044 B7R0.4 NCCCCC(C)C 1P00PX4E [1,1,0,0,0,0|1,0,0]=3 2045 B7R0.4 NCCCCC(C)C 1P01AKOS [1,1,0,0,0,0|1,0,0]=3 2046 B7R0.4 NCCCCC(F)F 1P023ZIT [1,1,0,0,0,0|2,0,0]=4 2047 B7R0.4 NCCCCC(N)C 1P01BCWK [1,1,0,0,0,0|1,0,0]=3 2048 B7R0.4 NCCCCN(C)C 1P00BXUJ [1,1,0,0,0,0|2,0,0]=4 2049 B7R0.4 NCCCNC(C)C 1P003TL9 [1,1,0,0,0,0|2,0,0]=4 2050 B7R0.4 NCCCOC(C)C 1P002XOS [1,1,0,0,0,0|2,0,0]=4 2051 B7R0.4 NCCCOC(C)C 1P019M1W [1,1,0,0,0,0|2,0,0]=4 2052 B7R0.4 NCCNCC(O)C 1P000KEG [1,1,0,0,0,0|2,0,0]=4 2053 B7R0.4 NCCOCC(C)C 1P00918F [1,1,0,0,0,0|2,0,0]=4 2054 B7R0.4 NCCOCC(C)C 1P01A7TA [1,1,0,0,0,0|2,0,0]=4 2055 B7R0.4 NCCSCC(C)C 1P01A35F [1,1,0,0,0,0|2,0,0]=4 2056 B7R0.4 NOCCCC(O)C 1P028EAZ [1,1,0,0,0,0|2,0,0]=4 2057 B7R0.4 OCC=CCC(C)C 1P0288PH [1,1,0,0,0,0|0,0,2]=4 2058 B7R0.4 OCCCCC(=O)C 1P00BGAI [1,1,0,0,0,0|0,0,1]=3 2059 B7R0.4 OCCCCC(=O)N 1P002ZKN [1,1,0,0,0,0|1,0,1]=4 2060 B7R0.4 OCCCCC(=O)[O-] 1P003ALZ [1,1,0,0,0,0|1,0,1]=4 2061 B7R0.4 OCCCCC(=O)[O-] 1P01AA46 [1,1,0,0,0,0|1,0,1]=4 2062 B7R0.4 OCCCCC(Br)C 1P021RP8 [1,1,0,0,0,0|0,0,0]=2 2063 B7R0.4 OCCCCC(C)C 1P003NCP [1,1,0,0,0,0|0,0,0]=2 2064 B7R0.4 OCCCCC(F)F 1P028ZJ1 [1,1,0,0,0,0|1,0,0]=3 2065 B7R0.4 OCCCCC(N)C 1P01ANVS [1,1,0,0,0,0|0,0,0]=2 2066 B7R0.4 OCCCCC(O)C 1P003E7I [1,1,0,0,0,0|0,0,0]=2 2067 B7R0.4 OCCCCN(C)C 1P00151I [1,1,0,0,0,0|1,0,0]=3 2068 B7R0.4 OCCCNC(C)C 1P003IP4 [1,1,0,0,0,0|1,0,0]=3 2069 B7R0.4 OCCCNC(C)C 1P00J3ID [1,1,0,0,0,0|1,0,0]=3 2070 B7R0.4 OCCCOC(C)C 1P008VPF [1,1,0,0,0,0|1,0,0]=3 2071 B7R0.4 OCCNCC(C)C 1P00J2D1 [1,1,0,0,0,0|1,0,0]=3 2072 B7R0.4 OCCNCC(F)F 1P019UFP [1,1,0,0,0,0|2,0,0]=4 2073 B7R0.4 OCCNCC(O)C 1P006OWY [1,1,0,0,0,0|1,0,0]=3 2074 B7R0.4 OCCOCC(C)C 1P003QZ6 [1,1,0,0,0,0|1,0,0]=3 2075 B7R0.4 OCCOCC(F)F 1P00G63D [1,1,0,0,0,0|2,0,0]=4 2076 B7R0.4 SCCCCC(=O)O 1P002ZTK [1,1,0,0,0,0|1,0,1]=4 2077 B7R0.4 SCCCOC(C)C 1P0290DX [1,1,0,0,0,0|1,1,0]=4 2078 B9R0.4 C=CCCC(CC(O)C)C 1P01B304 [0,2,0,0,0,0|1,0,1]=4 2079 B9R0.4 CCCCC(CC(=O)O)C 1P00DEMS [0,2,0,0,0,0|1,0,1]=4 2080 B9R0.4 CCCCC(CC(=O)O)N 1P003JEA [0,2,0,0,0,0|1,0,1]=4 2081 B9R0.4 CCCCC(CC(=O)O)O 1P0021PJ [0,2,0,0,0,0|0,1,1]=4 2082 B9R0.4 CCCCC(CC(C)C)C 1P00CVUW [0,2,0,0,0,0|2,0,0]=4 2083 B9R0.4 CCCC[C@@H](CC(=O)O)C 1P00E9G5 [0,2,0,0,0,0|1,0,1]=4 2084 B9R0.4 CCCC[C@@H](CC(=O)O)N 1P028ZHI [0,2,0,0,0,0|1,0,1]=4 2085 B9R0.4 CCCC[C@H](CC(=O)O)N 1P01C415 [0,2,0,0,0,0|1,0,1]=4 2086 B9R0.4 CCCNC(CC(=O)O)C 1P01JMXF [0,2,0,0,0,0|1,0,1]=4 2087 B9R0.4 CCNCC(CC(C)C)N 1P01A2EK [0,2,0,0,0,0|2,0,0]=4 2088 B9R0.4 COCCN(CC(C)C)N 1P01BK0W [0,2,0,0,0,0|2,0,0]=4 2089 B9R0.4 CSCC[C@@H](CC(=O)O)N 1P0059MX [0,2,0,0,0,0|1,0,1]=4 2090 B9R0.4 CSCC[C@@H](CC(=O)O)N 1P00C7Q2 [0,2,0,0,0,0|1,0,1]=4 2091 B9R0.4 CSCC[C@@H](CC(=O)O)O 1P0288US [0,2,0,0,0,0|0,1,1]=4 2092 B9R0.4 CSCC[C@H](CC(=O)O)N 1P01KL8J [0,2,0,0,0,0|1,0,1]=4 2093 B9R0.4 CSCC[C@H](CC(=O)O)O 1P028ZRH [0,2,0,0,0,0|0,1,1]=4 2094 B9R0.4 NCCCC(CC(=O)O)N 1P027RZB [0,2,0,0,0,0|1,0,1]=4 2095 B9R0.4 NCCC[C@@H](CC(=O)O)N 1P01BJRD [0,2,0,0,0,0|1,0,1]=4 2096 B9R0.4 OCCCC(CC(C)C)C 1P003L0D [0,2,0,0,0,0|1,0,0]=3 2097 B9R0.4 OCCOC(=O)CC(C)C 1P01HVM4 [0,2,0,0,0,0|0,1,1]=4 2098 B9R0.5 CCCCCC(CCC)C 1P003M8X [0,2,0,0,0,0|2,0,0]=4 2099 B9R0.5 CCCCCC(CCC)O 1P003MDW [0,2,0,0,0,0|1,1,0]=4 2100 B9R0.5 CCCCCC(CCO)O 1P002NOK [0,2,0,0,0,0|0,1,0]=3 2101 B9R0.5 COCCNC(COC)C 1P019WRE [0,2,0,0,0,0|2,0,0]=4 2102 B9R0.5 NCCCCS(=O)CCO 1P028036 [0,2,0,0,0,0|1,1,0]=4 2103 B9R0.5 OCCCOC(=O)CCO 1P024H5D [0,2,0,0,0,0|0,1,1]=4 2104 B9R0.8 CCCCC(C(CC)C)C 1P001R85 [0,2,0,0,0,0|2,0,0]=4 2105 B9R0.8 OCCNC(C(CC)C)C 1P01AYYV [0,2,0,0,0,0|1,0,0]=3 2106 B9R0.18 CCCCC(CCCC)Br 1P028G02 [0,2,0,0,0,0|2,0,0]=4 2107 B9R0.18 CCCCC(CCCC)N 1P003MV5 [0,2,0,0,0,0|2,0,0]=4 2108 B9R0.18 CCCCC(CCCC)N 1P0282WA [0,2,0,0,0,0|2,0,0]=4 2109 B9R0.18 CCCCC(CCCC)O 1P003NE9 [0,2,0,0,0,0|1,1,0]=4 2110 B9R0.18 CCCOC(OCCC)C 1P0038PW [0,2,0,0,0,0|2,0,0]=4 2111 B9R0.18 CCOCC(COCC)O 1P003E09 [0,2,0,0,0,0|1,1,0]=4 2112 B9R0.18 COCCC(=O)CCOC 1P00DVFJ [0,2,0,0,0,0|0,1,1]=4 2113 B9R0.18 NCCCN(CCOC)C 1P019NJG [0,2,0,0,0,0|2,0,0]=4 2114 B9R0.18 OCCCN(CCCO)C 1P00BCRK [0,2,0,0,0,0|2,0,0]=4 2115 B9R0.34 CCCC(CC(=O)OC)N 1P01A4H2 [0,2,0,0,0,0|1,0,1]=4 2116 B9R0.34 CCCC(CC(=O)OC)O 1P003S95 [0,2,0,0,0,0|0,1,1]=4 2117 B9R0.34 CCC[C@@H](CC(=O)OC)N 1P01FJUB [0,2,0,0,0,0|1,0,1]=4 2118 B9R0.34 CCC[C@H](CC(=O)OC)N 1P01FJU4 [0,2,0,0,0,0|1,0,1]=4 2119 B9R0.34 CCC[C@H](CC(=O)OC)O 1P0083AN [0,2,0,0,0,0|0,1,1]=4 2120 B9R0.34 OCCC(CC(CC)C)C 1P000E46 [0,2,0,0,0,0|1,0,0]=3 2121 B9R0.35 CCCC(=O)C(CCC)O 1P003N94 [0,2,0,0,0,0|1,1,0]=4 2122 B9R0.35 CCCC(C(=O)OCC)S 1P028SAF [0,2,0,0,0,0|1,0,1]=4 2123 B9R0.35 CCCC(C(CCC)C)C 1P001R81 [0,2,0,0,0,0|2,0,0]=4 2124 B9R0.35 CCCC(C(NCC)C)C 1P01AH3Z [0,2,0,0,0,0|2,0,0]=4 2125 B9R0.35 CCCN(C(CCN)C)C 1P028VDH [0,2,0,0,0,0|2,0,0]=4 2126 B9R0.35 CCC[C@H]([C@H](CCC)O)O 1P02896F [0,2,0,0,0,0|1,1,0]=4 2127 B9R0.40 CCCCC(CCC)CN 1P019ZHG [0,2,0,0,0,0|2,0,0]=4 2128 B9R0.40 CNCC(CCOC)CN 1P02859G [0,2,0,0,0,0|2,0,0]=4 2129 B9R0.48 CC(OCC)CCC(=O)O 1P024SFD [0,2,0,0,0,0|2,0,0]=4 2130 B9R0.48 CCCC(=O)CCC(=O)O 1P0065J5 [0,2,0,0,0,0|0,1,1]=4 2131 B9R0.48 CCCN(CCC(=O)O)C 1P01ABCF [0,2,0,0,0,0|2,0,0]=4 2132 B9R0.48 COCC(OCC(O)C)C 1P000QKC [0,2,0,0,0,0|2,0,0]=4 2133 B9R0.48 OCCC(CCC(=O)[O-])C 1P0283LP [0,2,0,0,0,0|1,0,1]=4 2134 B9R0.48 OCCN(CCN(C)C)C 1P003BMI [0,2,0,0,0,0|2,0,0]=4 2135 B9R0.6 CC(C(C(=O)O)N)CCC 1P00EBTL [0,2,0,0,0,0|1,0,1]=4 2136 B9R0.6 CC(C(C(=O)O)N)CCC 1P0293HN [0,2,0,0,0,0|1,0,1]=4 2137 B9R0.6 CCCC(C(C(=O)O)N)O 1P01ADO4 [0,2,0,0,0,0|0,1,1]=4 2138 B9R0.6 CCCC(C(C(=O)O)N)O 1P02819B [0,2,0,0,0,0|0,1,1]=4 2139 B9R0.19 CCCC(C(CO)(C)C)O 1P007QOJ [0,2,0,0,0,0|0,1,0]=3 2140 B9R0.23 CC(C(CC(=O)O)O)CC 1P0291JV [0,2,0,0,0,0|0,1,1]=4 2141 B9R0.23 CCC(C(=O)CC(O)C)C 1P0283TE [0,2,0,0,0,0|0,1,1]=4 2142 B9R0.23 CCC(C(CC(O)C)O)C 1P02910J [0,2,0,0,0,0|0,1,0]=3 2143 B9R0.23 OCC(N(CC(O)C)C)C 1P00GFC7 [0,2,0,0,0,0|2,0,0]=4 2144 B9R0.27 OCC(C(C(CO)O)O)O 1P003AGO [0,2,0,0,0,0|1,1,0]=4 2145 B9R0.27 OC[C@@H](C([C@H](CO)O)O)O 1P00G2Y9 [0,2,0,0,0,0|1,1,0]=4 2146 B9R0.27 OC[C@H](C([C@@H](CO)O)O)O 1P003QA7 [0,2,0,0,0,0|1,1,0]=4 2147 B9R0.27 OC[C@H]([C@@H]([C@H](CO)O)O)O 1P001TW0 [0,2,0,0,0,0|1,1,0]=4 2148 B9R0.27 OC[C@H]([C@H]([C@@H](CO)O)O)O 1P0039L6 [0,2,0,0,0,0|1,1,0]=4 2149 B9R0.27 OC[C@H]([C@H]([C@H](CO)O)O)O 1P00I99W [0,2,0,0,0,0|1,1,0]=4 2150 B9R0.37 OCCC(C(CC)CC)N 1P00H6GR [0,2,0,0,0,0|1,0,0]=3 2151 B9R0.14 CCCC(CC(=O)O)C=C 1P01DS36 [0,2,0,0,0,0|1,0,1]=4 2152 B9R0.14 CCCC(CC(=O)O)CC 1P00C0N9 [0,2,0,0,0,0|1,0,1]=4 2153 B9R0.14 OCCC(CC(C)C)CN 1P019TNG [0,2,0,0,0,0|1,0,0]=3 2154 B9R0.14 OCCC(CC(C)C)CN 1P028V59 [0,2,0,0,0,0|1,0,0]=3 2155 B9R0.14 OCCN(CC(O)C)N=O 1P008PI8 [0,2,0,0,0,0|1,1,0]=4 2156 B9R0.44 CCCC(CC(C)(C)C)C 1P001F5G [0,2,0,0,0,0|2,0,0]=4 2157 B9R0.44 NCCC(CC(C)(C)C)C 1P01B1R8 [0,2,0,0,0,0|2,0,0]=4 2158 B9R0.44 NCCC(CC(C)(C)C)C 1P01B1R9 [0,2,0,0,0,0|2,0,0]=4 2159 B9R0.44 OCCC(CC(C)(C)C)C 1P003J04 [0,2,0,0,0,0|1,0,0]=3 2160 B9R0.44 OCCC(CC(C)(C)C)N 1P01DZ46 [0,2,0,0,0,0|1,0,0]=3 2161 B9R0.53 CC(CC(C)C)CC(C)C 1P002S94 [0,2,0,0,0,0|2,0,0]=4 2162 B9R0.53 CC(CC(CC(=O)O)C)C 1P00EG1D [0,2,0,0,0,0|1,0,1]=4 2163 B9R0.53 CC(CC(CC(=O)O)N)C 1P0003JH [0,2,0,0,0,0|1,0,1]=4 2164 B9R0.53 CC(CC(CC(=O)O)N)C 1P003JDB [0,2,0,0,0,0|1,0,1]=4 2165 B9R0.53 CC(CC(CC(=O)O)O)C 1P00CZ4R [0,2,0,0,0,0|0,1,1]=4 2166 B9R0.53 CC(CC(CC(O)C)C)C 1P00DX8U [0,2,0,0,0,0|1,0,0]=3 2167 B9R0.53 CC(CN(CC(O)C)O)O 1P0039MT [0,2,0,0,0,0|1,1,0]=4 2168 B9R0.53 CC(C[C@@H](CC(=O)O)N)C 1P003RP6 [0,2,0,0,0,0|1,0,1]=4 2169 B9R0.53 CC(C[C@@H](CC(=O)O)N)C 1P007O5X [0,2,0,0,0,0|1,0,1]=4 2170 B9R0.53 CC(C[C@@H](CC(=O)O)O)C 1P0288QD [0,2,0,0,0,0|0,1,1]=4 2171 B9R0.53 CC(C[C@H](CC(=O)O)N)C 1P000XNZ [0,2,0,0,0,0|1,0,1]=4 2172 B9R0.53 CC(C[C@H](CC(=O)O)N)C 1P006D2D [0,2,0,0,0,0|1,0,1]=4 2173 B9R0.53 CC(C[C@H](CC(=O)O)O)C 1P0288Q6 [0,2,0,0,0,0|0,1,1]=4 2174 B9R0.53 NC(CC(C)C)CC(C)C 1P01AB7Y [0,2,0,0,0,0|2,0,0]=4 2175 B9R0.53 OC(CC(C)C)CC(C)C 1P003Q06 [0,2,0,0,0,0|1,1,0]=4 2176 B9R0.58 CCCC(CC(=O)O)(C)C 1P006AU5 [0,2,0,0,0,0|1,0,1]=4 2177 B9R0.58 CCCC(CC(=O)O)(O)C 1P00347T [0,2,0,0,0,0|0,1,1]=4 2178 B9R0.15 CCCC(C(=O)C)CCC 1P00D6RE [0,2,0,0,0,0|1,1,0]=4 2179 B9R0.15 CCCC(C(=O)Cl)CCC 1P002YLZ [0,2,0,0,0,0|1,1,0]=4 2180 B9R0.15 CCCC(C(=O)N)CCC 1P003FSP [0,2,0,0,0,0|1,1,0]=4 2181 B9R0.15 CCCC(C(=O)O)CCC 1P0033WB [0,2,0,0,0,0|1,1,0]=4 2182 B9R0.15 CCCC(C(=O)O)CCC 1P00ID7O [0,2,0,0,0,0|1,1,0]=4 2183 B9R0.15 CCCC(C(=O)[O-])CCC 1P00361X [0,2,0,0,0,0|1,1,0]=4 2184 B9R0.15 CCCC([C@@H](N)C)CCC 1P028PDE [0,2,0,0,0,0|2,0,0]=4 2185 B9R0.17 CCCC(CCN)CCC 1P0282KY [0,2,0,0,0,0|2,0,0]=4 2186 B9R0.17 COCC(CCO)COC 1P02907C [0,2,0,0,0,0|1,1,0]=4 2187 B9R0.17 OCCC(OCC)OCC 1P001Y1N [0,2,0,0,0,0|1,1,0]=4 2188 B9R0.59 CCCC(C#N)(CCC)N 1P01A9LQ [0,2,0,0,0,0|2,0,0]=4 2189 B9R0.59 CCCC(CCC)(CN)O 1P01AKFZ [0,2,0,0,0,0|1,1,0]=4 2190 B9R0.59 OCCC(CCO)(CO)O 1P01IZAG [0,2,0,0,0,0|1,1,0]=4 2191 B7R1.1 BrCC1CCCC1 1P003515 [1,0,0,1,0,0|2,0,0]=4 2192 B7R1.1 BrCC1CCCN1 1P00CKVT [1,0,0,1,0,0|2,0,0]=4 2193 B7R1.1 BrCC1CCCO1 1P000ITE [1,0,0,1,0,0|1,1,0]=4 2194 B7R1.1 BrCC1COCC1 1P001WHG [1,0,0,1,0,0|2,0,0]=4 2195 B7R1.1 BrC[C@@H]1CCCN1 1P00DJPT [1,0,0,1,0,0|2,0,0]=4 2196 B7R1.1 BrC[C@@H]1CCCO1 1P01IM3G [1,0,0,1,0,0|1,1,0]=4 2197 B7R1.1 BrC[C@@H]1COCC1 1P020LT7 [1,0,0,1,0,0|2,0,0]=4 2198 B7R1.1 BrC[C@H]1CCCO1 1P00IUP9 [1,0,0,1,0,0|1,1,0]=4 2199 B7R1.1 BrC[C@H]1COCC1 1P020LT9 [1,0,0,1,0,0|2,0,0]=4 2200 B7R1.1 CCC1=CCCC1 1P003ER5 [1,0,0,1,0,0|1,0,1]=4 2201 B7R1.1 CCC1CCCC1 1P003QYP [1,0,0,1,0,0|1,0,0]=3 2202 B7R1.1 CCC1CCCN1 1P01AHO8 [1,0,0,1,0,0|1,0,0]=3 2203 B7R1.1 CCC1CNCC1 1P005S3B [1,0,0,1,0,0|2,0,0]=4 2204 B7R1.1 CCC1CNCC1 1P019ZNZ [1,0,0,1,0,0|2,0,0]=4 2205 B7R1.1 CCN1CCCC1 1P003ES8 [1,0,0,1,0,0|2,0,0]=4 2206 B7R1.1 CC[C@@H]1CCCN1 1P00DIBN [1,0,0,1,0,0|1,0,0]=3 2207 B7R1.1 CC[C@@H]1CNCC1 1P002NX8 [1,0,0,1,0,0|2,0,0]=4 2208 B7R1.1 CC[C@H]1CCCN1 1P00EM15 [1,0,0,1,0,0|1,0,0]=3 2209 B7R1.1 CC[C@H]1CNCC1 1P002NX9 [1,0,0,1,0,0|2,0,0]=4 2210 B7R1.1 CNC1CCCC1 1P007NZ7 [1,0,0,1,0,0|2,0,0]=4 2211 B7R1.1 CNC1CCCC1 1P00G8LD [1,0,0,1,0,0|2,0,0]=4 2212 B7R1.1 CNC1COCC1 1P006OGE [1,0,0,1,0,0|2,0,0]=4 2213 B7R1.1 CNC1COCC1 1P00GUC5 [1,0,0,1,0,0|2,0,0]=4 2214 B7R1.1 CN[C@@H]1COCC1 1P000ZGV [1,0,0,1,0,0|2,0,0]=4 2215 B7R1.1 CN[C@H]1COCC1 1P000ZGS [1,0,0,1,0,0|2,0,0]=4 2216 B7R1.1 COC1CCCC1 1P0035LM [1,0,0,1,0,0|2,0,0]=4 2217 B7R1.1 COC1CCCO1 1P003AIB [1,0,0,1,0,0|1,1,0]=4 2218 B7R1.1 CSC1CCCC1 1P0069WS [1,0,0,1,0,0|2,0,0]=4 2219 B7R1.1 ClCC1CCCC1 1P009GZM [1,0,0,1,0,0|2,0,0]=4 2220 B7R1.1 ClCC1CCCO1 1P003V5P [1,0,0,1,0,0|1,1,0]=4 2221 B7R1.1 ClCC1COCC1 1P00GUC8 [1,0,0,1,0,0|2,0,0]=4 2222 B7R1.1 ClC[C@@H]1CCCN1 1P00CLBF [1,0,0,1,0,0|2,0,0]=4 2223 B7R1.1 FCC1CCCN1 1P01AN6Z [1,0,0,1,0,0|2,0,0]=4 2224 B7R1.1 FC[C@@H]1CCCN1 1P0051XA [1,0,0,1,0,0|2,0,0]=4 2225 B7R1.1 FC[C@H]1CCCN1 1P00IF57 [1,0,0,1,0,0|2,0,0]=4 2226 B7R1.1 ICC1CCCC1 1P003RHG [1,0,0,1,0,0|2,0,0]=4 2227 B7R1.1 ICC1CCCO1 1P00EBHK [1,0,0,1,0,0|1,1,0]=4 2228 B7R1.1 ICC1COCC1 1P0038AU [1,0,0,1,0,0|2,0,0]=4 2229 B7R1.1 NCC1CCCC1 1P0036ET [1,0,0,1,0,0|2,0,0]=4 2230 B7R1.1 NCC1CCCC1 1P00IB6C [1,0,0,1,0,0|2,0,0]=4 2231 B7R1.1 NCC1CCCN1 1P00ECYN [1,0,0,1,0,0|2,0,0]=4 2232 B7R1.1 NCC1CCCO1 1P003IEL [1,0,0,1,0,0|1,1,0]=4 2233 B7R1.1 NCC1CCCO1 1P01B53G [1,0,0,1,0,0|1,1,0]=4 2234 B7R1.1 NCC1COCC1 1P001WHF [1,0,0,1,0,0|2,0,0]=4 2235 B7R1.1 NCC1COCC1 1P00APKV [1,0,0,1,0,0|2,0,0]=4 2236 B7R1.1 NCC1SCCS1 1P01B710 [1,0,0,1,0,0|2,0,0]=4 2237 B7R1.1 NC[C@@H]1CCCN1 1P003D4W [1,0,0,1,0,0|2,0,0]=4 2238 B7R1.1 NC[C@@H]1CCCN1 1P007H8F [1,0,0,1,0,0|2,0,0]=4 2239 B7R1.1 NC[C@@H]1CCCO1 1P003CYT [1,0,0,1,0,0|1,1,0]=4 2240 B7R1.1 NC[C@@H]1CCCO1 1P00C31K [1,0,0,1,0,0|1,1,0]=4 2241 B7R1.1 NC[C@@H]1COCC1 1P001CGW [1,0,0,1,0,0|2,0,0]=4 2242 B7R1.1 NC[C@@H]1COCC1 1P008RTI [1,0,0,1,0,0|2,0,0]=4 2243 B7R1.1 NC[C@H]1CCCN1 1P000PJG [1,0,0,1,0,0|2,0,0]=4 2244 B7R1.1 NC[C@H]1CCCO1 1P01APNK [1,0,0,1,0,0|1,1,0]=4 2245 B7R1.1 NC[C@H]1COCC1 1P008RTH [1,0,0,1,0,0|2,0,0]=4 2246 B7R1.1 NC[C@H]1COCC1 1P00IL9J [1,0,0,1,0,0|2,0,0]=4 2247 B7R1.1 OCC1=CCCC1 1P00842I [1,0,0,1,0,0|1,0,1]=4 2248 B7R1.1 OCC1CCC=C1 1P0012O5 [1,0,0,1,0,0|1,0,1]=4 2249 B7R1.1 OCC1CCCC1 1P00354O [1,0,0,1,0,0|1,0,0]=3 2250 B7R1.1 OCC1CCCN1 1P00D8LK [1,0,0,1,0,0|1,0,0]=3 2251 B7R1.1 OCC1CCCO1 1P003V5N [1,0,0,1,0,0|0,1,0]=3 2252 B7R1.1 OCC1CCCS1 1P00D41W [1,0,0,1,0,0|0,0,0]=2 2253 B7R1.1 OCC1CCON1 1P01EKGH [1,0,0,1,0,0|2,0,0]=4 2254 B7R1.1 OCC1CNCC1 1P001L6R [1,0,0,1,0,0|2,0,0]=4 2255 B7R1.1 OCC1CNCC1 1P003KD2 [1,0,0,1,0,0|2,0,0]=4 2256 B7R1.1 OCC1CNCC1 1P00EB7Y [1,0,0,1,0,0|2,0,0]=4 2257 B7R1.1 OCC1COCC1 1P001QLQ [1,0,0,1,0,0|2,0,0]=4 2258 B7R1.1 OCC1COCO1 1P00IA87 [1,0,0,1,0,0|1,1,0]=4 2259 B7R1.1 OCC1CSCC1 1P01A0OB [1,0,0,1,0,0|2,0,0]=4 2260 B7R1.1 OCC1NCCS1 1P0281VP [1,0,0,1,0,0|1,0,0]=3 2261 B7R1.1 OCC1OCCO1 1P00EGQV [1,0,0,1,0,0|1,1,0]=4 2262 B7R1.1 OC[C@@H]1CCCN1 1P0032WM [1,0,0,1,0,0|1,0,0]=3 2263 B7R1.1 OC[C@@H]1CCCO1 1P0036G1 [1,0,0,1,0,0|0,1,0]=3 2264 B7R1.1 OC[C@@H]1CNCC1 1P000ZXR [1,0,0,1,0,0|2,0,0]=4 2265 B7R1.1 OC[C@@H]1CNCC1 1P003D28 [1,0,0,1,0,0|2,0,0]=4 2266 B7R1.1 OC[C@@H]1COCC1 1P009DDU [1,0,0,1,0,0|2,0,0]=4 2267 B7R1.1 OC[C@H]1CCCN1 1P003CKM [1,0,0,1,0,0|1,0,0]=3 2268 B7R1.1 OC[C@H]1CCCN1 1P00ACI8 [1,0,0,1,0,0|1,0,0]=3 2269 B7R1.1 OC[C@H]1CCCO1 1P0032UH [1,0,0,1,0,0|0,1,0]=3 2270 B7R1.1 OC[C@H]1CNCC1 1P000JI5 [1,0,0,1,0,0|2,0,0]=4 2271 B7R1.1 OC[C@H]1CNCC1 1P003CQ3 [1,0,0,1,0,0|2,0,0]=4 2272 B7R1.1 OC[C@H]1COCC1 1P000MEF [1,0,0,1,0,0|2,0,0]=4 2273 B7R1.1 ONC1CCCC1 1P00IB6K [1,0,0,1,0,0|2,0,0]=4 2274 B7R1.1 SCC1CCCC1 1P01AAKX [1,0,0,1,0,0|1,1,0]=4 2275 B7R1.1 SCC1CCCN1 1P028JI4 [1,0,0,1,0,0|1,1,0]=4 2276 B7R1.1 SCC1COCC1 1P00DKQ0 [1,0,0,1,0,0|2,0,0]=4 2277 B7R1.1 SC[C@@H]1CCCN1 1P028CS9 [1,0,0,1,0,0|1,1,0]=4 2278 B7R1.1 SC[C@H]1CCCN1 1P028BMN [1,0,0,1,0,0|1,1,0]=4 2279 B7R1.1 SC[C@H]1CCCO1 1P028TPO [1,0,0,1,0,0|0,2,0]=4 2280 B7R1.2 CC1CCC(=O)C1 1P0021LM [1,0,0,1,0,0|0,1,1]=4 2281 B7R1.2 CC1CCC(C1)Br 1P01AN9E [1,0,0,1,0,0|1,0,0]=3 2282 B7R1.2 CC1CCC(C1)Cl 1P01A5GG [1,0,0,1,0,0|1,0,0]=3 2283 B7R1.2 CC1CCC(C1)N 1P01A0I3 [1,0,0,1,0,0|1,0,0]=3 2284 B7R1.2 CC1CCC(C1)O 1P003K7U [1,0,0,1,0,0|0,1,0]=3 2285 B7R1.2 CC1CCC(N1)C 1P00EKIP [1,0,0,1,0,0|2,0,0]=4 2286 B7R1.2 CC1CCC(N1)C 1P00I749 [1,0,0,1,0,0|2,0,0]=4 2287 B7R1.2 CC1CCC(O1)C 1P0001ZC [1,0,0,1,0,0|2,0,0]=4 2288 B7R1.2 CC1NCC(C1)C 1P01AKTE [1,0,0,1,0,0|2,0,0]=4 2289 B7R1.2 CC1OCC(O1)C 1P00CARO [1,0,0,1,0,0|2,0,0]=4 2290 B7R1.2 CN1CCC(C1)Br 1P0084Y7 [1,0,0,1,0,0|2,0,0]=4 2291 B7R1.2 CN1CCC(C1)N 1P0010TK [1,0,0,1,0,0|2,0,0]=4 2292 B7R1.2 CN1CCC(C1)N 1P00938I [1,0,0,1,0,0|2,0,0]=4 2293 B7R1.2 CN1CCC(C1)O 1P0010TJ [1,0,0,1,0,0|1,1,0]=4 2294 B7R1.2 CN1CC[C@@H](C1)N 1P003A5O [1,0,0,1,0,0|2,0,0]=4 2295 B7R1.2 CN1CC[C@@H](C1)N 1P00IF1U [1,0,0,1,0,0|2,0,0]=4 2296 B7R1.2 CN1CC[C@@H](C1)O 1P0032WL [1,0,0,1,0,0|1,1,0]=4 2297 B7R1.2 CN1CC[C@H](C1)N 1P003AMQ [1,0,0,1,0,0|2,0,0]=4 2298 B7R1.2 CN1CC[C@H](C1)N 1P00D7X3 [1,0,0,1,0,0|2,0,0]=4 2299 B7R1.2 CN1CC[C@H](C1)O 1P0039GS [1,0,0,1,0,0|1,1,0]=4 2300 B7R1.2 C[C@@H]1CCC(=O)C1 1P003CMA [1,0,0,1,0,0|0,1,1]=4 2301 B7R1.2 C[C@@H]1CC[C@@H](N1)C 1P00ILRG [1,0,0,1,0,0|2,0,0]=4 2302 B7R1.2 C[C@@H]1CC[C@H](N1)C 1P00FEDI [1,0,0,1,0,0|2,0,0]=4 2303 B7R1.2 C[C@H]1CCC(=O)C1 1P00H79H [1,0,0,1,0,0|0,1,1]=4 2304 B7R1.2 C[C@H]1CC[C@@H](N1)C 1P01JJ1L [1,0,0,1,0,0|2,0,0]=4 2305 B7R1.2 FC1CCC(C1)Br 1P0285YJ [1,0,0,1,0,0|2,0,0]=4 2306 B7R1.2 FC1CNC(C1)C 1P028IQM [1,0,0,1,0,0|2,0,0]=4 2307 B7R1.2 F[C@@H]1CN[C@@H](C1)C 1P00I3KD [1,0,0,1,0,0|2,0,0]=4 2308 B7R1.2 F[C@@H]1CN[C@H](C1)C 1P024HC5 [1,0,0,1,0,0|2,0,0]=4 2309 B7R1.2 F[C@H]1CN[C@@H](C1)C 1P01XIFO [1,0,0,1,0,0|2,0,0]=4 2310 B7R1.2 F[C@H]1CN[C@H](C1)C 1P024HJK [1,0,0,1,0,0|2,0,0]=4 2311 B7R1.2 NC1CCC(C1)F 1P01B95V [1,0,0,1,0,0|2,0,0]=4 2312 B7R1.2 NC1CCC(C1)N 1P01B6LD [1,0,0,1,0,0|2,0,0]=4 2313 B7R1.2 NC1CCC(C1)O 1P0013HI [1,0,0,1,0,0|1,0,0]=3 2314 B7R1.2 NC1CCC(C1)O 1P003ATO [1,0,0,1,0,0|1,0,0]=3 2315 B7R1.2 NC1COC(C1)C 1P00BBVZ [1,0,0,1,0,0|1,0,0]=3 2316 B7R1.2 NC1COC(C1)C 1P01C3CB [1,0,0,1,0,0|1,0,0]=3 2317 B7R1.2 NC1CSC(C1)C 1P01C3DZ [1,0,0,1,0,0|1,1,0]=4 2318 B7R1.2 N[C@@H]1CC[C@@H](C1)F 1P01JVFM [1,0,0,1,0,0|2,0,0]=4 2319 B7R1.2 N[C@@H]1CC[C@@H](C1)N 1P00IN3F [1,0,0,1,0,0|2,0,0]=4 2320 B7R1.2 N[C@@H]1CC[C@@H](C1)O 1P000YJ2 [1,0,0,1,0,0|1,0,0]=3 2321 B7R1.2 N[C@@H]1CC[C@@H](C1)O 1P007XRF [1,0,0,1,0,0|1,0,0]=3 2322 B7R1.2 N[C@@H]1CC[C@H](C1)Cl 1P028JKD [1,0,0,1,0,0|2,0,0]=4 2323 B7R1.2 N[C@@H]1CC[C@H](C1)F 1P01DUAY [1,0,0,1,0,0|2,0,0]=4 2324 B7R1.2 N[C@@H]1CC[C@H](C1)N 1P00AT3S [1,0,0,1,0,0|2,0,0]=4 2325 B7R1.2 N[C@@H]1CC[C@H](C1)O 1P000MNR [1,0,0,1,0,0|1,0,0]=3 2326 B7R1.2 N[C@H]1CC[C@@H](C1)N 1P024X6E [1,0,0,1,0,0|2,0,0]=4 2327 B7R1.2 N[C@H]1CC[C@@H](C1)O 1P0032SH [1,0,0,1,0,0|1,0,0]=3 2328 B7R1.2 N[C@H]1CC[C@@H](C1)O 1P0039LP [1,0,0,1,0,0|1,0,0]=3 2329 B7R1.2 N[C@H]1CC[C@H](C1)F 1P00IHZG [1,0,0,1,0,0|2,0,0]=4 2330 B7R1.2 N[C@H]1CC[C@H](C1)F 1P01DL3F [1,0,0,1,0,0|2,0,0]=4 2331 B7R1.2 N[C@H]1CC[C@H](C1)O 1P000XZL [1,0,0,1,0,0|1,0,0]=3 2332 B7R1.2 OC1CCC(=O)C1 1P0038LJ [1,0,0,1,0,0|0,1,1]=4 2333 B7R1.2 OC1CCC(C1)Br 1P006X0X [1,0,0,1,0,0|1,0,0]=3 2334 B7R1.2 OC1CCC(C1)O 1P003DZ4 [1,0,0,1,0,0|0,1,0]=3 2335 B7R1.2 OC1CCC(C1)S 1P028T6P [1,0,0,1,0,0|0,0,0]=2 2336 B7R1.2 OC1CNC(C1)C 1P01A1FZ [1,0,0,1,0,0|1,1,0]=4 2337 B7R1.2 OC1CNC(C1)C 1P01BD6F [1,0,0,1,0,0|1,1,0]=4 2338 B7R1.2 O[C@@H]1CC[C@@H](C1)O 1P001UEV [1,0,0,1,0,0|0,1,0]=3 2339 B7R1.2 O[C@@H]1CC[C@H](C1)O 1P019GHU [1,0,0,1,0,0|0,1,0]=3 2340 B7R1.2 O[C@@H]1CN[C@@H](C1)C 1P00HC8F [1,0,0,1,0,0|1,1,0]=4 2341 B7R1.2 O[C@@H]1CN[C@H](C1)C 1P008ZIO [1,0,0,1,0,0|1,1,0]=4 2342 B7R1.2 O[C@H]1CN[C@@H](C1)C 1P00GAJW [1,0,0,1,0,0|1,1,0]=4 2343 B7R1.2 O[C@H]1CN[C@H](C1)C 1P00ILSC [1,0,0,1,0,0|1,1,0]=4 2344 B7R1.3 BrC1CCCCC1 1P003P12 [1,0,0,1,0,0|1,0,0]=3 2345 B7R1.3 BrC1CCCCO1 1P01B2UX [1,0,0,1,0,0|2,0,0]=4 2346 B7R1.3 BrC1CCCNC1 1P00DBEH [1,0,0,1,0,0|2,0,0]=4 2347 B7R1.3 BrC1CCCNC1 1P00ILCZ [1,0,0,1,0,0|2,0,0]=4 2348 B7R1.3 BrC1CCCOC1 1P000UY4 [1,0,0,1,0,0|1,0,0]=3 2349 B7R1.3 BrC1CCNCC1 1P0001J9 [1,0,0,1,0,0|2,0,0]=4 2350 B7R1.3 BrC1CCNCC1 1P00DENR [1,0,0,1,0,0|2,0,0]=4 2351 B7R1.3 BrC1CCOCC1 1P0034FF [1,0,0,1,0,0|1,0,0]=3 2352 B7R1.3 BrC1CCSCC1 1P00I6LD [1,0,0,1,0,0|1,1,0]=4 2353 B7R1.3 C=C1CCCCC1 1P000PMZ [1,0,0,1,0,0|1,0,1]=4 2354 B7R1.3 C=C1CCCOC1 1P004I6X [1,0,0,1,0,0|1,0,1]=4 2355 B7R1.3 C=C1CCOCC1 1P0078D5 [1,0,0,1,0,0|1,0,1]=4 2356 B7R1.3 CC1CCCCN1 1P0033V1 [1,0,0,1,0,0|2,0,0]=4 2357 B7R1.3 CC1CCCNC1 1P003K8H [1,0,0,1,0,0|2,0,0]=4 2358 B7R1.3 CC1CCNCC1 1P0036FU [1,0,0,1,0,0|2,0,0]=4 2359 B7R1.3 CC1CCOCC1 1P00E0HP [1,0,0,1,0,0|1,0,0]=3 2360 B7R1.3 CC1CCOCN1 1P01EJQY [1,0,0,1,0,0|2,0,0]=4 2361 B7R1.3 CC1CCOCO1 1P003M61 [1,0,0,1,0,0|2,0,0]=4 2362 B7R1.3 CC1COCCN1 1P002GNC [1,0,0,1,0,0|2,0,0]=4 2363 B7R1.3 CC1COCCN1 1P0073P9 [1,0,0,1,0,0|2,0,0]=4 2364 B7R1.3 CN1CCOCC1 1P0034KM [1,0,0,1,0,0|2,0,0]=4 2365 B7R1.3 CN1CCOCC1 1P003B0R [1,0,0,1,0,0|2,0,0]=4 2366 B7R1.3 C[C@@H]1CCCCN1 1P007DLX [1,0,0,1,0,0|2,0,0]=4 2367 B7R1.3 C[C@@H]1CCCCN1 1P01EUPR [1,0,0,1,0,0|2,0,0]=4 2368 B7R1.3 C[C@@H]1CCCNC1 1P001VT5 [1,0,0,1,0,0|2,0,0]=4 2369 B7R1.3 C[C@@H]1CCCNC1 1P00BGKY [1,0,0,1,0,0|2,0,0]=4 2370 B7R1.3 C[C@@H]1COCCN1 1P0032VW [1,0,0,1,0,0|2,0,0]=4 2371 B7R1.3 C[C@@H]1COCCN1 1P0037B0 [1,0,0,1,0,0|2,0,0]=4 2372 B7R1.3 C[C@H]1CCCCN1 1P002AMJ [1,0,0,1,0,0|2,0,0]=4 2373 B7R1.3 C[C@H]1CCCCN1 1P00I6IS [1,0,0,1,0,0|2,0,0]=4 2374 B7R1.3 C[C@H]1CCCNC1 1P001ONX [1,0,0,1,0,0|2,0,0]=4 2375 B7R1.3 C[C@H]1CCCNC1 1P00ADA8 [1,0,0,1,0,0|2,0,0]=4 2376 B7R1.3 C[C@H]1COCCN1 1P0007EQ [1,0,0,1,0,0|2,0,0]=4 2377 B7R1.3 C[C@H]1COCCN1 1P0032XT [1,0,0,1,0,0|2,0,0]=4 2378 B7R1.3 ClC1CCCCC1 1P00IA54 [1,0,0,1,0,0|1,0,0]=3 2379 B7R1.3 ClC1CCCOC1 1P019YWV [1,0,0,1,0,0|1,0,0]=3 2380 B7R1.3 ClC1CCNCC1 1P00DBUB [1,0,0,1,0,0|2,0,0]=4 2381 B7R1.3 ClC1CCNCC1 1P00IA2E [1,0,0,1,0,0|2,0,0]=4 2382 B7R1.3 ClC1CCOCC1 1P0025DT [1,0,0,1,0,0|1,0,0]=3 2383 B7R1.3 FC1CCCCC1 1P003R2P [1,0,0,1,0,0|1,0,0]=3 2384 B7R1.3 FC1CCCNC1 1P000D9H [1,0,0,1,0,0|2,0,0]=4 2385 B7R1.3 FC1CCCNC1 1P00346E [1,0,0,1,0,0|2,0,0]=4 2386 B7R1.3 FC1CCNCC1 1P0036AQ [1,0,0,1,0,0|2,0,0]=4 2387 B7R1.3 FC1CCNCC1 1P005OZ5 [1,0,0,1,0,0|2,0,0]=4 2388 B7R1.3 F[C@@H]1CCCNC1 1P00GJ0L [1,0,0,1,0,0|2,0,0]=4 2389 B7R1.3 F[C@H]1CCCNC1 1P00H3M8 [1,0,0,1,0,0|2,0,0]=4 2390 B7R1.3 IC1CCCCC1 1P003RHE [1,0,0,1,0,0|1,0,0]=3 2391 B7R1.3 IC1CCNCC1 1P009XNS [1,0,0,1,0,0|2,0,0]=4 2392 B7R1.3 IC1CCOCC1 1P00BFX2 [1,0,0,1,0,0|1,0,0]=3 2393 B7R1.3 IC1CCSCC1 1P00C2AL [1,0,0,1,0,0|1,1,0]=4 2394 B7R1.3 NC1CCCCC1 1P000ZPD [1,0,0,1,0,0|1,0,0]=3 2395 B7R1.3 NC1CCCCC1 1P002SSK [1,0,0,1,0,0|1,0,0]=3 2396 B7R1.3 NC1CCCCC1 1P003PM2 [1,0,0,1,0,0|1,0,0]=3 2397 B7R1.3 NC1CCCCC1 1P003PM3 [1,0,0,1,0,0|1,0,0]=3 2398 B7R1.3 NC1CCCCC1 1P00C7GJ [1,0,0,1,0,0|1,0,0]=3 2399 B7R1.3 NC1CCCCC1 1P01E40Y [1,0,0,1,0,0|1,0,0]=3 2400 B7R1.3 NC1CCCNC1 1P0018DZ [1,0,0,1,0,0|2,0,0]=4 2401 B7R1.3 NC1CCCNC1 1P00DEKQ [1,0,0,1,0,0|2,0,0]=4 2402 B7R1.3 NC1CCCOC1 1P0039S6 [1,0,0,1,0,0|1,0,0]=3 2403 B7R1.3 NC1CCCOC1 1P008TJQ [1,0,0,1,0,0|1,0,0]=3 2404 B7R1.3 NC1CCCSC1 1P01ALPH [1,0,0,1,0,0|1,1,0]=4 2405 B7R1.3 NC1CCNCC1 1P003L8M [1,0,0,1,0,0|2,0,0]=4 2406 B7R1.3 NC1CCNCC1 1P00I7J8 [1,0,0,1,0,0|2,0,0]=4 2407 B7R1.3 NC1CCOCC1 1P0002RI [1,0,0,1,0,0|1,0,0]=3 2408 B7R1.3 NC1CCOCC1 1P0034DI [1,0,0,1,0,0|1,0,0]=3 2409 B7R1.3 NC1CCOCC1 1P0034DJ [1,0,0,1,0,0|1,0,0]=3 2410 B7R1.3 NC1CCSCC1 1P002NGW [1,0,0,1,0,0|1,1,0]=4 2411 B7R1.3 NC1CCSCC1 1P00C1QN [1,0,0,1,0,0|1,1,0]=4 2412 B7R1.3 NC1COCOC1 1P01B7QH [1,0,0,1,0,0|2,0,0]=4 2413 B7R1.3 NN1CCCCC1 1P003EET [1,0,0,1,0,0|2,0,0]=4 2414 B7R1.3 NN1CCCCC1 1P003T6T [1,0,0,1,0,0|2,0,0]=4 2415 B7R1.3 NN1CCOCC1 1P003L84 [1,0,0,1,0,0|2,0,0]=4 2416 B7R1.3 N[C@@H]1CCCNC1 1P000XD1 [1,0,0,1,0,0|2,0,0]=4 2417 B7R1.3 N[C@@H]1CCCNC1 1P0032U8 [1,0,0,1,0,0|2,0,0]=4 2418 B7R1.3 N[C@@H]1CCCOC1 1P000ZV1 [1,0,0,1,0,0|1,0,0]=3 2419 B7R1.3 N[C@H]1CCCNC1 1P0037TI [1,0,0,1,0,0|2,0,0]=4 2420 B7R1.3 N[C@H]1CCCNC1 1P0057E7 [1,0,0,1,0,0|2,0,0]=4 2421 B7R1.3 N[C@H]1CCCOC1 1P000MUB [1,0,0,1,0,0|1,0,0]=3 2422 B7R1.3 O=C1CCCOC1 1P002NSO [1,0,0,1,0,0|0,1,1]=4 2423 B7R1.3 O=C1CCOCC1 1P0034LC [1,0,0,1,0,0|0,1,1]=4 2424 B7R1.3 OC1CCCCC1 1P003PLH [1,0,0,1,0,0|0,1,0]=3 2425 B7R1.3 OC1CCCCN1 1P00D9C2 [1,0,0,1,0,0|1,1,0]=4 2426 B7R1.3 OC1CCCCO1 1P00FB2P [1,0,0,1,0,0|1,1,0]=4 2427 B7R1.3 OC1CCCNC1 1P00346W [1,0,0,1,0,0|1,1,0]=4 2428 B7R1.3 OC1CCCNC1 1P00IBS0 [1,0,0,1,0,0|1,1,0]=4 2429 B7R1.3 OC1CCCOC1 1P002BBW [1,0,0,1,0,0|0,1,0]=3 2430 B7R1.3 OC1CCCSC1 1P007QC5 [1,0,0,1,0,0|0,2,0]=4 2431 B7R1.3 OC1CCNCC1 1P0034J6 [1,0,0,1,0,0|1,1,0]=4 2432 B7R1.3 OC1CCNCC1 1P00DEUF [1,0,0,1,0,0|1,1,0]=4 2433 B7R1.3 OC1CCNOC1 1P01FI74 [1,0,0,1,0,0|1,1,0]=4 2434 B7R1.3 OC1CCNOC1 1P028UDA [1,0,0,1,0,0|1,1,0]=4 2435 B7R1.3 OC1CCOCC1 1P002JYI [1,0,0,1,0,0|0,1,0]=3 2436 B7R1.3 OC1CCONC1 1P01FI2N [1,0,0,1,0,0|1,1,0]=4 2437 B7R1.3 OC1CCONC1 1P028Y01 [1,0,0,1,0,0|1,1,0]=4 2438 B7R1.3 OC1CCSCC1 1P002ZKU [1,0,0,1,0,0|0,2,0]=4 2439 B7R1.3 OC1COCOC1 1P019VAG [1,0,0,1,0,0|1,1,0]=4 2440 B7R1.3 ON1CCCCC1 1P00DA6U [1,0,0,1,0,0|1,1,0]=4 2441 B7R1.3 ON1CCOCC1 1P00EZ6W [1,0,0,1,0,0|1,1,0]=4 2442 B7R1.3 O[C@@H]1CCCNC1 1P002CAH [1,0,0,1,0,0|1,1,0]=4 2443 B7R1.3 O[C@@H]1CCCNC1 1P00EIV4 [1,0,0,1,0,0|1,1,0]=4 2444 B7R1.3 O[C@@H]1CCCOC1 1P0003PN [1,0,0,1,0,0|0,1,0]=3 2445 B7R1.3 O[C@H]1CCCNC1 1P003D2O [1,0,0,1,0,0|1,1,0]=4 2446 B7R1.3 O[C@H]1CCCNC1 1P00I54D [1,0,0,1,0,0|1,1,0]=4 2447 B7R1.3 O[C@H]1CCCOC1 1P00FFT0 [1,0,0,1,0,0|0,1,0]=3 2448 B7R1.3 S=C1CCCCC1 1P01G8O5 [1,0,0,1,0,0|0,0,2]=4 2449 B7R1.3 SC1CCCNC1 1P000OZB [1,0,0,1,0,0|1,0,0]=3 2450 B7R1.3 SC1CCCOC1 1P00CY91 [1,0,0,1,0,0|0,0,0]=2 2451 B7R1.3 SC1CCNCC1 1P00IKPD [1,0,0,1,0,0|1,0,0]=3 2452 B7R1.3 SC1CCOCC1 1P00297Q [1,0,0,1,0,0|0,0,0]=2 2453 B7R1.3 SC1CCSCC1 1P01EJ9C [1,0,0,1,0,0|0,1,0]=3 2454 B7R1.3 S[C@@H]1CCCNC1 1P027SDX [1,0,0,1,0,0|1,0,0]=3 2455 B7R1.3 S[C@H]1CCCNC1 1P027XVA [1,0,0,1,0,0|1,0,0]=3 2456 B7R1.4 BrC1CCCC1C 1P01APKT [1,0,0,1,0,0|1,0,0]=3 2457 B7R1.4 BrC1CCCC1N 1P019ZLA [1,0,0,1,0,0|2,0,0]=4 2458 B7R1.4 BrC1CCCC1O 1P005CWJ [1,0,0,1,0,0|1,0,0]=3 2459 B7R1.4 BrC1COCC1O 1P01BI5C [1,0,0,1,0,0|2,0,0]=4 2460 B7R1.4 Br[C@@H]1CCC[C@@H]1O 1P00BWF7 [1,0,0,1,0,0|1,0,0]=3 2461 B7R1.4 Br[C@@H]1CCC[C@H]1Br 1P0007MB [1,0,0,1,0,0|2,0,0]=4 2462 B7R1.4 Br[C@@H]1COC[C@H]1O 1P000BRK [1,0,0,1,0,0|2,0,0]=4 2463 B7R1.4 Br[C@H]1CCC[C@H]1C 1P0285VB [1,0,0,1,0,0|1,0,0]=3 2464 B7R1.4 C=C1CCCC1O 1P002A2S [1,0,0,1,0,0|1,0,1]=4 2465 B7R1.4 CC1CCCC1C 1P002OVL [1,0,0,1,0,0|1,0,0]=3 2466 B7R1.4 CC1CNCC1C 1P00ICYK [1,0,0,1,0,0|2,0,0]=4 2467 B7R1.4 CC1NCCC1C 1P019UAJ [1,0,0,1,0,0|2,0,0]=4 2468 B7R1.4 C[C@@H]1CNC[C@@H]1C 1P00J2M9 [1,0,0,1,0,0|2,0,0]=4 2469 B7R1.4 C[C@@H]1CNC[C@H]1C 1P00J2M8 [1,0,0,1,0,0|2,0,0]=4 2470 B7R1.4 ClC1CCCC1N 1P018SNK [1,0,0,1,0,0|2,0,0]=4 2471 B7R1.4 ClC1OCCC1Cl 1P003FYI [1,0,0,1,0,0|2,0,0]=4 2472 B7R1.4 Cl[C@@H]1CCC[C@@H]1O 1P007QXK [1,0,0,1,0,0|1,0,0]=3 2473 B7R1.4 F[C@@H]1CCC[C@@H]1N 1P01ANCG [1,0,0,1,0,0|2,0,0]=4 2474 B7R1.4 F[C@@H]1CCC[C@H]1N 1P00IL9Y [1,0,0,1,0,0|2,0,0]=4 2475 B7R1.4 F[C@@H]1CCC[C@H]1O 1P007NEZ [1,0,0,1,0,0|1,0,0]=3 2476 B7R1.4 F[C@@H]1CNC[C@@H]1O 1P00HXDM [1,0,0,1,0,0|2,0,0]=4 2477 B7R1.4 F[C@@H]1CNC[C@H]1O 1P002DCF [1,0,0,1,0,0|2,0,0]=4 2478 B7R1.4 F[C@@H]1COC[C@H]1O 1P00I0ET [1,0,0,1,0,0|2,0,0]=4 2479 B7R1.4 F[C@H]1CCC[C@@H]1N 1P0205LB [1,0,0,1,0,0|2,0,0]=4 2480 B7R1.4 F[C@H]1CCC[C@@H]1O 1P01ALS0 [1,0,0,1,0,0|1,0,0]=3 2481 B7R1.4 F[C@H]1CCC[C@H]1N 1P01ANCE [1,0,0,1,0,0|2,0,0]=4 2482 B7R1.4 F[C@H]1CNC[C@@H]1O 1P002FDT [1,0,0,1,0,0|2,0,0]=4 2483 B7R1.4 F[C@H]1CNC[C@H]1C 1P00I3RW [1,0,0,1,0,0|2,0,0]=4 2484 B7R1.4 F[C@H]1CNC[C@H]1O 1P01DL3T [1,0,0,1,0,0|2,0,0]=4 2485 B7R1.4 I[C@@H]1CCC[C@H]1O 1P027UTY [1,0,0,1,0,0|1,0,0]=3 2486 B7R1.4 NC1CCCC1C 1P00DJ2G [1,0,0,1,0,0|1,0,0]=3 2487 B7R1.4 NC1CCCC1N 1P009X4W [1,0,0,1,0,0|2,0,0]=4 2488 B7R1.4 NC1CCSC1C 1P01C5GM [1,0,0,1,0,0|1,1,0]=4 2489 B7R1.4 NC1CNCC1C 1P01BJ5V [1,0,0,1,0,0|2,0,0]=4 2490 B7R1.4 NC1COCC1C 1P01B6KT [1,0,0,1,0,0|2,0,0]=4 2491 B7R1.4 NC1CSCC1C 1P01BAM2 [1,0,0,1,0,0|2,0,0]=4 2492 B7R1.4 N[C@@H]1CCC[C@@H]1C 1P00HABK [1,0,0,1,0,0|1,0,0]=3 2493 B7R1.4 N[C@@H]1CCC[C@@H]1N 1P0032JQ [1,0,0,1,0,0|2,0,0]=4 2494 B7R1.4 N[C@@H]1CCC[C@H]1C 1P0280A3 [1,0,0,1,0,0|1,0,0]=3 2495 B7R1.4 N[C@@H]1CCC[C@H]1N 1P00IKQH [1,0,0,1,0,0|2,0,0]=4 2496 B7R1.4 N[C@@H]1CCO[C@@H]1C 1P00I0QF [1,0,0,1,0,0|1,0,0]=3 2497 B7R1.4 N[C@H]1CNC[C@H]1C 1P01JUWU [1,0,0,1,0,0|2,0,0]=4 2498 B7R1.4 N[C@H]1COC[C@H]1C 1P0280JR [1,0,0,1,0,0|2,0,0]=4 2499 B7R1.4 O=C1CCCC1C 1P008SEF [1,0,0,1,0,0|0,1,1]=4 2500 B7R1.4 O=C1CCCC1O 1P00DLEF [1,0,0,1,0,0|0,1,1]=4 2501 B7R1.4 O=C1CCOC1C 1P003V5J [1,0,0,1,0,0|0,1,1]=4 2502 B7R1.4 O=C1OCCC1S 1P001CQF [1,0,0,1,0,0|1,0,1]=4 2503 B7R1.4 OC1CCCC1C 1P003I5T [1,0,0,1,0,0|0,1,0]=3 2504 B7R1.4 OC1CCCC1N 1P0063PU [1,0,0,1,0,0|1,0,0]=3 2505 B7R1.4 OC1CCCC1O 1P003DTU [1,0,0,1,0,0|0,1,0]=3 2506 B7R1.4 OC1CCOC1C 1P01ADF1 [1,0,0,1,0,0|0,1,0]=3 2507 B7R1.4 OC1CCSC1C 1P019UA5 [1,0,0,1,0,0|0,2,0]=4 2508 B7R1.4 OC1CNCC1C 1P00B7NZ [1,0,0,1,0,0|1,1,0]=4 2509 B7R1.4 OC1CNCC1N 1P00GAL6 [1,0,0,1,0,0|2,0,0]=4 2510 B7R1.4 OC1CNCC1O 1P019ZAG [1,0,0,1,0,0|1,1,0]=4 2511 B7R1.4 OC1CNCC1O 1P01BEZ4 [1,0,0,1,0,0|1,1,0]=4 2512 B7R1.4 OC1COCC1N 1P000W1Z [1,0,0,1,0,0|2,0,0]=4 2513 B7R1.4 OC1COCC1N 1P001KPS [1,0,0,1,0,0|2,0,0]=4 2514 B7R1.4 OC1COCC1O 1P003IYI [1,0,0,1,0,0|1,1,0]=4 2515 B7R1.4 O[C@@H]1CCC[C@@H]1C 1P002R27 [1,0,0,1,0,0|0,1,0]=3 2516 B7R1.4 O[C@@H]1CCC[C@@H]1N 1P0013H6 [1,0,0,1,0,0|1,0,0]=3 2517 B7R1.4 O[C@@H]1CCC[C@@H]1O 1P00DCJ3 [1,0,0,1,0,0|0,1,0]=3 2518 B7R1.4 O[C@@H]1CCC[C@H]1C 1P002R28 [1,0,0,1,0,0|0,1,0]=3 2519 B7R1.4 O[C@@H]1CCC[C@H]1N 1P003662 [1,0,0,1,0,0|1,0,0]=3 2520 B7R1.4 O[C@@H]1CCC[C@H]1O 1P003BES [1,0,0,1,0,0|0,1,0]=3 2521 B7R1.4 O[C@@H]1CCN[C@H]1C 1P01B8DB [1,0,0,1,0,0|1,1,0]=4 2522 B7R1.4 O[C@@H]1CNC[C@@H]1O 1P0039YU [1,0,0,1,0,0|1,1,0]=4 2523 B7R1.4 O[C@@H]1CNC[C@H]1C 1P028P0R [1,0,0,1,0,0|1,1,0]=4 2524 B7R1.4 O[C@@H]1CNC[C@H]1N 1P028GSI [1,0,0,1,0,0|2,0,0]=4 2525 B7R1.4 O[C@@H]1CNC[C@H]1O 1P003APN [1,0,0,1,0,0|1,1,0]=4 2526 B7R1.4 O[C@@H]1CNC[C@H]1O 1P00ADCF [1,0,0,1,0,0|1,1,0]=4 2527 B7R1.4 O[C@@H]1COC[C@@H]1N 1P00DWPL [1,0,0,1,0,0|2,0,0]=4 2528 B7R1.4 O[C@@H]1COC[C@@H]1N 1P00ILJZ [1,0,0,1,0,0|2,0,0]=4 2529 B7R1.4 O[C@@H]1COC[C@@H]1O 1P003ACE [1,0,0,1,0,0|1,1,0]=4 2530 B7R1.4 O[C@@H]1COC[C@H]1C 1P028HPJ [1,0,0,1,0,0|1,1,0]=4 2531 B7R1.4 O[C@@H]1COC[C@H]1N 1P003AXA [1,0,0,1,0,0|2,0,0]=4 2532 B7R1.4 O[C@@H]1COC[C@H]1N 1P01BD0K [1,0,0,1,0,0|2,0,0]=4 2533 B7R1.4 O[C@H]1CCC[C@@H]1C 1P01E8JT [1,0,0,1,0,0|0,1,0]=3 2534 B7R1.4 O[C@H]1CCC[C@@H]1N 1P003663 [1,0,0,1,0,0|1,0,0]=3 2535 B7R1.4 O[C@H]1CCC[C@@H]1N 1P00EI3F [1,0,0,1,0,0|1,0,0]=3 2536 B7R1.4 O[C@H]1CCC[C@@H]1N 1P00I6HD [1,0,0,1,0,0|1,0,0]=3 2537 B7R1.4 O[C@H]1CCC[C@@H]1O 1P00E936 [1,0,0,1,0,0|0,1,0]=3 2538 B7R1.4 O[C@H]1CCC[C@H]1N 1P00352Q [1,0,0,1,0,0|1,0,0]=3 2539 B7R1.4 O[C@H]1CCN[C@@H]1C 1P01PAQL [1,0,0,1,0,0|1,1,0]=4 2540 B7R1.4 O[C@H]1CCN[C@H]1C 1P01E88W [1,0,0,1,0,0|1,1,0]=4 2541 B7R1.4 O[C@H]1CNC[C@@H]1C 1P002TYQ [1,0,0,1,0,0|1,1,0]=4 2542 B7R1.4 O[C@H]1CNC[C@@H]1O 1P002UW7 [1,0,0,1,0,0|1,1,0]=4 2543 B7R1.4 O[C@H]1CNC[C@@H]1O 1P006E9R [1,0,0,1,0,0|1,1,0]=4 2544 B7R1.4 O[C@H]1CNC[C@H]1C 1P002TZU [1,0,0,1,0,0|1,1,0]=4 2545 B7R1.4 O[C@H]1CNC[C@H]1C 1P01K8GK [1,0,0,1,0,0|1,1,0]=4 2546 B7R1.4 O[C@H]1COC[C@@H]1C 1P00I856 [1,0,0,1,0,0|1,1,0]=4 2547 B7R1.4 O[C@H]1COC[C@@H]1N 1P002FAF [1,0,0,1,0,0|2,0,0]=4 2548 B7R1.4 O[C@H]1COC[C@@H]1N 1P00BFVI [1,0,0,1,0,0|2,0,0]=4 2549 B7R1.4 O[C@H]1COC[C@@H]1N 1P00C780 [1,0,0,1,0,0|2,0,0]=4 2550 B7R1.4 O[C@H]1COC[C@@H]1O 1P004ZNU [1,0,0,1,0,0|1,1,0]=4 2551 B7R1.4 O[C@H]1COC[C@H]1C 1P027N5M [1,0,0,1,0,0|1,1,0]=4 2552 B7R1.4 O[C@H]1COC[C@H]1N 1P00AEA6 [1,0,0,1,0,0|2,0,0]=4 2553 B7R1.4 SC1CCOC1C 1P003I7F [1,0,0,1,0,0|0,0,0]=2 2554 B7R1.5 CC1CC1CCN 1P028C8I [1,0,0,1,0,0|2,0,0]=4 2555 B7R1.5 CNCC1CC1C 1P027ZCX [1,0,0,1,0,0|2,0,0]=4 2556 B7R1.6 BrCCC1CCC1 1P01C4OF [1,0,0,1,0,0|2,0,0]=4 2557 B7R1.6 BrCCC1COC1 1P0204ZL [1,0,0,1,0,0|2,0,0]=4 2558 B7R1.6 CCCC1CCS1 1P01HA0Z [1,0,0,1,0,0|0,0,0]=2 2559 B7R1.6 CCCC1CNC1 1P01JM7C [1,0,0,1,0,0|2,0,0]=4 2560 B7R1.6 CCCC1CNC1 1P01JWSU [1,0,0,1,0,0|2,0,0]=4 2561 B7R1.6 CCNC1CCC1 1P018SF4 [1,0,0,1,0,0|2,0,0]=4 2562 B7R1.6 CCNC1COC1 1P00AB09 [1,0,0,1,0,0|2,0,0]=4 2563 B7R1.6 CNCC1CCC1 1P009Z7Q [1,0,0,1,0,0|2,0,0]=4 2564 B7R1.6 CNCC1CCC1 1P00J3LC [1,0,0,1,0,0|2,0,0]=4 2565 B7R1.6 CNCC1CCN1 1P028WB2 [1,0,0,1,0,0|2,0,0]=4 2566 B7R1.6 CNCC1CCO1 1P01XAB4 [1,0,0,1,0,0|1,1,0]=4 2567 B7R1.6 CNCC1COC1 1P001DB9 [1,0,0,1,0,0|2,0,0]=4 2568 B7R1.6 CNC[C@@H]1CCO1 1P0285XI [1,0,0,1,0,0|1,1,0]=4 2569 B7R1.6 CNC[C@H]1CCO1 1P028S78 [1,0,0,1,0,0|1,1,0]=4 2570 B7R1.6 COCC1CCN1 1P000Z8C [1,0,0,1,0,0|2,0,0]=4 2571 B7R1.6 COCC1CCN1 1P01AMGU [1,0,0,1,0,0|2,0,0]=4 2572 B7R1.6 COC[C@@H]1CCN1 1P00II4T [1,0,0,1,0,0|2,0,0]=4 2573 B7R1.6 COC[C@H]1CCN1 1P00II4W [1,0,0,1,0,0|2,0,0]=4 2574 B7R1.6 ICCC1CCC1 1P028IQG [1,0,0,1,0,0|2,0,0]=4 2575 B7R1.6 ICCC1CCO1 1P01JUQV [1,0,0,1,0,0|1,1,0]=4 2576 B7R1.6 ICCC1COC1 1P01DZDP [1,0,0,1,0,0|2,0,0]=4 2577 B7R1.6 NCCC1CCC1 1P00EA85 [1,0,0,1,0,0|2,0,0]=4 2578 B7R1.6 NCCC1CCC1 1P00J2Q0 [1,0,0,1,0,0|2,0,0]=4 2579 B7R1.6 NCCC1CCO1 1P00ILQY [1,0,0,1,0,0|1,1,0]=4 2580 B7R1.6 NCCC1COC1 1P000O0R [1,0,0,1,0,0|2,0,0]=4 2581 B7R1.6 NCC[C@@H]1CCO1 1P01JUR4 [1,0,0,1,0,0|1,1,0]=4 2582 B7R1.6 OCCC1CCC1 1P003AJ0 [1,0,0,1,0,0|1,0,0]=3 2583 B7R1.6 OCCC1CCO1 1P00ILI6 [1,0,0,1,0,0|0,1,0]=3 2584 B7R1.6 OCCC1CNC1 1P00G8QI [1,0,0,1,0,0|2,0,0]=4 2585 B7R1.6 OCCC1CNC1 1P00HYIO [1,0,0,1,0,0|2,0,0]=4 2586 B7R1.6 OCCC1COC1 1P002RA8 [1,0,0,1,0,0|2,0,0]=4 2587 B7R1.6 OCCC1CSC1 1P01BG4T [1,0,0,1,0,0|2,0,0]=4 2588 B7R1.6 OCCN1CCC1 1P00630G [1,0,0,1,0,0|2,0,0]=4 2589 B7R1.6 OCC[C@@H]1CCO1 1P01JUSQ [1,0,0,1,0,0|0,1,0]=3 2590 B7R1.6 SCCC1CCC1 1P0291DM [1,0,0,1,0,0|1,1,0]=4 2591 B7R1.8 CC1CCC1CN 1P028C00 [1,0,0,1,0,0|2,0,0]=4 2592 B7R1.8 CC1CNC1CO 1P027WZ6 [1,0,0,1,0,0|2,0,0]=4 2593 B7R1.8 CCC1CCC1=O 1P008TOV [1,0,0,1,0,0|0,1,1]=4 2594 B7R1.8 CN1CCC1CO 1P01BUP0 [1,0,0,1,0,0|2,0,0]=4 2595 B7R1.8 CN1CC[C@@H]1CO 1P01KA98 [1,0,0,1,0,0|2,0,0]=4 2596 B7R1.8 CN1CC[C@H]1CO 1P000VWA [1,0,0,1,0,0|2,0,0]=4 2597 B7R1.8 CNC1CCC1C 1P027VP9 [1,0,0,1,0,0|2,0,0]=4 2598 B7R1.8 CN[C@@H]1CC[C@H]1O 1P024O8G [1,0,0,1,0,0|1,1,0]=4 2599 B7R1.8 CO[C@@H]1CC[C@H]1Br 1P028K6J [1,0,0,1,0,0|2,0,0]=4 2600 B7R1.8 CO[C@@H]1CC[C@H]1O 1P0290K0 [1,0,0,1,0,0|1,1,0]=4 2601 B7R1.8 CO[C@H]1CC[C@@H]1N 1P01KAEY [1,0,0,1,0,0|2,0,0]=4 2602 B7R1.8 CO[C@H]1CC[C@H]1N 1P01KAG0 [1,0,0,1,0,0|2,0,0]=4 2603 B7R1.8 CSC1CCC1N 1P028EVO [1,0,0,1,0,0|2,0,0]=4 2604 B7R1.8 CSC1CCC1O 1P0285L2 [1,0,0,1,0,0|1,1,0]=4 2605 B7R1.8 C[C@@H]1CC[C@@H]1CBr 1P028YW2 [1,0,0,1,0,0|2,0,0]=4 2606 B7R1.8 C[C@@H]1CC[C@@H]1CO 1P029257 [1,0,0,1,0,0|1,0,0]=3 2607 B7R1.8 C[C@@H]1CC[C@H]1CN 1P027XY8 [1,0,0,1,0,0|2,0,0]=4 2608 B7R1.8 NCC1CCC1F 1P01FMQX [1,0,0,1,0,0|2,0,0]=4 2609 B7R1.8 NC[C@@H]1CC[C@@H]1O 1P028HUW [1,0,0,1,0,0|1,1,0]=4 2610 B7R1.8 NC[C@@H]1CC[C@H]1O 1P028W6T [1,0,0,1,0,0|1,1,0]=4 2611 B7R1.8 NC[C@H]1CC[C@@H]1O 1P027WNT [1,0,0,1,0,0|1,1,0]=4 2612 B7R1.8 NC[C@H]1CC[C@H]1O 1P027WVA [1,0,0,1,0,0|1,1,0]=4 2613 B7R1.8 N[C@@H]1CC[C@@H]1CO 1P028PD3 [1,0,0,1,0,0|1,0,0]=3 2614 B7R1.8 N[C@@H]1CC[C@H]1CF 1P0209PB [1,0,0,1,0,0|2,0,0]=4 2615 B7R1.8 N[C@@H]1CC[C@H]1CO 1P028FJ7 [1,0,0,1,0,0|1,0,0]=3 2616 B7R1.8 OCC1CCC1=O 1P00I4ZH [1,0,0,1,0,0|0,1,1]=4 2617 B7R1.8 OCC1CCC1F 1P01DXWO [1,0,0,1,0,0|1,0,0]=3 2618 B7R1.8 OC[C@@H]1CC[C@H]1O 1P027UXG [1,0,0,1,0,0|0,1,0]=3 2619 B7R1.8 OC[C@@H]1NC[C@H]1O 1P028XO4 [1,0,0,1,0,0|1,1,0]=4 2620 B7R1.8 O[C@@H]1CC[C@@H]1CS 1P0284U2 [1,0,0,1,0,0|0,2,0]=4 2621 B7R1.8 O[C@@H]1CC[C@H]1CS 1P0284O0 [1,0,0,1,0,0|0,2,0]=4 2622 B7R1.9 CCC1OC1CBr 1P028HVD [1,0,0,1,0,0|1,1,0]=4 2623 B7R1.9 CC[C@@H]1C[C@@H]1CO 1P028W6W [1,0,0,1,0,0|1,0,0]=3 2624 B7R1.9 CC[C@@H]1C[C@H]1CBr 1P01BJQT [1,0,0,1,0,0|2,0,0]=4 2625 B7R1.9 CC[C@@H]1C[C@H]1CN 1P01C1KB [1,0,0,1,0,0|2,0,0]=4 2626 B7R1.9 CC[C@@H]1C[C@H]1CO 1P00D3SV [1,0,0,1,0,0|1,0,0]=3 2627 B7R1.9 NCC1CC1CO 1P00ACAI [1,0,0,1,0,0|2,0,0]=4 2628 B7R1.9 NC[C@@H]1C[C@H]1CO 1P001ZH3 [1,0,0,1,0,0|2,0,0]=4 2629 B7R1.9 NC[C@H]1C[C@H]1CO 1P0007FA [1,0,0,1,0,0|2,0,0]=4 2630 B7R1.9 OC[C@@H]1C[C@@H]1CF 1P028T7M [1,0,0,1,0,0|2,0,0]=4 2631 B7R1.9 OC[C@@H]1C[C@@H]1CO 1P002NRN [1,0,0,1,0,0|2,0,0]=4 2632 B7R1.9 OC[C@@H]1C[C@H]1CO 1P028DQN [1,0,0,1,0,0|2,0,0]=4 2633 B7R1.10 BrCC1CC(C1)C 1P01BK18 [1,0,0,1,0,0|2,0,0]=4 2634 B7R1.10 BrCC1CC(C1)O 1P01C40X [1,0,0,1,0,0|2,0,0]=4 2635 B7R1.10 BrC[C@@H]1C[C@H](C1)O 1P0203BD [1,0,0,1,0,0|2,0,0]=4 2636 B7R1.10 CC1CC(N1)CO 1P028MYQ [1,0,0,1,0,0|1,0,0]=3 2637 B7R1.10 CCC1CC(C1)Br 1P028W3S [1,0,0,1,0,0|2,0,0]=4 2638 B7R1.10 CCC1CC(C1)N 1P0209AG [1,0,0,1,0,0|2,0,0]=4 2639 B7R1.10 CCC1CC(C1)N 1P028V3O [1,0,0,1,0,0|2,0,0]=4 2640 B7R1.10 CCC1CC(C1)O 1P02830K [1,0,0,1,0,0|1,0,0]=3 2641 B7R1.10 CCN1CC(C1)O 1P003ERD [1,0,0,1,0,0|2,0,0]=4 2642 B7R1.10 CCN1CC(C1)O 1P00CLDW [1,0,0,1,0,0|2,0,0]=4 2643 B7R1.10 CNC1CC(C1)C 1P00HXML [1,0,0,1,0,0|2,0,0]=4 2644 B7R1.10 CNC1CC(C1)O 1P00AB8V [1,0,0,1,0,0|2,0,0]=4 2645 B7R1.10 CNC1CC(C1)O 1P019TYJ [1,0,0,1,0,0|2,0,0]=4 2646 B7R1.10 CN[C@@H]1C[C@@H](C1)O 1P001DAF [1,0,0,1,0,0|2,0,0]=4 2647 B7R1.10 CN[C@@H]1C[C@H](C1)O 1P001DB7 [1,0,0,1,0,0|2,0,0]=4 2648 B7R1.10 CN[C@@H]1C[C@H](C1)O 1P019GR3 [1,0,0,1,0,0|2,0,0]=4 2649 B7R1.10 COC1CC(C1)O 1P01A5EH [1,0,0,1,0,0|2,0,0]=4 2650 B7R1.10 CO[C@@H]1C[C@@H](C1)O 1P01BCAS [1,0,0,1,0,0|2,0,0]=4 2651 B7R1.10 CO[C@@H]1C[C@H](C1)O 1P01BXZ5 [1,0,0,1,0,0|2,0,0]=4 2652 B7R1.10 CSC1CC(C1)O 1P01AVEC [1,0,0,1,0,0|2,0,0]=4 2653 B7R1.10 CS[C@@H]1C[C@@H](C1)O 1P01BRI3 [1,0,0,1,0,0|2,0,0]=4 2654 B7R1.10 CS[C@@H]1C[C@H](C1)O 1P0281VN [1,0,0,1,0,0|2,0,0]=4 2655 B7R1.10 FCC1CC(C1)O 1P020479 [1,0,0,1,0,0|2,0,0]=4 2656 B7R1.10 FC[C@@H]1C[C@@H](C1)O 1P01JUID [1,0,0,1,0,0|2,0,0]=4 2657 B7R1.10 NCC1CC(C1)C 1P00HXLL [1,0,0,1,0,0|2,0,0]=4 2658 B7R1.10 NCC1CC(C1)O 1P001XKC [1,0,0,1,0,0|2,0,0]=4 2659 B7R1.10 NCC1CC(C1)O 1P009WZY [1,0,0,1,0,0|2,0,0]=4 2660 B7R1.10 NC[C@@H]1C[C@@H](C1)O 1P001CGT [1,0,0,1,0,0|2,0,0]=4 2661 B7R1.10 NC[C@@H]1C[C@@H](C1)O 1P00H0OB [1,0,0,1,0,0|2,0,0]=4 2662 B7R1.10 NC[C@@H]1C[C@H](C1)O 1P001CVZ [1,0,0,1,0,0|2,0,0]=4 2663 B7R1.10 OCC1CC(C1)Br 1P020M75 [1,0,0,1,0,0|2,0,0]=4 2664 B7R1.10 OCC1CC(C1)C 1P01B7GI [1,0,0,1,0,0|1,0,0]=3 2665 B7R1.10 OCC1CC(C1)Cl 1P001RPD [1,0,0,1,0,0|2,0,0]=4 2666 B7R1.10 OCC1CC(C1)F 1P00HJA6 [1,0,0,1,0,0|2,0,0]=4 2667 B7R1.10 OCC1CC(C1)N 1P000US1 [1,0,0,1,0,0|2,0,0]=4 2668 B7R1.10 OCC1CC(C1)N 1P009DFP [1,0,0,1,0,0|2,0,0]=4 2669 B7R1.10 OCC1CC(C1)O 1P000MRF [1,0,0,1,0,0|2,0,0]=4 2670 B7R1.10 OCC1CN(C1)C 1P001ML1 [1,0,0,1,0,0|2,0,0]=4 2671 B7R1.10 OCC1CN(C1)C 1P01FIC9 [1,0,0,1,0,0|2,0,0]=4 2672 B7R1.10 OC[C@@H]1C[C@@H](C1)N 1P009I21 [1,0,0,1,0,0|2,0,0]=4 2673 B7R1.10 OC[C@@H]1C[C@@H](C1)N 1P009KC1 [1,0,0,1,0,0|2,0,0]=4 2674 B7R1.10 OC[C@@H]1C[C@@H](C1)O 1P007T71 [1,0,0,1,0,0|2,0,0]=4 2675 B7R1.10 OC[C@@H]1C[C@H](C1)F 1P020492 [1,0,0,1,0,0|2,0,0]=4 2676 B7R1.10 OC[C@@H]1C[C@H](C1)N 1P000YJ1 [1,0,0,1,0,0|2,0,0]=4 2677 B7R1.10 OC[C@@H]1C[C@H](C1)N 1P00HHQV [1,0,0,1,0,0|2,0,0]=4 2678 B7R1.10 OC[C@@H]1C[C@H](C1)O 1P024UVD [1,0,0,1,0,0|2,0,0]=4 2679 B7R1.11 BrCC1[C@@H]([C@H]1C)C 1P028WRS [1,0,0,1,0,0|2,0,0]=4 2680 B7R1.11 NCC1[C@@H]([C@H]1C)C 1P028V3E [1,0,0,1,0,0|2,0,0]=4 2681 B7R1.15 CC1C(C)CC1=O 1P00CVG5 [1,0,0,1,0,0|0,1,1]=4 2682 B7R1.15 CC1C(O)CC1O 1P028A9J [1,0,0,1,0,0|0,1,0]=3 2683 B7R1.15 NC1C(O)CC1O 1P028T5Q [1,0,0,1,0,0|1,1,0]=4 2684 B7R1.15 NC1CC(C1C)O 1P029168 [1,0,0,1,0,0|1,0,0]=3 2685 B7R1.15 N[C@@H]1C[C@H]([C@@H]1O)O 1P0293V6 [1,0,0,1,0,0|1,1,0]=4 2686 B7R1.15 N[C@@H]1[C@@H](O)C[C@H]1O 1P027XXU [1,0,0,1,0,0|1,1,0]=4 2687 B7R1.21 BrCCC1(C)CC1 1P01CAV6 [1,0,0,1,0,0|2,0,0]=4 2688 B7R1.21 BrCCC1(N)CC1 1P028BA9 [1,0,0,1,0,0|2,0,0]=4 2689 B7R1.21 BrCCC1(O)CC1 1P000YG6 [1,0,0,1,0,0|1,1,0]=4 2690 B7R1.21 CC1(CCO)CO1 1P01IP7I [1,0,0,1,0,0|2,0,0]=4 2691 B7R1.21 CCCC1(N)CC1 1P00J22U [1,0,0,1,0,0|1,0,0]=3 2692 B7R1.21 CCOC1(Br)CC1 1P01BCHC [1,0,0,1,0,0|2,0,0]=4 2693 B7R1.21 CCOC1(O)CC1 1P001949 [1,0,0,1,0,0|1,1,0]=4 2694 B7R1.21 CNCC1(C)CC1 1P028DHD [1,0,0,1,0,0|2,0,0]=4 2695 B7R1.21 CNCC1(F)CC1 1P028GRJ [1,0,0,1,0,0|2,0,0]=4 2696 B7R1.21 CNCC1(N)CC1 1P0282ZZ [1,0,0,1,0,0|2,0,0]=4 2697 B7R1.21 CNCC1(O)CC1 1P01DW6C [1,0,0,1,0,0|1,1,0]=4 2698 B7R1.21 COCC1(N)CC1 1P00172B [1,0,0,1,0,0|2,0,0]=4 2699 B7R1.21 CSCC1(N)CC1 1P028BE9 [1,0,0,1,0,0|2,0,0]=4 2700 B7R1.21 FCCC1(N)CC1 1P0286W4 [1,0,0,1,0,0|2,0,0]=4 2701 B7R1.21 ICCC1(C)CC1 1P028H6R [1,0,0,1,0,0|2,0,0]=4 2702 B7R1.21 ICCC1(O)CC1 1P028IXF [1,0,0,1,0,0|1,1,0]=4 2703 B7R1.21 NCCC1(C)CC1 1P01BFVL [1,0,0,1,0,0|2,0,0]=4 2704 B7R1.21 NCCC1(N)CC1 1P01BC2F [1,0,0,1,0,0|2,0,0]=4 2705 B7R1.21 NCCC1(O)CC1 1P028UPQ [1,0,0,1,0,0|1,1,0]=4 2706 B7R1.21 OCCC1(C)CC1 1P00I41V [1,0,0,1,0,0|1,0,0]=3 2707 B7R1.21 OCCC1(N)CC1 1P01A3TD [1,0,0,1,0,0|1,0,0]=3 2708 B7R1.21 OCCC1(O)CC1 1P00A7R8 [1,0,0,1,0,0|0,1,0]=3 2709 B7R1.21 SCCC1(C)CC1 1P028ZT6 [1,0,0,1,0,0|1,1,0]=4 2710 B7R1.21 SCCC1(O)CC1 1P0285GQ [1,0,0,1,0,0|0,2,0]=4 2711 B7R1.22 BrCC(C1CC1)C 1P01BL3U [1,0,0,1,0,0|2,0,0]=4 2712 B7R1.22 BrCC(C1CC1)F 1P0293BN [1,0,0,1,0,0|2,0,0]=4 2713 B7R1.22 CCC(=O)C1CC1 1P00FHR5 [1,0,0,1,0,0|0,1,1]=4 2714 B7R1.22 CCC(C1CC1)N 1P003AXN [1,0,0,1,0,0|1,0,0]=3 2715 B7R1.22 CCC(C1CC1)N 1P00CGM3 [1,0,0,1,0,0|1,0,0]=3 2716 B7R1.22 CCC(C1CC1)O 1P00ARKQ [1,0,0,1,0,0|0,1,0]=3 2717 B7R1.22 CC[C@@H](C1CC1)O 1P0291PR [1,0,0,1,0,0|0,1,0]=3 2718 B7R1.22 CC[C@H](C1CC1)N 1P021VMF [1,0,0,1,0,0|1,0,0]=3 2719 B7R1.22 CNC(C1CC1)C 1P019L5Y [1,0,0,1,0,0|2,0,0]=4 2720 B7R1.22 NCC(C1CC1)C 1P019XR0 [1,0,0,1,0,0|2,0,0]=4 2721 B7R1.22 NCC(C1CC1)N 1P01A95K [1,0,0,1,0,0|2,0,0]=4 2722 B7R1.22 NCC(C1CC1)O 1P017KWA [1,0,0,1,0,0|1,1,0]=4 2723 B7R1.22 NCC(C1CC1)O 1P01X6BJ [1,0,0,1,0,0|1,1,0]=4 2724 B7R1.22 OCC(=O)C1CC1 1P019ZQ5 [1,0,0,1,0,0|0,1,1]=4 2725 B7R1.22 OCC(C1CC1)C 1P01BGG8 [1,0,0,1,0,0|1,0,0]=3 2726 B7R1.22 OCC(C1CC1)N 1P000V7S [1,0,0,1,0,0|1,0,0]=3 2727 B7R1.22 OCC(C1CC1)O 1P01BV42 [1,0,0,1,0,0|0,1,0]=3 2728 B7R1.22 OC[C@@H](C1CC1)N 1P01KIV6 [1,0,0,1,0,0|1,0,0]=3 2729 B7R1.22 OC[C@H](C1CC1)N 1P000Q6D [1,0,0,1,0,0|1,0,0]=3 2730 B7R1.22 OC[C@H](C1CC1)N 1P00AT14 [1,0,0,1,0,0|1,0,0]=3 2731 B7R1.25 BrCC1(C)CCC1 1P01B8HZ [1,0,0,1,0,0|2,0,0]=4 2732 B7R1.25 BrCC1(F)CCC1 1P01KA3B [1,0,0,1,0,0|2,0,0]=4 2733 B7R1.25 BrCC1(O)CCC1 1P01C31W [1,0,0,1,0,0|1,1,0]=4 2734 B7R1.25 CC1(CBr)CCO1 1P027CBV [1,0,0,1,0,0|2,0,0]=4 2735 B7R1.25 CC1(CC)CCN1 1P0281X1 [1,0,0,1,0,0|2,0,0]=4 2736 B7R1.25 CC1(CN)CCO1 1P00PQ6R [1,0,0,1,0,0|2,0,0]=4 2737 B7R1.25 CC1(CO)CCN1 1P00HSYL [1,0,0,1,0,0|2,0,0]=4 2738 B7R1.25 CC1(CO)CCO1 1P0037VL [1,0,0,1,0,0|2,0,0]=4 2739 B7R1.25 CCC1(C)CNC1 1P01ALIC [1,0,0,1,0,0|2,0,0]=4 2740 B7R1.25 CCC1(F)CNC1 1P01EJHG [1,0,0,1,0,0|2,0,0]=4 2741 B7R1.25 CCC1(N)CCC1 1P019U6Z [1,0,0,1,0,0|1,0,0]=3 2742 B7R1.25 CCC1(N)CNC1 1P00IEMG [1,0,0,1,0,0|2,0,0]=4 2743 B7R1.25 CCC1(N)COC1 1P0014LB [1,0,0,1,0,0|2,0,0]=4 2744 B7R1.25 CCC1(N)COC1 1P00HV1U [1,0,0,1,0,0|2,0,0]=4 2745 B7R1.25 CCC1(O)CNC1 1P00II4S [1,0,0,1,0,0|1,1,0]=4 2746 B7R1.25 CCC1(O)COC1 1P00HWLL [1,0,0,1,0,0|1,1,0]=4 2747 B7R1.25 CNC1(C)CCC1 1P0288NT [1,0,0,1,0,0|2,0,0]=4 2748 B7R1.25 C[C@@]1(CO)CCO1 1P0203OP [1,0,0,1,0,0|2,0,0]=4 2749 B7R1.25 C[C@]1(CN)CCO1 1P01JUI2 [1,0,0,1,0,0|2,0,0]=4 2750 B7R1.25 C[C@]1(CO)CCO1 1P020AZ6 [1,0,0,1,0,0|2,0,0]=4 2751 B7R1.25 ClCC1(N)CCC1 1P028BKO [1,0,0,1,0,0|2,0,0]=4 2752 B7R1.25 FCC1(N)CCC1 1P01C2XW [1,0,0,1,0,0|2,0,0]=4 2753 B7R1.25 ICC1(F)CCC1 1P028IR6 [1,0,0,1,0,0|2,0,0]=4 2754 B7R1.25 ICC1(O)CCC1 1P028HW9 [1,0,0,1,0,0|1,1,0]=4 2755 B7R1.25 NCC1(Br)CCC1 1P028JAW [1,0,0,1,0,0|2,0,0]=4 2756 B7R1.25 NCC1(C)CCC1 1P000MSK [1,0,0,1,0,0|2,0,0]=4 2757 B7R1.25 NCC1(C)CCC1 1P00GVAI [1,0,0,1,0,0|2,0,0]=4 2758 B7R1.25 NCC1(Cl)CCC1 1P028E3T [1,0,0,1,0,0|2,0,0]=4 2759 B7R1.25 NCC1(F)CCC1 1P00HXY5 [1,0,0,1,0,0|2,0,0]=4 2760 B7R1.25 NCC1(N)CCC1 1P01BA7G [1,0,0,1,0,0|2,0,0]=4 2761 B7R1.25 NCC1(O)CCC1 1P00229A [1,0,0,1,0,0|1,1,0]=4 2762 B7R1.25 OCC1(Br)CCC1 1P028KH0 [1,0,0,1,0,0|1,0,0]=3 2763 B7R1.25 OCC1(C)CCC1 1P00I83X [1,0,0,1,0,0|1,0,0]=3 2764 B7R1.25 OCC1(C)CNC1 1P001DXN [1,0,0,1,0,0|2,0,0]=4 2765 B7R1.25 OCC1(C)CNC1 1P00J3CD [1,0,0,1,0,0|2,0,0]=4 2766 B7R1.25 OCC1(C)COC1 1P003K18 [1,0,0,1,0,0|2,0,0]=4 2767 B7R1.25 OCC1(C)CSC1 1P00F1GP [1,0,0,1,0,0|2,0,0]=4 2768 B7R1.25 OCC1(F)CCC1 1P00HSH9 [1,0,0,1,0,0|1,0,0]=3 2769 B7R1.25 OCC1(F)CNC1 1P000TT7 [1,0,0,1,0,0|2,0,0]=4 2770 B7R1.25 OCC1(F)CNC1 1P00I0IE [1,0,0,1,0,0|2,0,0]=4 2771 B7R1.25 OCC1(F)COC1 1P00GVAL [1,0,0,1,0,0|2,0,0]=4 2772 B7R1.25 OCC1(N)CCC1 1P001AZ7 [1,0,0,1,0,0|1,0,0]=3 2773 B7R1.25 OCC1(N)CCC1 1P002298 [1,0,0,1,0,0|1,0,0]=3 2774 B7R1.25 OCC1(N)CNC1 1P028BCJ [1,0,0,1,0,0|2,0,0]=4 2775 B7R1.25 OCC1(N)COC1 1P000V0W [1,0,0,1,0,0|2,0,0]=4 2776 B7R1.25 OCC1(N)COC1 1P0289Q0 [1,0,0,1,0,0|2,0,0]=4 2777 B7R1.25 OCC1(O)CCC1 1P005JC6 [1,0,0,1,0,0|0,1,0]=3 2778 B7R1.25 OCC1(O)CNC1 1P00I3J4 [1,0,0,1,0,0|1,1,0]=4 2779 B7R1.25 OCC1(O)CNC1 1P01ANQ0 [1,0,0,1,0,0|1,1,0]=4 2780 B7R1.25 OCC1(O)COC1 1P001WQR [1,0,0,1,0,0|1,1,0]=4 2781 B7R1.25 SCC1(C)CCC1 1P0291OD [1,0,0,1,0,0|1,1,0]=4 2782 B7R1.25 SCC1(O)CCC1 1P0280PH [1,0,0,1,0,0|0,2,0]=4 2783 B7R1.27 CC1(CC)CC1N 1P01EIGI [1,0,0,1,0,0|2,0,0]=4 2784 B7R1.27 CC1(CO)CC1Br 1P00CSWU [1,0,0,1,0,0|2,0,0]=4 2785 B7R1.27 CC1(CO)CC1F 1P01C4KB [1,0,0,1,0,0|2,0,0]=4 2786 B7R1.27 C[C@@H]1C[C@@]1(F)CBr 1P028H14 [1,0,0,1,0,0|2,0,0]=4 2787 B7R1.27 C[C@@H]1C[C@@]1(F)CO 1P028UJ9 [1,0,0,1,0,0|1,0,0]=3 2788 B7R1.7 BrCCCC1CC1 1P01BTWI [1,0,0,1,0,0|1,0,0]=3 2789 B7R1.7 BrCCCC1CO1 1P01BD0F [1,0,0,1,0,0|1,0,0]=3 2790 B7R1.7 BrCCOC1CC1 1P01B71N [1,0,0,1,0,0|2,0,0]=4 2791 B7R1.7 C#CCCC1CC1 1P028XEA [1,0,0,1,0,0|1,0,1]=4 2792 B7R1.7 C=CCCC1CO1 1P003DVN [1,0,0,1,0,0|0,0,2]=4 2793 B7R1.7 C=CCC[C@@H]1CO1 1P00147E [1,0,0,1,0,0|0,0,2]=4 2794 B7R1.7 C=CCC[C@H]1CO1 1P00147D [1,0,0,1,0,0|0,0,2]=4 2795 B7R1.7 CCCCC1CO1 1P003DVT [1,0,0,1,0,0|0,0,0]=2 2796 B7R1.7 CCCNC1CC1 1P0064A7 [1,0,0,1,0,0|2,0,0]=4 2797 B7R1.7 CCCNC1CC1 1P019TR3 [1,0,0,1,0,0|2,0,0]=4 2798 B7R1.7 CCNCC1CC1 1P002TGR [1,0,0,1,0,0|2,0,0]=4 2799 B7R1.7 CCNCC1CC1 1P01ACSE [1,0,0,1,0,0|2,0,0]=4 2800 B7R1.7 CCOCC1CO1 1P003QVT [1,0,0,1,0,0|1,0,0]=3 2801 B7R1.7 CNCCC1CC1 1P001ILJ [1,0,0,1,0,0|2,0,0]=4 2802 B7R1.7 CNCCC1CC1 1P001SUG [1,0,0,1,0,0|2,0,0]=4 2803 B7R1.7 COCCC1CO1 1P01BDY7 [1,0,0,1,0,0|1,0,0]=3 2804 B7R1.7 ClCCNC1CC1 1P01C65P [1,0,0,1,0,0|2,0,0]=4 2805 B7R1.7 ClCCOC1CC1 1P0025L5 [1,0,0,1,0,0|2,0,0]=4 2806 B7R1.7 ClCOCC1CC1 1P0084ME [1,0,0,1,0,0|2,0,0]=4 2807 B7R1.7 FCCNC1CC1 1P028FE3 [1,0,0,1,0,0|2,0,0]=4 2808 B7R1.7 ICCCC1CC1 1P028D2B [1,0,0,1,0,0|1,0,0]=3 2809 B7R1.7 ICCCC1CO1 1P028IE9 [1,0,0,1,0,0|1,0,0]=3 2810 B7R1.7 N#CCCC1CC1 1P01A3MC [1,0,0,1,0,0|1,0,1]=4 2811 B7R1.7 NCCCC1CC1 1P00ELHZ [1,0,0,1,0,0|1,0,0]=3 2812 B7R1.7 NCCCC1CC1 1P01AK1R [1,0,0,1,0,0|1,0,0]=3 2813 B7R1.7 NCCNC1CC1 1P00ELA0 [1,0,0,1,0,0|2,0,0]=4 2814 B7R1.7 NNCCC1CC1 1P0293CU [1,0,0,1,0,0|2,0,0]=4 2815 B7R1.7 O=CCCC1CC1 1P00DKQ3 [1,0,0,1,0,0|0,0,2]=4 2816 B7R1.7 OCC#CC1CC1 1P0006L8 [1,0,0,1,0,0|0,0,2]=4 2817 B7R1.7 OCCCC1CC1 1P00DIF9 [1,0,0,1,0,0|0,0,0]=2 2818 B7R1.7 OCCNC1CC1 1P00CMB1 [1,0,0,1,0,0|1,0,0]=3 2819 B7R1.7 OCCOC1CC1 1P002DPU [1,0,0,1,0,0|1,0,0]=3 2820 B7R1.7 OC\C=C/C1CC1 1P0287QQ [1,0,0,1,0,0|0,0,2]=4 2821 B7R1.7 OC\C=C\C1CC1 1P001RIK [1,0,0,1,0,0|0,0,2]=4 2822 B7R1.7 ON=CCC1CC1 1P01EK78 [1,0,0,1,0,0|1,0,1]=4 2823 B7R1.7 SCCCC1CC1 1P029189 [1,0,0,1,0,0|0,1,0]=3 2824 B7R1.7 SCCOC1CC1 1P028VKB [1,0,0,1,0,0|1,1,0]=4 2825 B7R1.7 [C-]#[N+]CCC1CC1 1P028U1A [1,0,0,1,0,0|2,0,0]=4 2826 B7R1.24 C1CCC=CCC1 1P003PL0 [1,0,0,1,0,0|1,0,1]=4 2827 B7R1.24 C1CCCCOC1 1P003RDE [1,0,0,1,0,0|0,0,0]=2 2828 B7R1.24 C1CCCNOC1 1P01BD7K [1,0,0,1,0,0|1,0,0]=3 2829 B7R1.24 C1CNCCNC1 1P0035GQ [1,0,0,1,0,0|2,0,0]=4 2830 B7R1.24 C1CNCCOC1 1P0026DQ [1,0,0,1,0,0|1,0,0]=3 2831 B7R1.24 C1CNCCOC1 1P00ED3S [1,0,0,1,0,0|1,0,0]=3 2832 B7R1.24 C1CNCCSC1 1P0004CX [1,0,0,1,0,0|1,1,0]=4 2833 B7R1.24 C1CNNCCO1 1P00D7ZN [1,0,0,1,0,0|2,0,0]=4 2834 B7R1.24 C1CNNCCO1 1P01C4NW [1,0,0,1,0,0|2,0,0]=4 2835 B7R1.24 C1COCCON1 1P01EKI2 [1,0,0,1,0,0|2,0,0]=4 2836 B9R1.2 BrCC1CCCC(C1)C 1P01A4RF [0,1,0,1,0,0|2,0,0]=4 2837 B9R1.2 BrCC1CCCC(C1)F 1P01DWB6 [0,1,0,1,0,0|2,0,0]=4 2838 B9R1.2 BrCC1CCCC(C1)O 1P028LQF [0,1,0,1,0,0|1,0,0]=3 2839 B9R1.2 BrCC1CCOC(C1)C 1P01BFA3 [0,1,0,1,0,0|1,0,0]=3 2840 B9R1.2 C#CC1CCCC(C1)C 1P01BG80 [0,1,0,1,0,0|2,0,0]=4 2841 B9R1.2 C#CC1CCCC(C1)O 1P01BVBY [0,1,0,1,0,0|1,0,0]=3 2842 B9R1.2 C#C[C@H]1CCC[C@@H](C1)N 1P02802F [0,1,0,1,0,0|2,0,0]=4 2843 B9R1.2 C#C[C@H]1CCC[C@H](C1)N 1P028HMK [0,1,0,1,0,0|2,0,0]=4 2844 B9R1.2 CC1CC(CO)CNC1 1P01C4AW [0,1,0,1,0,0|2,0,0]=4 2845 B9R1.2 CC1CNCC(O1)CO 1P01AGPG [0,1,0,1,0,0|2,0,0]=4 2846 B9R1.2 CC1COCC(O1)CO 1P0282GJ [0,1,0,1,0,0|2,0,0]=4 2847 B9R1.2 CCC1CC(=O)CCO1 1P00D327 [0,1,0,1,0,0|0,1,1]=4 2848 B9R1.2 CCC1CC(N)CCO1 1P01AIO5 [0,1,0,1,0,0|1,0,0]=3 2849 B9R1.2 CCC1CC(O)CCO1 1P01A5QF [0,1,0,1,0,0|0,1,0]=3 2850 B9R1.2 CCC1CCCC(C1)N 1P01AJES [0,1,0,1,0,0|2,0,0]=4 2851 B9R1.2 CCC1CCCC(C1)O 1P00DJHN [0,1,0,1,0,0|1,0,0]=3 2852 B9R1.2 CCN1CCCC(C1)N 1P00FBJ5 [0,1,0,1,0,0|2,0,0]=4 2853 B9R1.2 CCN1CCCC(C1)O 1P003ES3 [0,1,0,1,0,0|1,1,0]=4 2854 B9R1.2 CCN1CCC[C@@H](C1)N 1P01BJPY [0,1,0,1,0,0|2,0,0]=4 2855 B9R1.2 CCN1CCC[C@@H](C1)N 1P01EIJU [0,1,0,1,0,0|2,0,0]=4 2856 B9R1.2 CCN1CCC[C@H](C1)N 1P01BVHL [0,1,0,1,0,0|2,0,0]=4 2857 B9R1.2 CCN1CCC[C@H](C1)N 1P01BVHM [0,1,0,1,0,0|2,0,0]=4 2858 B9R1.2 CC[C@@H]1CCC[C@@H](N1)C 1P01B7FZ [0,1,0,1,0,0|2,0,0]=4 2859 B9R1.2 CC[C@@H]1C[C@H](N)CCO1 1P028KR8 [0,1,0,1,0,0|1,0,0]=3 2860 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 1P01EI5S [0,1,0,1,0,0|1,1,0]=4 2861 B9R1.2 CN1CC(CBr)OCC1 1P01FIOH [0,1,0,1,0,0|2,0,0]=4 2862 B9R1.2 CN1CC(CCl)OCC1 1P01A9L1 [0,1,0,1,0,0|2,0,0]=4 2863 B9R1.2 CN1CC(CN)OCC1 1P001HPM [0,1,0,1,0,0|2,0,0]=4 2864 B9R1.2 CN1CC(CN)OCC1 1P00J2D4 [0,1,0,1,0,0|2,0,0]=4 2865 B9R1.2 CN1CC(CO)OCC1 1P003CCZ [0,1,0,1,0,0|2,0,0]=4 2866 B9R1.2 CN1C[C@@H](CN)OCC1 1P00GIA2 [0,1,0,1,0,0|2,0,0]=4 2867 B9R1.2 CN1C[C@@H](CO)OCC1 1P000HOB [0,1,0,1,0,0|2,0,0]=4 2868 B9R1.2 CN1C[C@H](CN)OCC1 1P00G7KU [0,1,0,1,0,0|2,0,0]=4 2869 B9R1.2 CN1C[C@H](CO)OCC1 1P000HOA [0,1,0,1,0,0|2,0,0]=4 2870 B9R1.2 CNC1CCCC(C1)C 1P00G7QY [0,1,0,1,0,0|2,0,0]=4 2871 B9R1.2 CNC1CCCC(C1)C 1P019MEA [0,1,0,1,0,0|2,0,0]=4 2872 B9R1.2 CNC1CCCC(C1)O 1P02864R [0,1,0,1,0,0|1,0,0]=3 2873 B9R1.2 CNC1CCOC(C1)C 1P028E14 [0,1,0,1,0,0|1,0,0]=3 2874 B9R1.2 COC1CC(O)CNC1 1P028LPJ [0,1,0,1,0,0|1,1,0]=4 2875 B9R1.2 COC1CCCC(=O)C1 1P0079W8 [0,1,0,1,0,0|0,1,1]=4 2876 B9R1.2 COC1CCCC(C1)Br 1P01C2FB [0,1,0,1,0,0|1,0,0]=3 2877 B9R1.2 COC1CCCC(C1)C 1P019PMB [0,1,0,1,0,0|1,0,0]=3 2878 B9R1.2 COC1CCCC(C1)I 1P01AD2H [0,1,0,1,0,0|1,0,0]=3 2879 B9R1.2 COC1CCCC(C1)N 1P00DK8W [0,1,0,1,0,0|1,0,0]=3 2880 B9R1.2 COC1CCCC(C1)O 1P00ILX5 [0,1,0,1,0,0|0,1,0]=3 2881 B9R1.2 COC1CCCN(C1)N 1P004C00 [0,1,0,1,0,0|2,0,0]=4 2882 B9R1.2 COC1CCNC(C1)C 1P00AO4A [0,1,0,1,0,0|1,1,0]=4 2883 B9R1.2 COC1CNCC(C1)C 1P028IK5 [0,1,0,1,0,0|2,0,0]=4 2884 B9R1.2 CO[C@@H]1CCC[C@@H](C1)N 1P01DN63 [0,1,0,1,0,0|1,0,0]=3 2885 B9R1.2 CO[C@@H]1CCC[C@@H](C1)O 1P01DY4H [0,1,0,1,0,0|0,1,0]=3 2886 B9R1.2 CO[C@@H]1CCC[C@H](C1)N 1P01XAE9 [0,1,0,1,0,0|1,0,0]=3 2887 B9R1.2 CO[C@@H]1CCN[C@@H](C1)C 1P009ZDO [0,1,0,1,0,0|1,1,0]=4 2888 B9R1.2 CO[C@@H]1CCN[C@H](C1)C 1P009ZDN [0,1,0,1,0,0|1,1,0]=4 2889 B9R1.2 CO[C@@H]1C[C@@H](F)CNC1 1P028TDN [0,1,0,1,0,0|2,0,0]=4 2890 B9R1.2 CO[C@@H]1C[C@@H](O)CNC1 1P0286TG [0,1,0,1,0,0|1,1,0]=4 2891 B9R1.2 CO[C@@H]1C[C@H](O)CNC1 1P024SKV [0,1,0,1,0,0|1,1,0]=4 2892 B9R1.2 CO[C@H]1CCC[C@H](C1)N 1P009334 [0,1,0,1,0,0|1,0,0]=3 2893 B9R1.2 CO[C@H]1CCN[C@@H](C1)C 1P01K514 [0,1,0,1,0,0|1,1,0]=4 2894 B9R1.2 CO[C@H]1C[C@@H](F)CNC1 1P02828O [0,1,0,1,0,0|2,0,0]=4 2895 B9R1.2 CO[C@H]1C[C@@H](O)CNC1 1P0283WS [0,1,0,1,0,0|1,1,0]=4 2896 B9R1.2 CO[C@H]1C[C@H](O)CNC1 1P024SKU [0,1,0,1,0,0|1,1,0]=4 2897 B9R1.2 CSC1CCCC(=O)C1 1P01BFPY [0,1,0,1,0,0|0,0,2]=4 2898 B9R1.2 CSC1CCCC(C1)N 1P01AJQM [0,1,0,1,0,0|1,0,0]=3 2899 B9R1.2 CSC1CCCC(C1)O 1P01C8KE [0,1,0,1,0,0|0,0,0]=2 2900 B9R1.2 C[C@@H]1CNC[C@@H](O1)CO 1P021NES [0,1,0,1,0,0|2,0,0]=4 2901 B9R1.2 C[C@@H]1CNC[C@H](O1)CO 1P021NEP [0,1,0,1,0,0|2,0,0]=4 2902 B9R1.2 C[C@H]1CNC[C@H](O1)CO 1P021NEU [0,1,0,1,0,0|2,0,0]=4 2903 B9R1.2 ClCC1CCCC(C1)O 1P01ALW3 [0,1,0,1,0,0|1,0,0]=3 2904 B9R1.2 ICC1CCCC(O1)C 1P0292CJ [0,1,0,1,0,0|2,0,0]=4 2905 B9R1.2 N#CC1CCCC(C1)C 1P018SDZ [0,1,0,1,0,0|2,0,0]=4 2906 B9R1.2 N#CC1CCCC(C1)O 1P00BJ35 [0,1,0,1,0,0|1,0,0]=3 2907 B9R1.2 N#CC1CCOC(C1)C 1P004C3D [0,1,0,1,0,0|1,0,0]=3 2908 B9R1.2 N#CC1CCSC(C1)C 1P0286W7 [0,1,0,1,0,0|1,1,0]=4 2909 B9R1.2 N#C[C@@H]1CCC[C@@H](C1)N 1P01DOZN [0,1,0,1,0,0|2,0,0]=4 2910 B9R1.2 NC1CC(CO)OCC1 1P0288QL [0,1,0,1,0,0|1,0,0]=3 2911 B9R1.2 NC1CC(OCC1)C#C 1P028IDK [0,1,0,1,0,0|1,0,1]=4 2912 B9R1.2 NCC1CCCC(C1)C 1P019XKJ [0,1,0,1,0,0|2,0,0]=4 2913 B9R1.2 NCC1CCCC(C1)F 1P01C5BB [0,1,0,1,0,0|2,0,0]=4 2914 B9R1.2 NCC1CCCC(C1)N 1P00IKDA [0,1,0,1,0,0|2,0,0]=4 2915 B9R1.2 NCC1CCCC(C1)O 1P000DEF [0,1,0,1,0,0|1,0,0]=3 2916 B9R1.2 NCC1CCCC(O1)C 1P01B690 [0,1,0,1,0,0|2,0,0]=4 2917 B9R1.2 NCC1CCOC(C1)C 1P01A4O2 [0,1,0,1,0,0|1,0,0]=3 2918 B9R1.2 NCC1CCSC(C1)C 1P028MM9 [0,1,0,1,0,0|1,1,0]=4 2919 B9R1.2 NCC1OCCN(C1)C 1P00CHAT [0,1,0,1,0,0|2,0,0]=4 2920 B9R1.2 NC[C@H]1CCC[C@H](C1)O 1P01K18D [0,1,0,1,0,0|1,0,0]=3 2921 B9R1.2 NC[C@H]1CCC[C@H](N1)C 1P027YHA [0,1,0,1,0,0|2,0,0]=4 2922 B9R1.2 NC[C@H]1CCS[C@@H](C1)C 1P028MAJ [0,1,0,1,0,0|1,1,0]=4 2923 B9R1.2 NNC1CCCC(C1)C 1P0170A6 [0,1,0,1,0,0|2,0,0]=4 2924 B9R1.2 NNC1CCCC(C1)C 1P019Y8L [0,1,0,1,0,0|2,0,0]=4 2925 B9R1.2 NNC1CCOC(C1)C 1P01A5VM [0,1,0,1,0,0|1,0,0]=3 2926 B9R1.2 NN[C@H]1CCO[C@@H](C1)C 1P01C1Z5 [0,1,0,1,0,0|1,0,0]=3 2927 B9R1.2 NO[C@@H]1CCN[C@@H](C1)C 1P01C508 [0,1,0,1,0,0|1,1,0]=4 2928 B9R1.2 O=CC1CCCC(C1)C 1P000VEJ [0,1,0,1,0,0|1,0,1]=4 2929 B9R1.2 O=CC1CCCC(C1)F 1P01BIXF [0,1,0,1,0,0|1,0,1]=4 2930 B9R1.2 O=CC1CCOC(C1)C 1P01A5EP [0,1,0,1,0,0|0,1,0]=3 2931 B9R1.2 O=NN1CCOC(C1)C 1P008PLI [0,1,0,1,0,0|1,1,0]=4 2932 B9R1.2 OCC1CC(=O)CCO1 1P0222X2 [0,1,0,1,0,0|0,1,1]=4 2933 B9R1.2 OCC1CCCC(=O)N1 1P00203X [0,1,0,1,0,0|0,1,1]=4 2934 B9R1.2 OCC1CCCC(C1)C 1P01A55Z [0,1,0,1,0,0|1,0,0]=3 2935 B9R1.2 OCC1CCCC(C1)N 1P00H5QJ [0,1,0,1,0,0|1,0,0]=3 2936 B9R1.2 OCC1CCCC(O1)C 1P0284M8 [0,1,0,1,0,0|1,0,0]=3 2937 B9R1.2 OCC1CCCN(C1)C 1P003EYI [0,1,0,1,0,0|2,0,0]=4 2938 B9R1.2 OCC1CCNC(C1)C 1P019TC2 [0,1,0,1,0,0|1,1,0]=4 2939 B9R1.2 OCC1CCOC(C1)C 1P01A5JQ [0,1,0,1,0,0|0,1,0]=3 2940 B9R1.2 OCC1OCCC(C1)N 1P01KX7D [0,1,0,1,0,0|1,0,0]=3 2941 B9R1.2 OC[C@@H]1CCCC(=O)N1 1P000YT8 [0,1,0,1,0,0|0,1,1]=4 2942 B9R1.2 OC[C@@H]1CCCN(C1)C 1P002AE5 [0,1,0,1,0,0|2,0,0]=4 2943 B9R1.2 OC[C@@H]1CCC[C@@H](C1)N 1P00J3QP [0,1,0,1,0,0|1,0,0]=3 2944 B9R1.2 OC[C@@H]1CCC[C@@H](C1)N 1P00J3W6 [0,1,0,1,0,0|1,0,0]=3 2945 B9R1.2 OC[C@@H]1CCC[C@@H](C1)O 1P01EJ3P [0,1,0,1,0,0|0,1,0]=3 2946 B9R1.2 OC[C@@H]1CCC[C@H](C1)N 1P01KHGU [0,1,0,1,0,0|1,0,0]=3 2947 B9R1.2 OC[C@@H]1NCC[C@@H](C1)O 1P020IRI [0,1,0,1,0,0|1,1,0]=4 2948 B9R1.2 OC[C@H]1CCCC(=O)N1 1P00734T [0,1,0,1,0,0|0,1,1]=4 2949 B9R1.2 OC[C@H]1CCCN(C1)C 1P002AE1 [0,1,0,1,0,0|2,0,0]=4 2950 B9R1.2 OC[C@H]1CCC[C@H](C1)O 1P027UDF [0,1,0,1,0,0|0,1,0]=3 2951 B9R1.2 OC[C@H]1CCC[C@H](N1)C 1P01BSD4 [0,1,0,1,0,0|1,0,0]=3 2952 B9R1.2 OC[C@H]1CCC[C@H](N1)C 1P027US4 [0,1,0,1,0,0|1,0,0]=3 2953 B9R1.2 OC[C@H]1CCC[C@H](O1)C 1P0284KG [0,1,0,1,0,0|1,0,0]=3 2954 B9R1.2 OC[C@H]1CCN[C@H](C1)C 1P01BC7W [0,1,0,1,0,0|1,1,0]=4 2955 B9R1.2 OC[C@H]1CCO[C@@H](C1)C 1P028Q3G [0,1,0,1,0,0|0,1,0]=3 2956 B9R1.2 OC[C@H]1NCC[C@H](C1)O 1P021VKQ [0,1,0,1,0,0|1,1,0]=4 2957 B9R1.2 OC[C@H]1OCC[C@H](C1)O 1P027Y0R [0,1,0,1,0,0|0,1,0]=3 2958 B9R1.7 BrCCC1CCN(C1)C 1P0293RQ [0,1,0,1,0,0|2,0,0]=4 2959 B9R1.7 CC1CCC(O1)CCN 1P01C7ZU [0,1,0,1,0,0|1,1,0]=4 2960 B9R1.7 CC1CCC(O1)CCO 1P01EMUC [0,1,0,1,0,0|0,1,0]=3 2961 B9R1.7 CCCC1CCC(=O)C1 1P00348R [0,1,0,1,0,0|1,0,1]=4 2962 B9R1.7 CCCC1CCC(=O)O1 1P00HB0Y [0,1,0,1,0,0|0,1,1]=4 2963 B9R1.7 CCCC1CCC(C1)N 1P01DVQV [0,1,0,1,0,0|2,0,0]=4 2964 B9R1.7 CCC[C@H]1COC(=O)C1 1P00ELOJ [0,1,0,1,0,0|1,0,1]=4 2965 B9R1.7 CNC[C@H]1NC[C@@H](C1)O 1P01C2PC [0,1,0,1,0,0|2,0,0]=4 2966 B9R1.7 COCC1CC(CN1)O 1P01C3A6 [0,1,0,1,0,0|2,0,0]=4 2967 B9R1.7 COC[C@@H]1C[C@@H](CN1)O 1P01C3C5 [0,1,0,1,0,0|2,0,0]=4 2968 B9R1.7 COC[C@@H]1C[C@H](CN1)O 1P01C5RU [0,1,0,1,0,0|2,0,0]=4 2969 B9R1.7 COC[C@H]1C[C@@H](CN1)O 1P028IFM [0,1,0,1,0,0|2,0,0]=4 2970 B9R1.7 COC[C@H]1C[C@H](CN1)O 1P01C5XL [0,1,0,1,0,0|2,0,0]=4 2971 B9R1.7 NCCC1CCC(C1)C 1P01FJWC [0,1,0,1,0,0|2,0,0]=4 2972 B9R1.7 NCCC1CCC(C1)F 1P01AC7S [0,1,0,1,0,0|2,0,0]=4 2973 B9R1.7 NCCC1CCN(C1)C 1P005N1H [0,1,0,1,0,0|2,0,0]=4 2974 B9R1.7 NCCC1CCN(C1)C 1P01BW8F [0,1,0,1,0,0|2,0,0]=4 2975 B9R1.7 OCCC1CCC(=O)N1 1P001M5D [0,1,0,1,0,0|1,0,1]=4 2976 B9R1.7 OCCC1CCN(C1)C 1P00CNQU [0,1,0,1,0,0|1,0,0]=3 2977 B9R1.7 OCCN1CCC(C1)C 1P01A1UE [0,1,0,1,0,0|2,0,0]=4 2978 B9R1.7 OCCN1CCC(C1)O 1P028XGV [0,1,0,1,0,0|2,0,0]=4 2979 B9R1.7 OCC[C@@H]1CCC(=O)N1 1P005J5U [0,1,0,1,0,0|1,0,1]=4 2980 B9R1.7 OCC[C@H]1CC[C@H](C1)N 1P024UNJ [0,1,0,1,0,0|1,0,0]=3 2981 B9R1.8 BrCCC1CCCCC1 1P001VIR [0,1,0,1,0,0|2,0,0]=4 2982 B9R1.8 BrCCC1CCCCN1 1P00J2AB [0,1,0,1,0,0|2,0,0]=4 2983 B9R1.8 BrCCC1CCCCO1 1P0059G4 [0,1,0,1,0,0|1,1,0]=4 2984 B9R1.8 BrCCC1CCNCC1 1P01FBKH [0,1,0,1,0,0|2,0,0]=4 2985 B9R1.8 BrCCC1CCOCC1 1P00396X [0,1,0,1,0,0|2,0,0]=4 2986 B9R1.8 BrCCC1COCCO1 1P01DTPS [0,1,0,1,0,0|1,1,0]=4 2987 B9R1.8 BrCCC1OCCCO1 1P0033B4 [0,1,0,1,0,0|1,1,0]=4 2988 B9R1.8 CCCC1CCCCC1 1P001Y30 [0,1,0,1,0,0|2,0,0]=4 2989 B9R1.8 CCCC1CCCCN1 1P001RYV [0,1,0,1,0,0|2,0,0]=4 2990 B9R1.8 CCCC1CCCNC1 1P019ZZ0 [0,1,0,1,0,0|2,0,0]=4 2991 B9R1.8 CCCC1CCNCC1 1P003MEC [0,1,0,1,0,0|2,0,0]=4 2992 B9R1.8 CCCC1CCNCC1 1P00I8YP [0,1,0,1,0,0|2,0,0]=4 2993 B9R1.8 CCCC1CNCCN1 1P019ZB5 [0,1,0,1,0,0|2,0,0]=4 2994 B9R1.8 CCCC1CNCCO1 1P01A3JF [0,1,0,1,0,0|1,1,0]=4 2995 B9R1.8 CCCC1COCCN1 1P002C2P [0,1,0,1,0,0|1,0,0]=3 2996 B9R1.8 CCCC1COCCN1 1P021YV0 [0,1,0,1,0,0|1,0,0]=3 2997 B9R1.8 CCCN1CCOCC1 1P00CCYI [0,1,0,1,0,0|2,0,0]=4 2998 B9R1.8 CCC[C@H]1CCCCN1 1P00DH6U [0,1,0,1,0,0|2,0,0]=4 2999 B9R1.8 CCNC1CCCOC1 1P01C5YU [0,1,0,1,0,0|2,0,0]=4 3000 B9R1.8 CCNC1CCOCC1 1P003808 [0,1,0,1,0,0|2,0,0]=4 3001 B9R1.8 CCNC1CCOCC1 1P0090V0 [0,1,0,1,0,0|2,0,0]=4 3002 B9R1.8 CNCC1CCCOC1 1P00FU62 [0,1,0,1,0,0|2,0,0]=4 3003 B9R1.8 CNCC1CCCSC1 1P027ZF3 [0,1,0,1,0,0|2,0,0]=4 3004 B9R1.8 CNCC1CCOCC1 1P00D8US [0,1,0,1,0,0|2,0,0]=4 3005 B9R1.8 CNCC1CCOCC1 1P00IACV [0,1,0,1,0,0|2,0,0]=4 3006 B9R1.8 CNCC1COCCO1 1P002TMX [0,1,0,1,0,0|2,0,0]=4 3007 B9R1.8 CNCC1COCCO1 1P00H3GN [0,1,0,1,0,0|2,0,0]=4 3008 B9R1.8 CNC[C@@H]1COCCO1 1P00ILMO [0,1,0,1,0,0|2,0,0]=4 3009 B9R1.8 CNC[C@@H]1COCCO1 1P00IMSV [0,1,0,1,0,0|2,0,0]=4 3010 B9R1.8 CNC[C@H]1COCCO1 1P00ILKF [0,1,0,1,0,0|2,0,0]=4 3011 B9R1.8 COCC1COCCN1 1P00H9GX [0,1,0,1,0,0|2,0,0]=4 3012 B9R1.8 COC[C@@H]1COCCN1 1P005VWK [0,1,0,1,0,0|2,0,0]=4 3013 B9R1.8 COC[C@H]1COCCN1 1P007PGW [0,1,0,1,0,0|2,0,0]=4 3014 B9R1.8 ClCCC1CCCCC1 1P007F3V [0,1,0,1,0,0|2,0,0]=4 3015 B9R1.8 ClCCC1CCNCC1 1P01F94Q [0,1,0,1,0,0|2,0,0]=4 3016 B9R1.8 ClCCC1CCOCC1 1P01ANXK [0,1,0,1,0,0|2,0,0]=4 3017 B9R1.8 FCCC1CCCNC1 1P01B68G [0,1,0,1,0,0|2,0,0]=4 3018 B9R1.8 FCCC1CCNCC1 1P00AT7O [0,1,0,1,0,0|2,0,0]=4 3019 B9R1.8 FCCC1CCNCC1 1P00AT7P [0,1,0,1,0,0|2,0,0]=4 3020 B9R1.8 FCCC1CNCCO1 1P01BXWO [0,1,0,1,0,0|1,1,0]=4 3021 B9R1.8 ICCC1CCCCC1 1P00G4Q8 [0,1,0,1,0,0|2,0,0]=4 3022 B9R1.8 ICCC1CCOCC1 1P00E0GZ [0,1,0,1,0,0|2,0,0]=4 3023 B9R1.8 NCCC1CCCCC1 1P003PLC [0,1,0,1,0,0|2,0,0]=4 3024 B9R1.8 NCCC1CCCCC1 1P00D941 [0,1,0,1,0,0|2,0,0]=4 3025 B9R1.8 NCCC1CCCCO1 1P0002TK [0,1,0,1,0,0|1,1,0]=4 3026 B9R1.8 NCCC1CCCCO1 1P00BYX9 [0,1,0,1,0,0|1,1,0]=4 3027 B9R1.8 NCCC1CCCOC1 1P006SW3 [0,1,0,1,0,0|1,1,0]=4 3028 B9R1.8 NCCC1CCCOC1 1P024NNR [0,1,0,1,0,0|1,1,0]=4 3029 B9R1.8 NCCC1CCNCC1 1P006MVE [0,1,0,1,0,0|2,0,0]=4 3030 B9R1.8 NCCC1CCNCC1 1P00GAAA [0,1,0,1,0,0|2,0,0]=4 3031 B9R1.8 NCCC1CCOCC1 1P003KFO [0,1,0,1,0,0|2,0,0]=4 3032 B9R1.8 NCCC1CCOCC1 1P0077K0 [0,1,0,1,0,0|2,0,0]=4 3033 B9R1.8 NCCC1CCSCC1 1P000SUN [0,1,0,1,0,0|2,0,0]=4 3034 B9R1.8 NCCC1COCCO1 1P01DXCG [0,1,0,1,0,0|1,1,0]=4 3035 B9R1.8 NCCC1OCCCO1 1P028F4T [0,1,0,1,0,0|1,1,0]=4 3036 B9R1.8 NCCC1OCCNC1 1P01BCCR [0,1,0,1,0,0|1,1,0]=4 3037 B9R1.8 OCCC1=CCCCC1 1P00CMOG [0,1,0,1,0,0|1,0,1]=4 3038 B9R1.8 OCCC1CCCC=C1 1P007VW0 [0,1,0,1,0,0|1,0,0]=3 3039 B9R1.8 OCCC1CCCCC1 1P003HLE [0,1,0,1,0,0|1,0,0]=3 3040 B9R1.8 OCCC1CCCCN1 1P001LDB [0,1,0,1,0,0|1,0,0]=3 3041 B9R1.8 OCCC1CCCCO1 1P00C8W8 [0,1,0,1,0,0|0,1,0]=3 3042 B9R1.8 OCCC1CCCNC1 1P001Y2V [0,1,0,1,0,0|1,0,0]=3 3043 B9R1.8 OCCC1CCCOC1 1P00962W [0,1,0,1,0,0|0,1,0]=3 3044 B9R1.8 OCCC1CCCSC1 1P01K92C [0,1,0,1,0,0|0,0,0]=2 3045 B9R1.8 OCCC1CCNCC1 1P003A23 [0,1,0,1,0,0|1,0,0]=3 3046 B9R1.8 OCCC1CCNCC1 1P00GZ55 [0,1,0,1,0,0|1,0,0]=3 3047 B9R1.8 OCCC1CCOCC1 1P00D9CJ [0,1,0,1,0,0|1,0,0]=3 3048 B9R1.8 OCCC1CNCCN1 1P01BFQG [0,1,0,1,0,0|1,0,0]=3 3049 B9R1.8 OCCC1CNCCO1 1P0011X5 [0,1,0,1,0,0|0,1,0]=3 3050 B9R1.8 OCCC1CNCCO1 1P00G8NN [0,1,0,1,0,0|0,1,0]=3 3051 B9R1.8 OCCC1COCCN1 1P00HZ9I [0,1,0,1,0,0|1,0,0]=3 3052 B9R1.8 OCCC1COCCO1 1P01EI7Q [0,1,0,1,0,0|0,1,0]=3 3053 B9R1.8 OCCC1CSCCN1 1P019ZKG [0,1,0,1,0,0|1,0,0]=3 3054 B9R1.8 OCCC1NCCNC1 1P006ULW [0,1,0,1,0,0|1,0,0]=3 3055 B9R1.8 OCCC1SCCCS1 1P001M75 [0,1,0,1,0,0|0,0,0]=2 3056 B9R1.8 OCCN1CCCCC1 1P0030HK [0,1,0,1,0,0|2,0,0]=4 3057 B9R1.8 OCCN1CCCCC1 1P02027R [0,1,0,1,0,0|2,0,0]=4 3058 B9R1.8 OCCN1CCNCC1 1P0035QX [0,1,0,1,0,0|2,0,0]=4 3059 B9R1.8 OCCN1CCSCC1 1P0037LA [0,1,0,1,0,0|2,0,0]=4 3060 B9R1.8 OCC[C@@H]1CCCCN1 1P0039GQ [0,1,0,1,0,0|1,0,0]=3 3061 B9R1.8 OCC[C@@H]1CCCCN1 1P00G3EI [0,1,0,1,0,0|1,0,0]=3 3062 B9R1.8 OCC[C@@H]1COCCN1 1P006E3G [0,1,0,1,0,0|1,0,0]=3 3063 B9R1.8 OCC[C@@H]1NCCNC1 1P000N1A [0,1,0,1,0,0|1,0,0]=3 3064 B9R1.8 OCC[C@H]1CCCCN1 1P0032VE [0,1,0,1,0,0|1,0,0]=3 3065 B9R1.8 OCC[C@H]1NCCNC1 1P001PA9 [0,1,0,1,0,0|1,0,0]=3 3066 B9R1.8 SCCC1CCCCC1 1P028H2U [0,1,0,1,0,0|1,1,0]=4 3067 B9R1.8 SCCC1CCCOC1 1P0288ED [0,1,0,1,0,0|0,2,0]=4 3068 B9R1.8 SCCC1CCOCC1 1P020ZM3 [0,1,0,1,0,0|1,1,0]=4 3069 B9R1.8 SCCC1CNCCO1 1P028VVM [0,1,0,1,0,0|0,2,0]=4 3070 B9R1.9 CCCC[C@@H]1C[C@@H](C1)O 1P028G5L [0,1,0,1,0,0|1,0,0]=3 3071 B9R1.9 CCCC[C@@H]1C[C@H](C1)O 1P028FO3 [0,1,0,1,0,0|1,0,0]=3 3072 B9R1.9 CCCOC1CC(C1)Br 1P028CTN [0,1,0,1,0,0|2,0,0]=4 3073 B9R1.9 CCCOC1CC(C1)N 1P028SBB [0,1,0,1,0,0|2,0,0]=4 3074 B9R1.9 CCCO[C@@H]1C[C@@H](C1)O 1P0287GP [0,1,0,1,0,0|1,0,0]=3 3075 B9R1.9 COCCC1CC(C1)N 1P027YQG [0,1,0,1,0,0|2,0,0]=4 3076 B9R1.9 CSCCC1CC(C1)Br 1P028VYZ [0,1,0,1,0,0|2,0,0]=4 3077 B9R1.9 CSCCC1CC(C1)N 1P028SJP [0,1,0,1,0,0|2,0,0]=4 3078 B9R1.9 CSCCC1CC(C1)O 1P02875U [0,1,0,1,0,0|1,0,0]=3 3079 B9R1.9 CSCCC1CC(C1)S 1P027XIC [0,1,0,1,0,0|1,1,0]=4 3080 B9R1.9 CSCC[C@@H]1C[C@H](C1)N 1P027Y4T [0,1,0,1,0,0|2,0,0]=4 3081 B9R1.9 NCCCC1CC(C1)C 1P02821Q [0,1,0,1,0,0|2,0,0]=4 3082 B9R1.12 BrCCCC1CCCC1 1P01BL95 [0,1,0,1,0,0|2,0,0]=4 3083 B9R1.12 BrCCCC1CCCO1 1P01BL47 [0,1,0,1,0,0|1,1,0]=4 3084 B9R1.12 BrCCCC1COCC1 1P01C48U [0,1,0,1,0,0|1,0,0]=3 3085 B9R1.12 BrCCOC1CCCC1 1P018SQY [0,1,0,1,0,0|2,0,0]=4 3086 B9R1.12 BrCCOC1COCC1 1P01BKNE [0,1,0,1,0,0|2,0,0]=4 3087 B9R1.12 BrCCSC1CCCC1 1P01BUB9 [0,1,0,1,0,0|2,0,0]=4 3088 B9R1.12 C#CCCC1CCCC1 1P028WPS [0,1,0,1,0,0|2,0,0]=4 3089 B9R1.12 C#CCCC1CCCN1 1P028S00 [0,1,0,1,0,0|2,0,0]=4 3090 B9R1.12 C#CCCC1CCCO1 1P028U27 [0,1,0,1,0,0|1,1,0]=4 3091 B9R1.12 C#CCCC1COCC1 1P028FDV [0,1,0,1,0,0|1,0,1]=4 3092 B9R1.12 C=CCCC1CCCN1 1P01BEYG [0,1,0,1,0,0|2,0,0]=4 3093 B9R1.12 CCCCC1CCCN1 1P00J2HB [0,1,0,1,0,0|2,0,0]=4 3094 B9R1.12 CCCCC1CNCC1 1P024NS2 [0,1,0,1,0,0|2,0,0]=4 3095 B9R1.12 CCCNC1CCCC1 1P009AID [0,1,0,1,0,0|2,0,0]=4 3096 B9R1.12 CCCNC1CCCC1 1P00C6JG [0,1,0,1,0,0|2,0,0]=4 3097 B9R1.12 CCCOC1CNCC1 1P00IIW4 [0,1,0,1,0,0|2,0,0]=4 3098 B9R1.12 CCNCC1CCCO1 1P00FDM8 [0,1,0,1,0,0|1,1,0]=4 3099 B9R1.12 CCNCC1CCCO1 1P019XF9 [0,1,0,1,0,0|1,1,0]=4 3100 B9R1.12 CCNCC1COCC1 1P019V1T [0,1,0,1,0,0|1,0,0]=3 3101 B9R1.12 CCOCC1CCCN1 1P004794 [0,1,0,1,0,0|2,0,0]=4 3102 B9R1.12 CCOCC1CCCO1 1P003QXO [0,1,0,1,0,0|1,1,0]=4 3103 B9R1.12 CCOCC1CNCC1 1P019U4Z [0,1,0,1,0,0|2,0,0]=4 3104 B9R1.12 CNCCC1CCCO1 1P01AG1E [0,1,0,1,0,0|1,1,0]=4 3105 B9R1.12 COCCC1CCCN1 1P00II1T [0,1,0,1,0,0|1,0,0]=3 3106 B9R1.12 COCCC1CNCC1 1P01ACM2 [0,1,0,1,0,0|2,0,0]=4 3107 B9R1.12 ClCCCC1CCCC1 1P019T49 [0,1,0,1,0,0|2,0,0]=4 3108 B9R1.12 ClCCSC1COCC1 1P01DW5B [0,1,0,1,0,0|2,0,0]=4 3109 B9R1.12 ClCOCC1CCCO1 1P01DYVW [0,1,0,1,0,0|1,1,0]=4 3110 B9R1.12 FCCNC1CCCC1 1P028YHR [0,1,0,1,0,0|2,0,0]=4 3111 B9R1.12 FCCNC1COCC1 1P028X6D [0,1,0,1,0,0|2,0,0]=4 3112 B9R1.12 ICCCC1CCCC1 1P007VU0 [0,1,0,1,0,0|2,0,0]=4 3113 B9R1.12 ICCCC1CCCO1 1P027UA3 [0,1,0,1,0,0|1,1,0]=4 3114 B9R1.12 NCCCC1CCCC1 1P00EEJI [0,1,0,1,0,0|2,0,0]=4 3115 B9R1.12 NCCCC1CCCC1 1P00ILAW [0,1,0,1,0,0|2,0,0]=4 3116 B9R1.12 NCCCC1COCC1 1P005QV6 [0,1,0,1,0,0|1,0,0]=3 3117 B9R1.12 NCCCC1COCC1 1P009135 [0,1,0,1,0,0|1,0,0]=3 3118 B9R1.12 NCCC[C@@H]1CCCO1 1P028K5H [0,1,0,1,0,0|1,1,0]=4 3119 B9R1.12 NCCC[C@H]1CCCO1 1P027YKE [0,1,0,1,0,0|1,1,0]=4 3120 B9R1.12 NCCNC1CCCC1 1P028UVM [0,1,0,1,0,0|2,0,0]=4 3121 B9R1.12 NCCOC1CCCC1 1P003FHL [0,1,0,1,0,0|2,0,0]=4 3122 B9R1.12 NCCOC1CCCC1 1P009A0U [0,1,0,1,0,0|2,0,0]=4 3123 B9R1.12 NCCOC1COCC1 1P01C7I9 [0,1,0,1,0,0|2,0,0]=4 3124 B9R1.12 NCCSC1CCCC1 1P00I4BG [0,1,0,1,0,0|2,0,0]=4 3125 B9R1.12 NCCSC1CCCC1 1P01ABA5 [0,1,0,1,0,0|2,0,0]=4 3126 B9R1.12 O=CCCC1CCCC1 1P00EEF2 [0,1,0,1,0,0|1,0,1]=4 3127 B9R1.12 O=CCCC1CCCO1 1P01A7J3 [0,1,0,1,0,0|0,1,1]=4 3128 B9R1.12 O=CCCC1COCC1 1P01B1YM [0,1,0,1,0,0|1,0,1]=4 3129 B9R1.12 OCC#CC1CCCC1 1P02867C [0,1,0,1,0,0|1,0,1]=4 3130 B9R1.12 OCCCC1CCCC1 1P003JTF [0,1,0,1,0,0|1,0,0]=3 3131 B9R1.12 OCCCC1CCCN1 1P008OSO [0,1,0,1,0,0|1,0,0]=3 3132 B9R1.12 OCCCC1CCCO1 1P00G5LD [0,1,0,1,0,0|0,1,0]=3 3133 B9R1.12 OCCCC1CNCC1 1P01C2L0 [0,1,0,1,0,0|2,0,0]=4 3134 B9R1.12 OCCCC1OCCO1 1P003AZ1 [0,1,0,1,0,0|1,1,0]=4 3135 B9R1.12 OCCCN1CCCC1 1P002BAZ [0,1,0,1,0,0|2,0,0]=4 3136 B9R1.12 OCCC[C@@H]1CCCN1 1P01FIC0 [0,1,0,1,0,0|1,0,0]=3 3137 B9R1.12 OCCC[C@H]1CCCN1 1P01FIB9 [0,1,0,1,0,0|1,0,0]=3 3138 B9R1.12 OCCNC1CCCC1 1P019WIC [0,1,0,1,0,0|1,0,0]=3 3139 B9R1.12 OCCOC1CCCC1 1P0023OM [0,1,0,1,0,0|1,0,0]=3 3140 B9R1.12 OCCOC1CNCC1 1P028JJB [0,1,0,1,0,0|2,0,0]=4 3141 B9R1.12 OCCOC1COCC1 1P01BK1R [0,1,0,1,0,0|2,0,0]=4 3142 B9R1.12 SCCCC1CCCC1 1P028M2V [0,1,0,1,0,0|1,1,0]=4 3143 B9R1.15 BrCC1CCCCC1C 1P01ALI8 [0,1,0,1,0,0|2,0,0]=4 3144 B9R1.15 BrCC1CCCCC1F 1P00O5PB [0,1,0,1,0,0|2,0,0]=4 3145 B9R1.15 BrCC1CCCCC1O 1P01AMNH [0,1,0,1,0,0|1,1,0]=4 3146 B9R1.15 CCC1CCCCC1Br 1P01B7NI [0,1,0,1,0,0|2,0,0]=4 3147 B9R1.15 CCC1CCCCC1N 1P019NC1 [0,1,0,1,0,0|2,0,0]=4 3148 B9R1.15 CCC1CCCCC1O 1P003HO9 [0,1,0,1,0,0|1,1,0]=4 3149 B9R1.15 CCC1COCCC1=O 1P00BHVG [0,1,0,1,0,0|0,1,1]=4 3150 B9R1.15 CCC1OCCCC1N 1P027WR0 [0,1,0,1,0,0|1,0,0]=3 3151 B9R1.15 CN1CCOCC1CO 1P008ZQU [0,1,0,1,0,0|2,0,0]=4 3152 B9R1.15 CN1CCOC[C@@H]1CO 1P019GS8 [0,1,0,1,0,0|2,0,0]=4 3153 B9R1.15 CN1CCOC[C@H]1CO 1P019GS9 [0,1,0,1,0,0|2,0,0]=4 3154 B9R1.15 CN1CCOC[C@H]1CO 1P01E6KO [0,1,0,1,0,0|2,0,0]=4 3155 B9R1.15 COC1COCCC1N 1P01AII0 [0,1,0,1,0,0|2,0,0]=4 3156 B9R1.15 COC1COCCC1O 1P01AD7T [0,1,0,1,0,0|1,1,0]=4 3157 B9R1.15 CO[C@@H]1COCC[C@H]1N 1P000KMD [0,1,0,1,0,0|2,0,0]=4 3158 B9R1.15 CO[C@@H]1COCC[C@H]1N 1P01JVFH [0,1,0,1,0,0|2,0,0]=4 3159 B9R1.15 CO[C@@H]1OCCC[C@@H]1N 1P028VHL [0,1,0,1,0,0|2,0,0]=4 3160 B9R1.15 CO[C@@H]1OCCC[C@H]1Br 1P028GQN [0,1,0,1,0,0|2,0,0]=4 3161 B9R1.15 CO[C@H]1COCC[C@@H]1N 1P00HWSM [0,1,0,1,0,0|2,0,0]=4 3162 B9R1.15 CO[C@H]1COCC[C@H]1N 1P00IJM3 [0,1,0,1,0,0|2,0,0]=4 3163 B9R1.15 NCC1CCCCC1C 1P00I8B6 [0,1,0,1,0,0|2,0,0]=4 3164 B9R1.15 NCC1CCCCC1C 1P019XYX [0,1,0,1,0,0|2,0,0]=4 3165 B9R1.15 NCC1CCCCC1F 1P01BAQJ [0,1,0,1,0,0|2,0,0]=4 3166 B9R1.15 NCC1CCCCC1N 1P00CIER [0,1,0,1,0,0|2,0,0]=4 3167 B9R1.15 NCC1CCCCC1O 1P01AKX1 [0,1,0,1,0,0|1,1,0]=4 3168 B9R1.15 NCC1CCOCC1C 1P01BAX4 [0,1,0,1,0,0|2,0,0]=4 3169 B9R1.15 NCC1NCCCC1C 1P01B1N1 [0,1,0,1,0,0|2,0,0]=4 3170 B9R1.15 NC[C@@H]1CCCC[C@@H]1N 1P009WIT [0,1,0,1,0,0|2,0,0]=4 3171 B9R1.15 NC[C@@H]1CCCC[C@@H]1O 1P002QEN [0,1,0,1,0,0|1,1,0]=4 3172 B9R1.15 NC[C@@H]1CCCC[C@H]1N 1P00I577 [0,1,0,1,0,0|2,0,0]=4 3173 B9R1.15 NC[C@@H]1CCNC[C@H]1O 1P0004PQ [0,1,0,1,0,0|1,1,0]=4 3174 B9R1.15 NC[C@H]1CCCC[C@@H]1O 1P01C1SL [0,1,0,1,0,0|1,1,0]=4 3175 B9R1.15 NC[C@H]1OCCO[C@H]1C 1P0280PW [0,1,0,1,0,0|2,0,0]=4 3176 B9R1.15 OCC1CC=CCC1C 1P003NR2 [0,1,0,1,0,0|1,0,1]=4 3177 B9R1.15 OCC1CCCCC1=O 1P00D9D9 [0,1,0,1,0,0|0,1,1]=4 3178 B9R1.15 OCC1CCCCC1C 1P002LAB [0,1,0,1,0,0|1,0,0]=3 3179 B9R1.15 OCC1CCCCC1F 1P0209HO [0,1,0,1,0,0|1,0,0]=3 3180 B9R1.15 OCC1CCCCC1N 1P01AKNO [0,1,0,1,0,0|1,0,0]=3 3181 B9R1.15 OCC1CCCCC1O 1P00C1PL [0,1,0,1,0,0|0,1,0]=3 3182 B9R1.15 OCC1CCCCN1C 1P002K5X [0,1,0,1,0,0|2,0,0]=4 3183 B9R1.15 OCC1CCCNC1=O 1P002RFF [0,1,0,1,0,0|0,1,1]=4 3184 B9R1.15 OCC1CCCNC1C 1P00HSYD [0,1,0,1,0,0|1,0,0]=3 3185 B9R1.15 OCC1CCNCC1C 1P020L4O [0,1,0,1,0,0|1,0,0]=3 3186 B9R1.15 OCC1CCNCC1C 1P0282ZX [0,1,0,1,0,0|1,0,0]=3 3187 B9R1.15 OCC1CCNCC1O 1P00I4RF [0,1,0,1,0,0|0,1,0]=3 3188 B9R1.15 OCC1CNCCC1C 1P01B7X3 [0,1,0,1,0,0|1,0,0]=3 3189 B9R1.15 OCC1CNCCN1C 1P00J2Q1 [0,1,0,1,0,0|2,0,0]=4 3190 B9R1.15 OCC1COCCC1O 1P01A726 [0,1,0,1,0,0|0,1,0]=3 3191 B9R1.15 OCC1NCCCC1C 1P00HSYI [0,1,0,1,0,0|1,0,0]=3 3192 B9R1.15 OC[C@@H]1CC=CC[C@@H]1N 1P009WIO [0,1,0,1,0,0|1,0,1]=4 3193 B9R1.15 OC[C@@H]1CCCCN1C 1P0072JL [0,1,0,1,0,0|2,0,0]=4 3194 B9R1.15 OC[C@@H]1CCCC[C@@H]1N 1P00BJ5U [0,1,0,1,0,0|1,0,0]=3 3195 B9R1.15 OC[C@@H]1CCCC[C@@H]1N 1P021VJJ [0,1,0,1,0,0|1,0,0]=3 3196 B9R1.15 OC[C@@H]1CCCC[C@H]1N 1P00BEIS [0,1,0,1,0,0|1,0,0]=3 3197 B9R1.15 OC[C@@H]1CCNC[C@@H]1F 1P00HYG1 [0,1,0,1,0,0|1,0,0]=3 3198 B9R1.15 OC[C@@H]1CCNC[C@@H]1O 1P00BOQ7 [0,1,0,1,0,0|0,1,0]=3 3199 B9R1.15 OC[C@@H]1CNCC[C@@H]1O 1P0293V3 [0,1,0,1,0,0|0,1,0]=3 3200 B9R1.15 OC[C@@H]1NCCO[C@H]1C 1P019GSE [0,1,0,1,0,0|2,0,0]=4 3201 B9R1.15 OC[C@H]1CCCCN1C 1P005QFY [0,1,0,1,0,0|2,0,0]=4 3202 B9R1.15 OC[C@H]1CCCC[C@@H]1N 1P028BQN [0,1,0,1,0,0|1,0,0]=3 3203 B9R1.15 OC[C@H]1CCCC[C@H]1N 1P00BP7S [0,1,0,1,0,0|1,0,0]=3 3204 B9R1.15 OC[C@H]1CCCN[C@H]1C 1P027WFI [0,1,0,1,0,0|1,0,0]=3 3205 B9R1.15 OC[C@H]1CCNC[C@@H]1O 1P00J2SE [0,1,0,1,0,0|0,1,0]=3 3206 B9R1.15 OC[C@H]1CCNC[C@H]1F 1P00IG87 [0,1,0,1,0,0|1,0,0]=3 3207 B9R1.15 OC[C@H]1NCCO[C@@H]1C 1P00FH70 [0,1,0,1,0,0|2,0,0]=4 3208 B9R1.22 CN1C[C@@H](C[C@H]1CO)F 1P01WTLI [0,1,0,1,0,0|2,0,0]=4 3209 B9R1.22 CN1C[C@@H](C[C@H]1CO)N 1P027OUS [0,1,0,1,0,0|2,0,0]=4 3210 B9R1.22 CN1C[C@H](C[C@H]1CO)F 1P01XAEF [0,1,0,1,0,0|2,0,0]=4 3211 B9R1.22 CN[C@H]1CN(C[C@@H]1O)C 1P009E7V [0,1,0,1,0,0|2,0,0]=4 3212 B9R1.22 CN[C@H]1CN(C[C@@H]1O)C 1P00J2IT [0,1,0,1,0,0|2,0,0]=4 3213 B9R1.22 CO[C@@H]1CN(C[C@H]1O)C 1P01JWNH [0,1,0,1,0,0|2,0,0]=4 3214 B9R1.22 CO[C@@H]1C[C@@H](C[C@@H]1O)N 1P028VMR [0,1,0,1,0,0|1,0,0]=3 3215 B9R1.22 CO[C@H]1CN(C[C@@H]1O)C 1P020763 [0,1,0,1,0,0|2,0,0]=4 3216 B9R1.22 OC[C@@H]1C[C@@H](CN1C)N 1P00J2PL [0,1,0,1,0,0|2,0,0]=4 3217 B9R1.22 OC[C@@H]1C[C@@H](CN1C)O 1P01DZKW [0,1,0,1,0,0|1,1,0]=4 3218 B9R1.22 OC[C@@H]1C[C@H](CN1C)O 1P007EAU [0,1,0,1,0,0|1,1,0]=4 3219 B9R1.22 OC[C@@H]1OC(C[C@H]1O)O 1P007TRT [0,1,0,1,0,0|1,1,0]=4 3220 B9R1.22 OC[C@H]1OC(C[C@@H]1O)O 1P019ZMT [0,1,0,1,0,0|1,1,0]=4 3221 B9R1.33 BrCCC1CCCC1=O 1P019U2G [0,1,0,1,0,0|1,1,0]=4 3222 B9R1.33 BrCCC1CCCN1C 1P01A1NX [0,1,0,1,0,0|2,0,0]=4 3223 B9R1.33 BrCCC1CCOC1=O 1P019ZFZ [0,1,0,1,0,0|1,1,0]=4 3224 B9R1.33 BrCCC1OCCC1C 1P028O8J [0,1,0,1,0,0|1,0,0]=3 3225 B9R1.33 BrCCN1CCCC1C 1P028N2D [0,1,0,1,0,0|2,0,0]=4 3226 B9R1.33 C=CCC1CCCC1N 1P009N8I [0,1,0,1,0,0|2,0,0]=4 3227 B9R1.33 C=CC[C@H]1CCC[C@H]1N 1P028BK1 [0,1,0,1,0,0|2,0,0]=4 3228 B9R1.33 CC1OCCC1CCN 1P028WEI [0,1,0,1,0,0|2,0,0]=4 3229 B9R1.33 CCCC1CCCC1=O 1P000J0L [0,1,0,1,0,0|1,1,0]=4 3230 B9R1.33 CCCC1CCNC1=O 1P027UUD [0,1,0,1,0,0|1,1,0]=4 3231 B9R1.33 CCC[C@@H]1CNC[C@H]1O 1P0289X5 [0,1,0,1,0,0|2,0,0]=4 3232 B9R1.33 CCN[C@@H]1CCC[C@H]1O 1P00NE7N [0,1,0,1,0,0|1,1,0]=4 3233 B9R1.33 CCN[C@H]1COC[C@@H]1O 1P009EE6 [0,1,0,1,0,0|2,0,0]=4 3234 B9R1.33 CCO[C@@H]1CCC[C@H]1N 1P01C2DS [0,1,0,1,0,0|2,0,0]=4 3235 B9R1.33 CCO[C@@H]1CCC[C@H]1O 1P01BHF0 [0,1,0,1,0,0|1,1,0]=4 3236 B9R1.33 CCO[C@@H]1COC[C@H]1N 1P00J3MH [0,1,0,1,0,0|2,0,0]=4 3237 B9R1.33 CCO[C@H]1COC[C@@H]1N 1P00J2DC [0,1,0,1,0,0|2,0,0]=4 3238 B9R1.33 CCSC1CCCC1N 1P019U7X [0,1,0,1,0,0|2,0,0]=4 3239 B9R1.33 CNCC1CCCC1O 1P01A313 [0,1,0,1,0,0|1,1,0]=4 3240 B9R1.33 CNCC1CCOC1C 1P028XLI [0,1,0,1,0,0|2,0,0]=4 3241 B9R1.33 COCC1CCCN1N 1P00BBB8 [0,1,0,1,0,0|2,0,0]=4 3242 B9R1.33 COC[C@@H]1CCCN1N 1P00392U [0,1,0,1,0,0|2,0,0]=4 3243 B9R1.33 COC[C@H]1CCCN1N 1P00373B [0,1,0,1,0,0|2,0,0]=4 3244 B9R1.33 C[C@@H]1OCC[C@@H]1CCN 1P028J1N [0,1,0,1,0,0|2,0,0]=4 3245 B9R1.33 ClCCC1CCCN1C 1P003F80 [0,1,0,1,0,0|2,0,0]=4 3246 B9R1.33 FCCC1CCCC1=O 1P01BBFU [0,1,0,1,0,0|1,1,0]=4 3247 B9R1.33 NCCC1CCCN1C 1P003F7H [0,1,0,1,0,0|2,0,0]=4 3248 B9R1.33 NCCN1CCCC1C 1P019SVQ [0,1,0,1,0,0|2,0,0]=4 3249 B9R1.33 NCC[C@@H]1CCCN1C 1P00BYXW [0,1,0,1,0,0|2,0,0]=4 3250 B9R1.33 NCC[C@@H]1CCCN1C 1P024TQ1 [0,1,0,1,0,0|2,0,0]=4 3251 B9R1.33 NCC[C@@H]1CCC[C@@H]1O 1P028WGM [0,1,0,1,0,0|1,1,0]=4 3252 B9R1.33 NCC[C@@H]1CCC[C@H]1O 1P028CO5 [0,1,0,1,0,0|1,1,0]=4 3253 B9R1.33 NCC[C@@H]1COC[C@H]1O 1P028LFI [0,1,0,1,0,0|2,0,0]=4 3254 B9R1.33 NCC[C@H]1CCCN1C 1P01DXS4 [0,1,0,1,0,0|2,0,0]=4 3255 B9R1.33 OCCC1CCCC1N 1P00KA7L [0,1,0,1,0,0|1,0,0]=3 3256 B9R1.33 OCCC1CCCC1O 1P01BGE5 [0,1,0,1,0,0|0,1,0]=3 3257 B9R1.33 OCCC1CCCN1C 1P003EY6 [0,1,0,1,0,0|1,0,0]=3 3258 B9R1.33 OCCC1CCNC1=O 1P01ALNF [0,1,0,1,0,0|1,1,0]=4 3259 B9R1.33 OCCC1CCOC1=O 1P019KYT [0,1,0,1,0,0|1,1,0]=4 3260 B9R1.33 OCCC1OCCC1C 1P028OO6 [0,1,0,1,0,0|0,1,0]=3 3261 B9R1.33 OCCN1CCCC1=O 1P003SQ8 [0,1,0,1,0,0|0,1,1]=4 3262 B9R1.33 OCC[C@@H]1CCCN1C 1P00EKI1 [0,1,0,1,0,0|1,0,0]=3 3263 B9R1.33 OCC[C@@H]1CCC[C@H]1N 1P0293KT [0,1,0,1,0,0|1,0,0]=3 3264 B9R1.33 OCC[C@H]1CCCN1C 1P00EKFF [0,1,0,1,0,0|1,0,0]=3 3265 B9R1.48 CC1CNCCC(C1)O 1P028HXM [0,1,0,1,0,0|1,0,0]=3 3266 B9R1.48 CC1NCCNC(C1)C 1P028KDU [0,1,0,1,0,0|2,0,0]=4 3267 B9R1.48 CN1CCNCC(C1)O 1P0280YJ [0,1,0,1,0,0|2,0,0]=4 3268 B9R1.48 CN1CCOCC(C1)N 1P028BOP [0,1,0,1,0,0|2,0,0]=4 3269 B9R1.48 C[C@@H]1CCCOC(=O)C1 1P002E70 [0,1,0,1,0,0|1,0,1]=4 3270 B9R1.49 CC1CCCC(=O)CC1 1P01ALFG [0,1,0,1,0,0|1,0,1]=4 3271 B9R1.49 CC1CCCC(CC1)N 1P01B1O1 [0,1,0,1,0,0|2,0,0]=4 3272 B9R1.49 CC1CCCC(CN1)C 1P01ALG5 [0,1,0,1,0,0|2,0,0]=4 3273 B9R1.49 CC1CCCC(CN1)C 1P028DEI [0,1,0,1,0,0|2,0,0]=4 3274 B9R1.49 CN1CCCC(CC1)N 1P00II1N [0,1,0,1,0,0|2,0,0]=4 3275 B9R1.49 CN1CCCC(CC1)O 1P002F6O [0,1,0,1,0,0|1,1,0]=4 3276 B9R1.49 C[C@@H]1CCO[C@@H](CN1)C 1P028J2S [0,1,0,1,0,0|1,0,0]=3 3277 B9R1.49 NC1CCCC(CC1)N 1P028JOK [0,1,0,1,0,0|2,0,0]=4 3278 B9R1.49 NC1CCCC(CC1)O 1P027UAM [0,1,0,1,0,0|1,0,0]=3 3279 B9R1.49 OC1CCCC(=O)NC1 1P000ZGL [0,1,0,1,0,0|0,1,1]=4 3280 B9R1.50 BrC1CCCC=CCC1 1P00CMWI [0,1,0,1,0,0|2,0,0]=4 3281 B9R1.50 CC1CCCCCCN1 1P0286RS [0,1,0,1,0,0|2,0,0]=4 3282 B9R1.50 ClC1CCCCCCC1 1P001OHL [0,1,0,1,0,0|2,0,0]=4 3283 B9R1.50 NC1CCCC=CCC1 1P01EMNJ [0,1,0,1,0,0|2,0,0]=4 3284 B9R1.50 NC1CCCCCCC1 1P00IA7I [0,1,0,1,0,0|2,0,0]=4 3285 B9R1.50 NC1CCCCCNC1 1P01C0JA [0,1,0,1,0,0|2,0,0]=4 3286 B9R1.50 NC1CCCCCNC1 1P01FJAM [0,1,0,1,0,0|2,0,0]=4 3287 B9R1.50 O=C1CCCOCCC1 1P028F98 [0,1,0,1,0,0|0,1,1]=4 3288 B9R1.50 OC1CCCC=CCC1 1P00GARS [0,1,0,1,0,0|1,1,0]=4 3289 B9R1.50 OC1CCCCCCC1 1P005JW9 [0,1,0,1,0,0|1,1,0]=4 3290 B9R1.50 O[C@H]1CCCC=CCC1 1P00CIJB [0,1,0,1,0,0|1,1,0]=4 3291 B9R1.58 CCOC1CC(C1)CO 1P01BAJ1 [0,1,0,1,0,0|2,0,0]=4 3292 B9R1.58 NCCC1CC(C1)OC 1P01B348 [0,1,0,1,0,0|2,0,0]=4 3293 B9R1.58 NCC[C@@H]1C[C@@H](C1)OC 1P028KV5 [0,1,0,1,0,0|2,0,0]=4 3294 B9R1.58 NCC[C@@H]1C[C@@H](C1)OC 1P028ZDP [0,1,0,1,0,0|2,0,0]=4 3295 B9R1.58 OCCN1CC(C1)CC 1P01DW5W [0,1,0,1,0,0|2,0,0]=4 3296 B9R1.58 OCCN1CC(C1)CF 1P001JWU [0,1,0,1,0,0|2,0,0]=4 3297 B9R1.69 CC1CCC(=O)C(C1)C 1P008KX0 [0,1,0,1,0,0|1,0,1]=4 3298 B9R1.69 CC1CCC(C(C1)C)N 1P01AIDT [0,1,0,1,0,0|2,0,0]=4 3299 B9R1.69 CC1CCC(C(C1)C)O 1P00FCDH [0,1,0,1,0,0|1,0,0]=3 3300 B9R1.69 CC1CCC(C(C1)N)O 1P01AVGZ [0,1,0,1,0,0|2,0,0]=4 3301 B9R1.69 CC1CCC(C(C1)N)O 1P028UQE [0,1,0,1,0,0|2,0,0]=4 3302 B9R1.69 CC1CCC(C(C1)O)C 1P003GGI [0,1,0,1,0,0|1,0,0]=3 3303 B9R1.69 CC1CNC(C(C1)C)C 1P01AGF1 [0,1,0,1,0,0|2,0,0]=4 3304 B9R1.69 CC1NCC(C(C1)O)C 1P01E0AK [0,1,0,1,0,0|1,0,0]=3 3305 B9R1.69 NC1CCC(C(C1)C)C 1P01AKVY [0,1,0,1,0,0|2,0,0]=4 3306 B9R1.69 NC1CCC(C(C1)C)O 1P01B99H [0,1,0,1,0,0|1,0,0]=3 3307 B9R1.69 NC1CCN(C(C1)C)C 1P00GUYC [0,1,0,1,0,0|2,0,0]=4 3308 B9R1.69 N[C@@H]1CC[C@H]([C@@H](C1)O)C 1P021695 [0,1,0,1,0,0|1,0,0]=3 3309 B9R1.69 N[C@H]1CCN([C@@H](C1)C)C 1P01EI5Y [0,1,0,1,0,0|2,0,0]=4 3310 B9R1.69 N[C@H]1CCN([C@H](C1)C)C 1P01EI5U [0,1,0,1,0,0|2,0,0]=4 3311 B9R1.69 N[C@H]1CC[C@@H]([C@H](C1)O)C 1P028APT [0,1,0,1,0,0|1,0,0]=3 3312 B9R1.69 OC1CCC(C(C1)C)C 1P003IZD [0,1,0,1,0,0|1,0,0]=3 3313 B9R1.69 OC1CCC(C(C1)C)N 1P028ZC8 [0,1,0,1,0,0|1,0,0]=3 3314 B9R1.73 CCCC(C1CCC1)N 1P01C21H [0,1,0,1,0,0|2,0,0]=4 3315 B9R1.73 NCCC(N1CCC1)C 1P0292ON [0,1,0,1,0,0|2,0,0]=4 3316 B9R1.73 NCC[C@@H](C1CCC1)O 1P028BOV [0,1,0,1,0,0|1,1,0]=4 3317 B9R1.73 NCC[C@H](C1CCC1)O 1P028QYK [0,1,0,1,0,0|1,1,0]=4 3318 B9R1.73 OCCC(C1CCC1)N 1P01FIC4 [0,1,0,1,0,0|1,0,0]=3 3319 B9R1.73 OCCN(C1CCC1)C 1P01AMI3 [0,1,0,1,0,0|2,0,0]=4 3320 B9R1.73 OCCN(C1CNC1)C 1P027ZR2 [0,1,0,1,0,0|2,0,0]=4 3321 B9R1.100 C=CCCC(C1CC1)N 1P0291OM [0,1,0,1,0,0|2,0,0]=4 3322 B9R1.100 C=CCCC(C1CC1)O 1P01A2EC [0,1,0,1,0,0|1,1,0]=4 3323 B9R1.100 OCCCN(C1CC1)C 1P028A1H [0,1,0,1,0,0|2,0,0]=4 3324 B9R1.117 CCNCC1(O)CCC1 1P024MG0 [0,1,0,1,0,0|1,1,0]=4 3325 B9R1.117 CCSCC1(N)CCC1 1P028BXT [0,1,0,1,0,0|2,0,0]=4 3326 B9R1.117 COCCC1(C)CNC1 1P01BCB2 [0,1,0,1,0,0|2,0,0]=4 3327 B9R1.117 COCCC1(N)CCC1 1P01BHBV [0,1,0,1,0,0|1,0,0]=3 3328 B9R1.117 N#CCCC1(N)CCC1 1P028GJ9 [0,1,0,1,0,0|2,0,0]=4 3329 B9R1.117 NCCCC1(O)CCC1 1P01C47G [0,1,0,1,0,0|1,1,0]=4 3330 B9R1.117 NCCOC1(C)CCC1 1P01A2AB [0,1,0,1,0,0|2,0,0]=4 3331 B9R1.117 OCCCC1(O)CCC1 1P00ILEE [0,1,0,1,0,0|0,1,0]=3 3332 B9R1.134 BrCCC1(C)OCCO1 1P003F7P [0,1,0,1,0,0|2,0,0]=4 3333 B9R1.134 CCCC1(C)CNCC1 1P0046PY [0,1,0,1,0,0|2,0,0]=4 3334 B9R1.134 CCCC1(C)CNCC1 1P027V14 [0,1,0,1,0,0|2,0,0]=4 3335 B9R1.134 CNCC1(C)CCCO1 1P028N5T [0,1,0,1,0,0|2,0,0]=4 3336 B9R1.134 CNCC1(C)OCCO1 1P01DHHR [0,1,0,1,0,0|2,0,0]=4 3337 B9R1.134 CNCC1(O)COCC1 1P028X6I [0,1,0,1,0,0|1,1,0]=4 3338 B9R1.134 COCC1(N)COCC1 1P01C2S4 [0,1,0,1,0,0|2,0,0]=4 3339 B9R1.134 COCC1(N)COCC1 1P01C2S5 [0,1,0,1,0,0|2,0,0]=4 3340 B9R1.134 NCCC1(C)CCCC1 1P01BAXQ [0,1,0,1,0,0|2,0,0]=4 3341 B9R1.134 NCCC1(C)CCCO1 1P0282PR [0,1,0,1,0,0|1,1,0]=4 3342 B9R1.134 NCCC1(C)COCC1 1P0293BC [0,1,0,1,0,0|2,0,0]=4 3343 B9R1.134 NCCC1(C)OCCO1 1P00EDFB [0,1,0,1,0,0|2,0,0]=4 3344 B9R1.134 NCCC1(O)CCCC1 1P004WEU [0,1,0,1,0,0|1,1,0]=4 3345 B9R1.134 NCCC1(O)CCCC1 1P01BEOG [0,1,0,1,0,0|1,1,0]=4 3346 B9R1.134 NCCC1(O)COCC1 1P01C5VC [0,1,0,1,0,0|1,1,0]=4 3347 B9R1.134 OCCC1(C)CNCC1 1P028SS6 [0,1,0,1,0,0|1,0,0]=3 3348 B9R1.134 OCCC1(C)COCC1 1P027UYO [0,1,0,1,0,0|1,0,0]=3 3349 B9R1.134 OCCC1(C)OCCO1 1P003I1M [0,1,0,1,0,0|1,1,0]=4 3350 B9R1.134 OCCC1(N)CCCC1 1P01BAGI [0,1,0,1,0,0|1,0,0]=3 3351 B9R1.134 OCCC1(N)COCC1 1P01BFCH [0,1,0,1,0,0|1,0,0]=3 3352 B9R1.154 C=CCC1C(N)CC1O 1P028WZL [0,1,0,1,0,0|1,0,1]=4 3353 B9R1.3 CC1C(C)CCCC1N 1P00BZID [0,1,0,1,0,0|2,0,0]=4 3354 B9R1.3 CC1C(C)CCCC1O 1P001MVK [0,1,0,1,0,0|1,0,0]=3 3355 B9R1.3 CC1CCCC(C1N)C 1P00FBUJ [0,1,0,1,0,0|2,0,0]=4 3356 B9R1.3 CC1CCCC(C1N)C 1P019MFB [0,1,0,1,0,0|2,0,0]=4 3357 B9R1.3 CC1CCCC(C1O)C 1P0033IL [0,1,0,1,0,0|2,0,0]=4 3358 B9R1.3 NC1C(C)CCCC1O 1P02894C [0,1,0,1,0,0|1,0,0]=3 3359 B9R1.3 N[C@H]1[C@H](C)CCC[C@@H]1O 1P028XHG [0,1,0,1,0,0|1,0,0]=3 3360 B9R1.3 OC1C(O)CCCC1O 1P003DRA [0,1,0,1,0,0|0,1,0]=3 3361 B9R1.3 O[C@@H]1CCC[C@@H]([C@H]1N)O 1P01DTZW [0,1,0,1,0,0|0,1,0]=3 3362 B9R1.3 O[C@@H]1[C@@H](N)CCC[C@@H]1O 1P020107 [0,1,0,1,0,0|1,0,0]=3 3363 B9R1.3 O[C@@H]1[C@H](O)CNC[C@@H]1O 1P01B5PY [0,1,0,1,0,0|1,1,0]=4 3364 B9R1.3 O[C@@H]1[C@H](O)CNC[C@@H]1O 1P01B672 [0,1,0,1,0,0|1,1,0]=4 3365 B9R1.3 O[C@H]1[C@H](N)CCC[C@H]1O 1P028YI9 [0,1,0,1,0,0|1,0,0]=3 3366 B9R1.5 CC1CCCCCC1N 1P019STW [0,1,0,1,0,0|2,0,0]=4 3367 B9R1.5 CC1CCNCCC1O 1P00I1SS [0,1,0,1,0,0|1,1,0]=4 3368 B9R1.5 CC1CCOCCC1=O 1P028VX6 [0,1,0,1,0,0|0,1,1]=4 3369 B9R1.5 CC1CNCCCC1O 1P00I1P2 [0,1,0,1,0,0|1,1,0]=4 3370 B9R1.5 NC1CCCCCC1F 1P028KTG [0,1,0,1,0,0|2,0,0]=4 3371 B9R1.5 N[C@@H]1CCCCC[C@@H]1N 1P01EKHR [0,1,0,1,0,0|2,0,0]=4 3372 B9R1.5 N[C@@H]1CCCCC[C@H]1O 1P00C14K [0,1,0,1,0,0|1,1,0]=4 3373 B9R1.5 OC1CCNCCC1F 1P00I1PF [0,1,0,1,0,0|1,1,0]=4 3374 B9R1.5 O[C@@H]1CCCCC[C@H]1Br 1P027WTJ [0,1,0,1,0,0|1,1,0]=4 3375 B9R1.11 BrCC(C1CCCC1)F 1P028NFM [0,1,0,1,0,0|2,0,0]=4 3376 B9R1.11 BrCC(C1COCC1)F 1P0286OR [0,1,0,1,0,0|2,0,0]=4 3377 B9R1.11 BrCC(C1COCC1)O 1P028VQZ [0,1,0,1,0,0|2,0,0]=4 3378 B9R1.11 CCC(=O)C1COCC1 1P019SN3 [0,1,0,1,0,0|1,0,1]=4 3379 B9R1.11 CCC(C1CCCC1)N 1P01C1Y4 [0,1,0,1,0,0|2,0,0]=4 3380 B9R1.11 CCC(C1CCCN1)C 1P020192 [0,1,0,1,0,0|2,0,0]=4 3381 B9R1.11 CCC(C1CCCO1)N 1P01A384 [0,1,0,1,0,0|1,1,0]=4 3382 B9R1.11 CCC(C1CNCC1)C 1P01DXU7 [0,1,0,1,0,0|2,0,0]=4 3383 B9R1.11 CCC(C1COCC1)N 1P019SN0 [0,1,0,1,0,0|1,0,0]=3 3384 B9R1.11 CCC([C@@H]1CCCN1)O 1P027YOB [0,1,0,1,0,0|2,0,0]=4 3385 B9R1.11 CCC([C@H]1CCCN1)O 1P028OGY [0,1,0,1,0,0|2,0,0]=4 3386 B9R1.11 CC[C@H](C1COCC1)O 1P01BVBQ [0,1,0,1,0,0|1,0,0]=3 3387 B9R1.11 NCC(C1CCCC1)C 1P0289AT [0,1,0,1,0,0|2,0,0]=4 3388 B9R1.11 NCC(C1CCCC1)N 1P01BEYS [0,1,0,1,0,0|2,0,0]=4 3389 B9R1.11 NCC(C1CCCC1)O 1P01AJVW [0,1,0,1,0,0|2,0,0]=4 3390 B9R1.11 NCC(C1CCCO1)O 1P01BVIS [0,1,0,1,0,0|1,1,0]=4 3391 B9R1.11 NCC(C1COCC1)O 1P01AJZ8 [0,1,0,1,0,0|2,0,0]=4 3392 B9R1.11 OCC(C1CCCC1)F 1P028NX9 [0,1,0,1,0,0|1,0,0]=3 3393 B9R1.11 OCC(C1CCCC1)N 1P00ASQI [0,1,0,1,0,0|1,0,0]=3 3394 B9R1.11 OCC(C1CCCN1)O 1P028IUX [0,1,0,1,0,0|1,0,0]=3 3395 B9R1.11 OCC(C1COCC1)C 1P027OEA [0,1,0,1,0,0|2,0,0]=4 3396 B9R1.11 OCC(C1COCC1)F 1P028UIT [0,1,0,1,0,0|2,0,0]=4 3397 B9R1.11 OCC(C1COCC1)N 1P003GT5 [0,1,0,1,0,0|2,0,0]=4 3398 B9R1.11 OCC(C1COCC1)N 1P019ZM5 [0,1,0,1,0,0|2,0,0]=4 3399 B9R1.11 OCC(N1CCCC1)C 1P00J9Q2 [0,1,0,1,0,0|2,0,0]=4 3400 B9R1.11 OC[C@@H](N1CCCC1)C 1P00F9PW [0,1,0,1,0,0|2,0,0]=4 3401 B9R1.11 OC[C@H](N1CCCC1)C 1P00BAC0 [0,1,0,1,0,0|2,0,0]=4 3402 B9R1.82 OCC([C@@H]1C[C@@H](C1)N)F 1P028VWV [0,1,0,1,0,0|2,0,0]=4 3403 B9R1.101 OCC(C(C1CC1)N)O 1P0287AT [0,1,0,1,0,0|1,0,0]=3 3404 B9R1.132 OC[C@@H]1NC[C@H]([C@H]1O)O 1P028N36 [0,1,0,1,0,0|1,1,0]=4 3405 B9R1.132 OC[C@H]1NC[C@H]([C@@H]1O)O 1P008Z39 [0,1,0,1,0,0|1,1,0]=4 3406 B9R1.186 OCC(C1(N)CCC1)O 1P027W49 [0,1,0,1,0,0|1,0,0]=3 3407 B9R1.202 CC1(CO)CNCC1C 1P01B7AV [0,1,0,1,0,0|2,0,0]=4 3408 B9R1.202 CCC1(C)NCCC1O 1P0283X8 [0,1,0,1,0,0|1,1,0]=4 3409 B9R1.202 NCC1(C)CCCC1C 1P01BZPZ [0,1,0,1,0,0|2,0,0]=4 3410 B9R1.202 NCC1(C)CCCC1O 1P028V3J [0,1,0,1,0,0|1,1,0]=4 3411 B9R1.202 OCC1(C)CCCC1N 1P01AL7G [0,1,0,1,0,0|1,0,0]=3 3412 B9R1.202 OCC1(C)CCCN1C 1P028AMM [0,1,0,1,0,0|2,0,0]=4 3413 B9R1.202 OC[C@]1(C)CCCN1C 1P027OMC [0,1,0,1,0,0|2,0,0]=4 3414 B9R1.202 OC[C@]1(C)CCC[C@H]1N 1P028WX2 [0,1,0,1,0,0|1,0,0]=3 3415 B9R1.13 CC(=O)CC1COCC1 1P019Z4V [0,1,0,1,0,0|1,0,1]=4 3416 B9R1.13 CC(CC1CCCC1)N 1P007FVO [0,1,0,1,0,0|2,0,0]=4 3417 B9R1.13 CC(CC1CCCN1)C 1P0094TE [0,1,0,1,0,0|2,0,0]=4 3418 B9R1.13 CC(CC1CCCN1)O 1P01A2LX [0,1,0,1,0,0|1,0,0]=3 3419 B9R1.13 CC(CC1CCCO1)N 1P01A9VY [0,1,0,1,0,0|1,1,0]=4 3420 B9R1.13 CC(CC1CCCO1)O 1P028ZRN [0,1,0,1,0,0|0,1,0]=3 3421 B9R1.13 CC(CC1CNCC1)C 1P00J21P [0,1,0,1,0,0|2,0,0]=4 3422 B9R1.13 CC(CC1COCC1)Cl 1P01DWLS [0,1,0,1,0,0|1,0,0]=3 3423 B9R1.13 CC(CC1COCC1)N 1P01A08J [0,1,0,1,0,0|1,0,0]=3 3424 B9R1.13 CC(CN1CCCC1)O 1P00COOF [0,1,0,1,0,0|2,0,0]=4 3425 B9R1.13 CC(NC1COCC1)C 1P00HTKX [0,1,0,1,0,0|2,0,0]=4 3426 B9R1.13 CC(NC1COCC1)C 1P028DI8 [0,1,0,1,0,0|2,0,0]=4 3427 B9R1.13 C[C@@H](CN1CCCC1)O 1P009LB0 [0,1,0,1,0,0|2,0,0]=4 3428 B9R1.13 OB(CC1CCCC1)O 1P01C4QN [0,1,0,1,0,0|2,0,0]=4 3429 B9R1.13 OC(=O)CC1CCCC1 1P003PNA [0,1,0,1,0,0|1,0,1]=4 3430 B9R1.13 OC(=O)CC1CCCN1 1P005ESH [0,1,0,1,0,0|1,0,1]=4 3431 B9R1.13 OC(=O)CC1CCCO1 1P00BF6B [0,1,0,1,0,0|0,1,1]=4 3432 B9R1.13 OC(=O)C[C@@H]1CCCN1 1P0037NF [0,1,0,1,0,0|1,0,1]=4 3433 B9R1.13 OC(=O)C[C@@H]1CCCN1 1P003D1B [0,1,0,1,0,0|1,0,1]=4 3434 B9R1.13 OC(=O)C[C@H]1CCCN1 1P0038BU [0,1,0,1,0,0|1,0,1]=4 3435 B9R1.13 OC(=O)C[C@H]1CCCN1 1P00EKFJ [0,1,0,1,0,0|1,0,1]=4 3436 B9R1.13 OC(=O)C[C@H]1CCCO1 1P01C638 [0,1,0,1,0,0|0,1,1]=4 3437 B9R1.32 OCC1N(C)CC1(C)C 1P0284T6 [0,1,0,1,0,0|2,0,0]=4 3438 B9R1.34 CC1CC(C)CC(C1)Br 1P01BJEX [0,1,0,1,0,0|2,0,0]=4 3439 B9R1.34 CC1CC(C)CC(C1)I 1P004PLU [0,1,0,1,0,0|2,0,0]=4 3440 B9R1.34 CC1CC(C)CC(C1)N 1P00FG8S [0,1,0,1,0,0|2,0,0]=4 3441 B9R1.34 CC1CC(C)CC(C1)O 1P00DBHB [0,1,0,1,0,0|1,0,0]=3 3442 B9R1.34 CC1CC(C)NC(C1)C 1P00CC4I [0,1,0,1,0,0|2,0,0]=4 3443 B9R1.34 CN1CC(C)OC(C1)C 1P01B8LJ [0,1,0,1,0,0|2,0,0]=4 3444 B9R1.34 CN1C[C@H](C)O[C@@H](C1)C 1P028JHN [0,1,0,1,0,0|2,0,0]=4 3445 B9R1.34 C[C@@H]1C[C@H](C)N[C@@H](C1)C 1P01EJHL [0,1,0,1,0,0|2,0,0]=4 3446 B9R1.34 C[C@@H]1O[C@H](C)CC(=O)C1 1P001KYT [0,1,0,1,0,0|0,1,1]=4 3447 B9R1.34 NC1CC(C)NC(C1)C 1P01A2F4 [0,1,0,1,0,0|2,0,0]=4 3448 B9R1.34 NC1CC(C)SC(C1)C 1P0282GL [0,1,0,1,0,0|1,1,0]=4 3449 B9R1.34 N[C@@H]1C[C@@H](O)C[C@H](C1)O 1P028393 [0,1,0,1,0,0|0,1,0]=3 3450 B9R1.34 N[C@@H]1C[C@H](N)C[C@@H](C1)N 1P01XFND [0,1,0,1,0,0|2,0,0]=4 3451 B9R1.34 N[C@@H]1C[C@H](O)C[C@@H](C1)O 1P028JRL [0,1,0,1,0,0|0,1,0]=3 3452 B9R1.34 OC1CC(C)NC(C1)C 1P00AKWV [0,1,0,1,0,0|1,1,0]=4 3453 B9R1.34 OC1CC(C)OC(C1)C 1P00I8LX [0,1,0,1,0,0|0,1,0]=3 3454 B9R1.34 OC1CC(O)CC(C1)O 1P003DWW [0,1,0,1,0,0|0,1,0]=3 3455 B9R1.34 O[C@@H]1C[C@H](C)N[C@@H](C1)C 1P0206R8 [0,1,0,1,0,0|1,1,0]=4 3456 B9R1.34 O[C@@H]1C[C@H](O)C[C@@H](C1)O 1P003PDS [0,1,0,1,0,0|0,1,0]=3 3457 B9R1.41 CC(C1CCCC1N)C 1P01DXA2 [0,1,0,1,0,0|2,0,0]=4 3458 B9R1.41 CC(C1CCCC1N)C 1P01FJWO [0,1,0,1,0,0|2,0,0]=4 3459 B9R1.41 CC([C@@H]1CCCN1C)O 1P00CGYG [0,1,0,1,0,0|2,0,0]=4 3460 B9R1.41 CC([C@@H]1CCC[C@H]1C)O 1P028UII [0,1,0,1,0,0|1,0,0]=3 3461 B9R1.41 CC([C@@H]1CCC[C@H]1N)C 1P028JIR [0,1,0,1,0,0|2,0,0]=4 3462 B9R1.41 CC1CCCC1C(=O)O 1P00DC0Z [0,1,0,1,0,0|1,0,1]=4 3463 B9R1.41 C[C@@H]([C@@H]1CCCN1C)O 1P01JWLL [0,1,0,1,0,0|2,0,0]=4 3464 B9R1.41 C[C@H]([C@@H]1CCC[C@@H]1O)N 1P028JKQ [0,1,0,1,0,0|1,1,0]=4 3465 B9R1.41 FC([C@@H]1CCC[C@H]1N)F 1P028EOY [0,1,0,1,0,0|2,0,0]=4 3466 B9R1.41 NC1CCCC1C(=O)O 1P000Q69 [0,1,0,1,0,0|1,0,1]=4 3467 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O 1P000Y63 [0,1,0,1,0,0|1,0,1]=4 3468 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O 1P019E17 [0,1,0,1,0,0|1,0,1]=4 3469 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O 1P001QMO [0,1,0,1,0,0|1,0,1]=4 3470 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O 1P0039JU [0,1,0,1,0,0|1,0,1]=4 3471 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O 1P00ECRB [0,1,0,1,0,0|1,0,1]=4 3472 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O 1P00182K [0,1,0,1,0,0|1,0,1]=4 3473 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O 1P00ACEC [0,1,0,1,0,0|1,0,1]=4 3474 B9R1.41 OC1CCCC1C(=O)O 1P01AL3N [0,1,0,1,0,0|0,1,1]=4 3475 B9R1.41 O[C@@H]1CCC[C@@H]1C(=O)O 1P01FLSN [0,1,0,1,0,0|0,1,1]=4 3476 B9R1.41 O[C@@H]1CCC[C@H]1C(=O)O 1P002HAD [0,1,0,1,0,0|0,1,1]=4 3477 B9R1.41 O[C@H]1CCC[C@@H]1C(=O)O 1P0200WK [0,1,0,1,0,0|0,1,1]=4 3478 B9R1.41 O[C@H]1CCC[C@H]1C(=O)O 1P0020L2 [0,1,0,1,0,0|0,1,1]=4 3479 B9R1.41 SC1CCCC1C(=O)O 1P007UL0 [0,1,0,1,0,0|0,0,1]=3 3480 B9R1.53 CC(CN1CC(C1)O)C 1P00J2XK [0,1,0,1,0,0|2,0,0]=4 3481 B9R1.53 CC(O[C@@H]1C[C@@H](C1)O)C 1P01C1U4 [0,1,0,1,0,0|2,0,0]=4 3482 B9R1.53 CC1CC(C1)CC(=O)O 1P01JUW8 [0,1,0,1,0,0|1,0,1]=4 3483 B9R1.53 FC(CC1CC(C1)O)F 1P0289G8 [0,1,0,1,0,0|2,0,0]=4 3484 B9R1.53 O[C@@H]1C[C@@H](C1)CN(C)C 1P01E3VD [0,1,0,1,0,0|2,0,0]=4 3485 B9R1.53 O[C@@H]1C[C@@H](C1)CN(C)C 1P028255 [0,1,0,1,0,0|2,0,0]=4 3486 B9R1.53 O[C@@H]1C[C@H](C1)CN(C)C 1P0280O8 [0,1,0,1,0,0|2,0,0]=4 3487 B9R1.66 BrC1CCCC(C1)(C)C 1P01C61K [0,1,0,1,0,0|2,0,0]=4 3488 B9R1.66 BrC1CCCC(C1)(F)F 1P028VLV [0,1,0,1,0,0|2,0,0]=4 3489 B9R1.66 BrC1CCOC(C1)(C)C 1P01C35G [0,1,0,1,0,0|1,0,0]=3 3490 B9R1.66 C=C1CCOC(C1)(C)C 1P01J872 [0,1,0,1,0,0|1,0,1]=4 3491 B9R1.66 CC1CCCC(C1)(C)O 1P00IADK [0,1,0,1,0,0|1,0,0]=3 3492 B9R1.66 CC1CCNC(C1)(C)C 1P01BSL5 [0,1,0,1,0,0|2,0,0]=4 3493 B9R1.66 CC1NCCC(C1)(C)O 1P01BBB4 [0,1,0,1,0,0|1,1,0]=4 3494 B9R1.66 CC1NCCC(C1)(F)F 1P0014FJ [0,1,0,1,0,0|2,0,0]=4 3495 B9R1.66 CC1OCCC(C1)(C)O 1P01BS2Y [0,1,0,1,0,0|0,1,0]=3 3496 B9R1.66 C[C@@H]1NCCC(C1)(F)F 1P0204FH [0,1,0,1,0,0|2,0,0]=4 3497 B9R1.66 C[C@H]1NCCC(C1)(F)F 1P01XA6F [0,1,0,1,0,0|2,0,0]=4 3498 B9R1.66 IC1CCOC(C1)(C)C 1P01DNMH [0,1,0,1,0,0|1,0,0]=3 3499 B9R1.66 NC1CCCC(C1)(C)C 1P01A1W6 [0,1,0,1,0,0|2,0,0]=4 3500 B9R1.66 NC1CCCC(C1)(C)C 1P01JVEP [0,1,0,1,0,0|2,0,0]=4 3501 B9R1.66 NC1CCCC(C1)(F)F 1P00IHHZ [0,1,0,1,0,0|2,0,0]=4 3502 B9R1.66 NC1CCOC(C1)(C)C 1P003FSJ [0,1,0,1,0,0|1,0,0]=3 3503 B9R1.66 NC1CCOC(C1)(C)C 1P00H3HL [0,1,0,1,0,0|1,0,0]=3 3504 B9R1.66 NC1CCSC(C1)(C)C 1P01EJY6 [0,1,0,1,0,0|1,1,0]=4 3505 B9R1.66 N[C@@H]1CCCC(C1)(F)F 1P01JUPQ [0,1,0,1,0,0|2,0,0]=4 3506 B9R1.66 N[C@@H]1CCC[C@@](C1)(C)O 1P027Q01 [0,1,0,1,0,0|1,0,0]=3 3507 B9R1.66 N[C@H]1CCCC(C1)(F)F 1P01JUOA [0,1,0,1,0,0|2,0,0]=4 3508 B9R1.66 O=C1CCOC(C1)(C)C 1P000J5L [0,1,0,1,0,0|0,1,1]=4 3509 B9R1.66 OC1CCCC(C1)(C)C 1P005W25 [0,1,0,1,0,0|1,0,0]=3 3510 B9R1.66 OC1CCCC(C1)(F)F 1P01DY3B [0,1,0,1,0,0|1,0,0]=3 3511 B9R1.66 OC1CCCS(=O)(=O)C1 1P019YZG [0,1,0,1,0,0|1,1,0]=4 3512 B9R1.66 OC1CCNC(C1)(C)C 1P00IMRB [0,1,0,1,0,0|1,1,0]=4 3513 B9R1.66 OC1CCOC(C1)(C)C 1P002QEO [0,1,0,1,0,0|0,1,0]=3 3514 B9R1.66 OC1CNCC(C1)(F)F 1P01B29C [0,1,0,1,0,0|2,0,0]=4 3515 B9R1.66 SC1CCCS(=O)(=O)C1 1P01BY33 [0,1,0,1,0,0|1,0,1]=4 3516 B9R1.66 SC1CCOC(C1)(C)C 1P01EJ9V [0,1,0,1,0,0|0,0,0]=2 3517 B9R1.86 CC[C@@H]1C[C@H]1CC(=O)O 1P0285MJ [0,1,0,1,0,0|1,0,1]=4 3518 B9R1.136 NCCC1CC(C1)(C)C 1P028A0I [0,1,0,1,0,0|2,0,0]=4 3519 B9R1.136 OCCC1CC(C1)(F)F 1P00HB4Z [0,1,0,1,0,0|2,0,0]=4 3520 B9R1.137 CC(C1CC1)CC(=O)O 1P019Y4O [0,1,0,1,0,0|1,0,1]=4 3521 B9R1.137 NC(C1CC1)CC(=O)O 1P003JBL [0,1,0,1,0,0|1,0,1]=4 3522 B9R1.137 N[C@@H](C1CC1)CC(=O)O 1P01FIX5 [0,1,0,1,0,0|1,0,1]=4 3523 B9R1.137 N[C@H](C1CC1)CC(=O)O 1P01EM2U [0,1,0,1,0,0|1,0,1]=4 3524 B9R1.171 CC(CC1(O)CCC1)N 1P01FI7X [0,1,0,1,0,0|1,1,0]=4 3525 B9R1.171 OC(=O)CC1(C)CCC1 1P01FEY7 [0,1,0,1,0,0|1,0,1]=4 3526 B9R1.171 OC(=O)CC1(N)CCC1 1P00F2F3 [0,1,0,1,0,0|1,0,1]=4 3527 B9R1.171 OC(=O)CC1(N)CCC1 1P00J0SF [0,1,0,1,0,0|1,0,1]=4 3528 B9R1.171 OC(=O)CC1(O)CCC1 1P00II0W [0,1,0,1,0,0|0,1,1]=4 3529 B9R1.177 CSCC1(N)CC(C1)O 1P027ZY8 [0,1,0,1,0,0|2,0,0]=4 3530 B9R1.177 FCCC1(N)CC(C1)O 1P028FIJ [0,1,0,1,0,0|2,0,0]=4 3531 B9R1.177 FCCC1(N)CC(C1)O 1P028IQ8 [0,1,0,1,0,0|2,0,0]=4 3532 B9R1.181 CC1(CCO)CC1(F)Cl 1P01C4AS [0,1,0,1,0,0|2,0,0]=4 3533 B9R1.14 BrCC1CCCC1OC 1P027W7A [0,1,0,1,0,0|1,1,0]=4 3534 B9R1.14 CCC1NCCC1CO 1P01ALVW [0,1,0,1,0,0|1,1,0]=4 3535 B9R1.14 CNC1CCCC1SC 1P019TEX [0,1,0,1,0,0|2,0,0]=4 3536 B9R1.14 CSC1CCCC1C#N 1P01SDTC [0,1,0,1,0,0|1,0,1]=4 3537 B9R1.14 NCC1CCCC1CF 1P01FJW0 [0,1,0,1,0,0|2,0,0]=4 3538 B9R1.14 NCC1CCCC1OC 1P01A54G [0,1,0,1,0,0|1,1,0]=4 3539 B9R1.14 NC[C@@H]1CCC[C@H]1CF 1P028YLP [0,1,0,1,0,0|2,0,0]=4 3540 B9R1.14 OC[C@@H]1CCCN1C=O 1P01EWWO [0,1,0,1,0,0|1,1,0]=4 3541 B9R1.14 OC[C@@H]1CCCN1CC 1P00J36N [0,1,0,1,0,0|2,0,0]=4 3542 B9R1.14 OC[C@@H]1CCC[C@@H]1CO 1P01DX44 [0,1,0,1,0,0|0,1,0]=3 3543 B9R1.14 OC[C@@H]1CNC[C@@H]1CO 1P004R41 [0,1,0,1,0,0|1,1,0]=4 3544 B9R1.14 OC[C@@H]1CNC[C@H]1CO 1P00J2M2 [0,1,0,1,0,0|1,1,0]=4 3545 B9R1.14 OC[C@H]1CCCN1CC 1P01EMWX [0,1,0,1,0,0|2,0,0]=4 3546 B9R1.23 N#C[C@@H]1C[C@H]([C@@H](C1)N)O 1P028Q88 [0,1,0,1,0,0|2,0,0]=4 3547 B9R1.23 NCC1CC(C(C1)O)O 1P028R7W [0,1,0,1,0,0|2,0,0]=4 3548 B9R1.89 BrCC1CCCCCC1 1P00CLUM [0,1,0,1,0,0|2,0,0]=4 3549 B9R1.89 C#CC1CCCCCC1 1P01BB1Z [0,1,0,1,0,0|2,0,0]=4 3550 B9R1.89 CCC1CCNCCC1 1P00J2WU [0,1,0,1,0,0|2,0,0]=4 3551 B9R1.89 CCC1NCCOCC1 1P01FKV9 [0,1,0,1,0,0|2,0,0]=4 3552 B9R1.89 CNC1CCCCCC1 1P00C9CB [0,1,0,1,0,0|2,0,0]=4 3553 B9R1.89 CNC1CCCCCC1 1P00J29A [0,1,0,1,0,0|2,0,0]=4 3554 B9R1.89 CNC1CCNCCC1 1P01A2ZU [0,1,0,1,0,0|2,0,0]=4 3555 B9R1.89 CNC1CCOCCC1 1P027YFH [0,1,0,1,0,0|1,0,0]=3 3556 B9R1.89 CNC1CCOCCC1 1P0283L6 [0,1,0,1,0,0|1,0,0]=3 3557 B9R1.89 COC1CCNCCC1 1P001DB2 [0,1,0,1,0,0|1,1,0]=4 3558 B9R1.89 COC1CCNCCC1 1P0099PE [0,1,0,1,0,0|1,1,0]=4 3559 B9R1.89 CSC1CCCCNC1 1P01A1WQ [0,1,0,1,0,0|2,0,0]=4 3560 B9R1.89 CSC1CCNCCC1 1P01BHQQ [0,1,0,1,0,0|1,0,0]=3 3561 B9R1.89 N#CC1CCCCCC1 1P003PL1 [0,1,0,1,0,0|2,0,0]=4 3562 B9R1.89 N#CC1CCNCCC1 1P000PF0 [0,1,0,1,0,0|2,0,0]=4 3563 B9R1.89 N#CC1CCNCCC1 1P01JV26 [0,1,0,1,0,0|2,0,0]=4 3564 B9R1.89 N#CC1CCOCCC1 1P028KJY [0,1,0,1,0,0|1,0,0]=3 3565 B9R1.89 NCC1CCCCCC1 1P0025QO [0,1,0,1,0,0|2,0,0]=4 3566 B9R1.89 NCC1CCCCCC1 1P003PKW [0,1,0,1,0,0|2,0,0]=4 3567 B9R1.89 NCC1CCOCCC1 1P01BH2Q [0,1,0,1,0,0|1,0,0]=3 3568 B9R1.89 NCC1CCOCCC1 1P02889S [0,1,0,1,0,0|1,0,0]=3 3569 B9R1.89 NCC1CCSCCC1 1P01FJW1 [0,1,0,1,0,0|1,1,0]=4 3570 B9R1.89 NNC1CCCCCC1 1P008N3I [0,1,0,1,0,0|2,0,0]=4 3571 B9R1.89 NNC1CCCCCC1 1P01AB4Y [0,1,0,1,0,0|2,0,0]=4 3572 B9R1.89 O=CC1CCCCCC1 1P00C13Z [0,1,0,1,0,0|1,1,0]=4 3573 B9R1.89 O=CC1CCOCCC1 1P01C5M5 [0,1,0,1,0,0|0,1,0]=3 3574 B9R1.89 OCC1CCCCCC1 1P003PKV [0,1,0,1,0,0|1,1,0]=4 3575 B9R1.89 OCC1CCCCCC1 1P005B4A [0,1,0,1,0,0|1,1,0]=4 3576 B9R1.89 OCC1CCNCCC1 1P00I3QZ [0,1,0,1,0,0|1,1,0]=4 3577 B9R1.89 OCC1CCNCCC1 1P01AFMZ [0,1,0,1,0,0|1,1,0]=4 3578 B9R1.89 OCC1NCCOCC1 1P027YLH [0,1,0,1,0,0|1,1,0]=4 3579 B9R1.89 SCC1CCCCCC1 1P0285S4 [0,1,0,1,0,0|1,0,0]=3 3580 B9R1.89 [C-]#[N+]C1CCCCCC1 1P0080GG [0,1,0,1,0,0|2,0,0]=4 3581 B9R1.175 BrCCC1(CCC1)C#N 1P02938Z [0,1,0,1,0,0|2,0,0]=4 3582 B9R1.175 BrCCC1(CN)CCC1 1P027WXI [0,1,0,1,0,0|2,0,0]=4 3583 B9R1.175 CCCC1(CCC1)C#N 1P01A2RR [0,1,0,1,0,0|2,0,0]=4 3584 B9R1.175 CCCC1(CN)CCC1 1P005WXQ [0,1,0,1,0,0|2,0,0]=4 3585 B9R1.175 CCCC1(CN)CCC1 1P01A04A [0,1,0,1,0,0|2,0,0]=4 3586 B9R1.175 CCOC1(CS)CCC1 1P028ERQ [0,1,0,1,0,0|2,0,0]=4 3587 B9R1.175 FCCC1(CN)CCC1 1P028CH0 [0,1,0,1,0,0|2,0,0]=4 3588 B9R1.175 NCCC1(CO)CCC1 1P01C6X5 [0,1,0,1,0,0|1,1,0]=4 3589 B9R1.175 NCCC1(OC)CCC1 1P01AMM9 [0,1,0,1,0,0|1,1,0]=4 3590 B9R1.175 OCCC1(CC)CNC1 1P028CO7 [0,1,0,1,0,0|2,0,0]=4 3591 B9R1.175 OCCC1(CCC1)C#N 1P027WU8 [0,1,0,1,0,0|1,0,0]=3 3592 B9R1.175 OCCC1(CN)CCC1 1P00I0HG [0,1,0,1,0,0|1,0,0]=3 3593 B9R1.175 OCCC1(CO)CCC1 1P028KQY [0,1,0,1,0,0|0,1,0]=3 3594 B9R1.175 OCCC1(NC)CCC1 1P023Q4U [0,1,0,1,0,0|1,0,0]=3 3595 B9R1.175 OCCC1(NC)COC1 1P024TWV [0,1,0,1,0,0|2,0,0]=4 3596 B9R1.175 OCCC1(OC)CCC1 1P01BBXH [0,1,0,1,0,0|0,1,0]=3 3597 B9R1.175 OCCC1(OC)COC1 1P01KYL9 [0,1,0,1,0,0|1,1,0]=4 3598 B9R1.175 SCC1(CCC1)COC 1P0292YG [0,1,0,1,0,0|2,0,0]=4 3599 B9R1.182 CCCC1(CCC)OC1 1P0068EI [0,1,0,1,0,0|1,1,0]=4 3600 B9R1.182 NCCC1(CCO)N=N1 1P0222L4 [0,1,0,1,0,0|2,0,0]=4 3601 B9R1.182 OCCC1(CCO)CC1 1P00G675 [0,1,0,1,0,0|2,0,0]=4 3602 B9R1.182 OCCC1(CCO)N=N1 1P0222KZ [0,1,0,1,0,0|2,0,0]=4 3603 B9R1.24 BrCC1CCCC1(C)C 1P0291NB [0,1,0,1,0,0|2,0,0]=4 3604 B9R1.24 BrCC1CCCC1(F)F 1P01B75C [0,1,0,1,0,0|2,0,0]=4 3605 B9R1.24 ICC1OCCC1(C)C 1P01EME6 [0,1,0,1,0,0|2,0,0]=4 3606 B9R1.24 NCC1CCCC1(C)C 1P01ANDY [0,1,0,1,0,0|2,0,0]=4 3607 B9R1.24 NCC1CCCC1(F)F 1P01AV7T [0,1,0,1,0,0|2,0,0]=4 3608 B9R1.24 NCC1OCCC1(C)C 1P01FK7T [0,1,0,1,0,0|2,0,0]=4 3609 B9R1.24 NCC1OCCC1(C)C 1P028YJI [0,1,0,1,0,0|2,0,0]=4 3610 B9R1.24 OCC1CCCC1(C)C 1P01DWSZ [0,1,0,1,0,0|1,0,0]=3 3611 B9R1.24 OCC1CCCC1(F)F 1P01AMSH [0,1,0,1,0,0|1,0,0]=3 3612 B9R1.24 OCC1CCCS1(=O)=O 1P01B2MB [0,1,0,1,0,0|1,1,0]=4 3613 B9R1.24 OCC1CCNC1(C)C 1P01DW1E [0,1,0,1,0,0|2,0,0]=4 3614 B9R1.24 OCC1CCSC1(C)C 1P01DX5U [0,1,0,1,0,0|2,0,0]=4 3615 B9R1.24 OCC1CNCC1(C)C 1P028IKZ [0,1,0,1,0,0|2,0,0]=4 3616 B9R1.24 OCC1CNCC1(F)F 1P01JUHL [0,1,0,1,0,0|2,0,0]=4 3617 B9R1.24 OCC1NCCC1(F)F 1P01JV0V [0,1,0,1,0,0|2,0,0]=4 3618 B9R1.24 OCC1OCCC1(C)C 1P008LR1 [0,1,0,1,0,0|2,0,0]=4 3619 B9R1.24 OC[C@@H]1CCC[C@]1(C)N 1P009BZB [0,1,0,1,0,0|1,0,0]=3 3620 B9R1.30 NC[C@@H]1[C@@H](C1(F)F)CO 1P0291UL [0,1,0,1,0,0|2,0,0]=4 3621 B9R1.30 OC[C@@H]1[C@@H](C1(C)C)CO 1P027IYL [0,1,0,1,0,0|2,0,0]=4 3622 B9R1.30 OC[C@@H]1[C@@H](C1(F)F)CO 1P028YR5 [0,1,0,1,0,0|2,0,0]=4 3623 B9R1.36 O[C@@H]1CC(C[C@@H]1O)(F)F 1P0205AR [0,1,0,1,0,0|2,0,0]=4 3624 B9R1.109 NCCC(C1CC1)(C)C 1P01AMS6 [0,1,0,1,0,0|2,0,0]=4 3625 B9R1.109 NCCC(C1CC1)(O)C 1P01BMX7 [0,1,0,1,0,0|1,1,0]=4 3626 B9R1.148 CC1(C)CCNCCC1 1P00ANO6 [0,1,0,1,0,0|2,0,0]=4 3627 B9R1.148 CC1(C)CCNCCC1 1P01ALGZ [0,1,0,1,0,0|2,0,0]=4 3628 B9R1.148 CC1(C)NCCOCC1 1P028N9F [0,1,0,1,0,0|2,0,0]=4 3629 B9R1.148 CC1(N)CCCCCC1 1P005VEE [0,1,0,1,0,0|2,0,0]=4 3630 B9R1.148 CC1(N)CCCCCC1 1P00J25J [0,1,0,1,0,0|2,0,0]=4 3631 B9R1.148 CC1(O)CCCCCC1 1P003I5P [0,1,0,1,0,0|1,1,0]=4 3632 B9R1.148 CC1(O)CCNCCC1 1P00FGYJ [0,1,0,1,0,0|1,1,0]=4 3633 B9R1.148 CC1(O)CCNCCC1 1P00H3JP [0,1,0,1,0,0|1,1,0]=4 3634 B9R1.148 CC1(O)CCOCCC1 1P01A09E [0,1,0,1,0,0|0,1,0]=3 3635 B9R1.148 FC1(F)CCNCCC1 1P00IL62 [0,1,0,1,0,0|2,0,0]=4 3636 B9R2.8 OC1CC2CC(C1)C2 1P020MJ6 [0,0,0,2,0,0|1,0,0]=3 3637 B9R2.18 N[C@@H]1CC[C@@H]2[C@H]1[C@H]2F 1P027YBO [0,0,0,2,0,0|2,0,0]=4 3638 B9R2.21 NC1CCC2C(C1)C2 1P01C5FS [0,0,0,2,0,0|2,0,0]=4 3639 B9R2.21 NC1CCC2C(C1)C2 1P01C5FT [0,0,0,2,0,0|2,0,0]=4 3640 B9R2.39 Br[C@H]1C[C@H]2C[C@@H]1CC2 1P003R11 [0,0,0,2,0,0|2,0,0]=4 3641 B9R2.39 CC1CC2CC1C=C2 1P003NCL [0,0,0,2,0,0|2,0,0]=4 3642 B9R2.39 C[C@@H]1C[C@@H]2C[C@H]1CN2 1P027Z14 [0,0,0,2,0,0|2,0,0]=4 3643 B9R2.39 NC1CC2CC1CC2 1P001IOX [0,0,0,2,0,0|2,0,0]=4 3644 B9R2.39 NC1CC2CC1CC2 1P0050EX [0,0,0,2,0,0|2,0,0]=4 3645 B9R2.39 NC1CC2OC1CC2 1P00HSYM [0,0,0,2,0,0|1,0,0]=3 3646 B9R2.39 NC1CC2OC1CC2 1P020AL1 [0,0,0,2,0,0|1,0,0]=3 3647 B9R2.39 N[C@@H]1C[C@@H]2C[C@H]1CC2 1P003BXR [0,0,0,2,0,0|2,0,0]=4 3648 B9R2.39 N[C@@H]1C[C@@H]2C[C@H]1CO2 1P0285NP [0,0,0,2,0,0|1,0,0]=3 3649 B9R2.39 N[C@@H]1C[C@@H]2O[C@H]1CC2 1P0289Y5 [0,0,0,2,0,0|1,0,0]=3 3650 B9R2.39 N[C@@H]1C[C@H]2C[C@@H]1CC2 1P00ENQX [0,0,0,2,0,0|2,0,0]=4 3651 B9R2.39 N[C@@H]1C[C@H]2C[C@@H]1OC2 1P028I4S [0,0,0,2,0,0|2,0,0]=4 3652 B9R2.39 N[C@@H]1C[C@H]2O[C@@H]1CC2 1P01EI6G [0,0,0,2,0,0|1,0,0]=3 3653 B9R2.39 N[C@@H]1C[C@H]2O[C@@H]1CC2 1P0292LF [0,0,0,2,0,0|1,0,0]=3 3654 B9R2.39 N[C@H]1C[C@@H]2C[C@H]1CC2 1P00J3D2 [0,0,0,2,0,0|2,0,0]=4 3655 B9R2.39 N[C@H]1C[C@H]2O[C@@H]1CC2 1P01DTQS [0,0,0,2,0,0|1,0,0]=3 3656 B9R2.39 O=C1CC2OC1CC2 1P01C1RJ [0,0,0,2,0,0|0,1,1]=4 3657 B9R2.39 OC1CC2CC1C=C2 1P000VFJ [0,0,0,2,0,0|1,0,1]=4 3658 B9R2.39 OC1CC2CC1CC2 1P001UBO [0,0,0,2,0,0|1,0,0]=3 3659 B9R2.39 OC1CC2CC1CN2 1P00267R [0,0,0,2,0,0|1,0,0]=3 3660 B9R2.39 OC1CC2CC1CO2 1P0292UW [0,0,0,2,0,0|0,1,0]=3 3661 B9R2.39 OC1CC2CC1NC2 1P002DF8 [0,0,0,2,0,0|2,0,0]=4 3662 B9R2.39 OC1CN2CC1CC2 1P019TGP [0,0,0,2,0,0|2,0,0]=4 3663 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CN2 1P01XAIE [0,0,0,2,0,0|1,0,0]=3 3664 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1OC2 1P0282HQ [0,0,0,2,0,0|2,0,0]=4 3665 B9R2.39 O[C@@H]1C[C@H]2N[C@@H]1CC2 1P0026TT [0,0,0,2,0,0|1,0,0]=3 3666 B9R2.39 O[C@@H]1C[C@H]2O[C@@H]1CC2 1P01EN8K [0,0,0,2,0,0|0,1,0]=3 3667 B9R2.39 O[C@H]1C[C@@H]2C[C@H]1CN2 1P01XAI1 [0,0,0,2,0,0|1,0,0]=3 3668 B9R2.39 O[C@H]1C[C@H]2C[C@@H]1CC2 1P003R19 [0,0,0,2,0,0|1,0,0]=3 3669 B9R2.39 O[C@H]1C[C@H]2C[C@@H]1NC2 1P01JVKU [0,0,0,2,0,0|2,0,0]=4 3670 B9R2.39 O[C@H]1C[C@H]2N[C@@H]1CC2 1P00230T [0,0,0,2,0,0|1,0,0]=3 3671 B9R2.39 S[C@@H]1C[C@@H]2C[C@H]1CC2 1P028U6O [0,0,0,2,0,0|1,0,0]=3 3672 B9R2.68 C1CC2CCC(C1)N2 1P003760 [0,0,0,2,0,0|2,0,0]=4 3673 B9R2.68 C1CC2CCC(C1)N2 1P00BI7R [0,0,0,2,0,0|2,0,0]=4 3674 B9R2.68 C1CC2CCC(N1)C2 1P01QMBT [0,0,0,2,0,0|2,0,0]=4 3675 B9R2.68 C1CC2NCC(O1)C2 1P0291F3 [0,0,0,2,0,0|1,0,0]=3 3676 B9R2.68 C1C[C@H]2NC[C@@H](C1)C2 1P00BKCQ [0,0,0,2,0,0|2,0,0]=4 3677 B9R2.68 C1NC2COC(C1)C2 1P01FK89 [0,0,0,2,0,0|1,1,0]=4 3678 B9R2.68 N1CC2OCC(C1)C2 1P01A771 [0,0,0,2,0,0|2,0,0]=4 3679 B9R2.68 N1CC2SCC(C1)C2 1P01BBRL [0,0,0,2,0,0|2,0,0]=4 3680 B9R2.109 NC1CCCC2C1C2 1P01A2WU [0,0,0,2,0,0|2,0,0]=4 3681 B9R2.109 O=C1CCCC2C1O2 1P005RRW [0,0,0,2,0,0|0,1,1]=4 3682 B9R2.109 OC1CCNC2C1C2 1P0206VP [0,0,0,2,0,0|1,1,0]=4 3683 B9R2.109 O[C@@H]1COC[C@H]2[C@@H]1C2 1P027XLG [0,0,0,2,0,0|2,0,0]=4 3684 B9R2.7 CC1CC2C1CNC2 1P028W5X [0,0,0,2,0,0|2,0,0]=4 3685 B9R2.7 NC1CC2C1CCC2 1P01EIIF [0,0,0,2,0,0|2,0,0]=4 3686 B9R2.7 N[C@@H]1C[C@@H]2[C@H]1CCO2 1P01EI5P [0,0,0,2,0,0|1,0,0]=3 3687 B9R2.7 N[C@H]1C[C@@H]2[C@H]1CCO2 1P00J3AR [0,0,0,2,0,0|1,0,0]=3 3688 B9R2.7 OC1CC2C1CCC2 1P027W1R [0,0,0,2,0,0|1,0,0]=3 3689 B9R2.7 OC1CC2C1CNC2 1P01B6Y3 [0,0,0,2,0,0|1,1,0]=4 3690 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CCN2 1P00J3QG [0,0,0,2,0,0|1,0,0]=3 3691 B9R2.7 O[C@@H]1C[C@H]2[C@@H]1CCC2 1P0280AG [0,0,0,2,0,0|1,0,0]=3 3692 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CCN2 1P00J3QE [0,0,0,2,0,0|1,0,0]=3 3693 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CNC2 1P00J3QR [0,0,0,2,0,0|1,1,0]=4 3694 B9R2.34 OC1CC2(C1)CC2N 1P01EMZF [0,0,0,2,0,0|2,0,0]=4 3695 B9R2.41 BrC1CC(C1)C2CC2 1P028HA6 [0,0,0,2,0,0|2,0,0]=4 3696 B9R2.41 OC1CC(C1)C2CC2 1P024VX4 [0,0,0,2,0,0|1,0,0]=3 3697 B9R2.41 OC1CN(C1)C2CC2 1P00JZ6T [0,0,0,2,0,0|2,0,0]=4 3698 B9R2.51 C1CCC2CC(C1)N2 1P027TRG [0,0,0,2,0,0|2,0,0]=4 3699 B9R2.51 C1COC2CC(N1)C2 1P027URP [0,0,0,2,0,0|2,0,0]=4 3700 B9R2.59 NCC1CC2CC1C2 1P028KL6 [0,0,0,2,0,0|2,0,0]=4 3701 B9R2.59 OCC1CC2CC1C2 1P028INT [0,0,0,2,0,0|1,0,0]=3 3702 B9R2.84 NCCC12CC(C1)C2 1P01XA5O [0,0,0,2,0,0|2,0,0]=4 3703 B9R2.84 OCCC12CC(C1)C2 1P01JUQH [0,0,0,2,0,0|1,0,0]=3 3704 B9R2.138 BrC1CC2(C1)CCC2 1P01B692 [0,0,0,2,0,0|2,0,0]=4 3705 B9R2.138 NC1CC2(C1)CCC2 1P001H90 [0,0,0,2,0,0|2,0,0]=4 3706 B9R2.138 NC1CC2(C1)CCO2 1P027U7K [0,0,0,2,0,0|2,0,0]=4 3707 B9R2.138 OC1CC2(C1)CCC2 1P001MVQ [0,0,0,2,0,0|1,0,0]=3 3708 B9R2.138 OC1CC2(C1)CCN2 1P0292EV [0,0,0,2,0,0|2,0,0]=4 3709 B9R2.138 OC1CC2(C1)CNC2 1P000OIL [0,0,0,2,0,0|2,0,0]=4 3710 B9R2.138 OC1CC2(C1)CNC2 1P001U73 [0,0,0,2,0,0|2,0,0]=4 3711 B9R2.138 OC1CC2(C1)COC2 1P00ABC9 [0,0,0,2,0,0|2,0,0]=4 3712 B9R2.138 OC1CC2(C1)CSC2 1P0203L7 [0,0,0,2,0,0|2,0,0]=4 3713 B9R2.138 SC1CC2(C1)CCC2 1P028E6J [0,0,0,2,0,0|1,1,0]=4 3714 B9R2.1 NC1CC12CCCC2 1P018SML [0,0,0,2,0,0|2,0,0]=4 3715 B9R2.1 NC1CC12COCC2 1P028CMG [0,0,0,2,0,0|2,0,0]=4 3716 B9R2.2 C1CCC(C1)C2CO2 1P008ATO [0,0,0,2,0,0|1,0,0]=3 3717 B9R2.2 C1CNC(C1)C2CC2 1P00DK8G [0,0,0,2,0,0|2,0,0]=4 3718 B9R2.2 C1CN[C@H](C1)C2CC2 1P01K4GS [0,0,0,2,0,0|2,0,0]=4 3719 B9R2.2 C1NCC(C1)C2CC2 1P000NFJ [0,0,0,2,0,0|2,0,0]=4 3720 B9R2.2 C1NCC(C1)C2CC2 1P0222UN [0,0,0,2,0,0|2,0,0]=4 3721 B9R2.2 C1OCC(C1)C2CO2 1P00J39R [0,0,0,2,0,0|2,0,0]=4 3722 B9R2.3 C1CC2C(C1)CNC2 1P003JEY [0,0,0,2,0,0|2,0,0]=4 3723 B9R2.3 C1CC2C(C1)CNC2 1P00EBYO [0,0,0,2,0,0|2,0,0]=4 3724 B9R2.3 C1C[C@@H]2[C@@H](C1)CNC2 1P01JUUU [0,0,0,2,0,0|2,0,0]=4 3725 B9R2.3 C1C[C@@H]2[C@H](C1)CCN2 1P002943 [0,0,0,2,0,0|2,0,0]=4 3726 B9R2.3 C1C[C@@H]2[C@H](C1)CCN2 1P01PVGA [0,0,0,2,0,0|2,0,0]=4 3727 B9R2.3 C1C[C@@H]2[C@H](C1)CNC2 1P001ET8 [0,0,0,2,0,0|2,0,0]=4 3728 B9R2.3 C1C[C@@H]2[C@H](C1)CNC2 1P00IHQT [0,0,0,2,0,0|2,0,0]=4 3729 B9R2.3 N1CC2C(C1)CCO2 1P00HGPR [0,0,0,2,0,0|2,0,0]=4 3730 B9R2.3 N1CC2C(C1)COC2 1P003AKW [0,0,0,2,0,0|2,0,0]=4 3731 B9R2.3 N1CC2C(C1)COC2 1P00ED86 [0,0,0,2,0,0|2,0,0]=4 3732 B9R2.3 N1C[C@@H]2[C@H](C1)CCO2 1P019FNH [0,0,0,2,0,0|2,0,0]=4 3733 B9R2.3 N1C[C@@H]2[C@H](C1)CCO2 1P01C1K3 [0,0,0,2,0,0|2,0,0]=4 3734 B9R2.3 N1C[C@@H]2[C@H](C1)COC2 1P00385O [0,0,0,2,0,0|2,0,0]=4 3735 B9R2.3 N1C[C@@H]2[C@H](C1)COC2 1P00ED80 [0,0,0,2,0,0|2,0,0]=4 3736 B9R2.3 N1C[C@H]2[C@H](C1)COC2 1P00ILQV [0,0,0,2,0,0|2,0,0]=4 3737 B9R2.3 N1C[C@H]2[C@H](C1)COC2 1P01JUWW [0,0,0,2,0,0|2,0,0]=4 3738 B9R2.3 O1C[C@@H]2[C@@H](C1)CCN2 1P028N1R [0,0,0,2,0,0|2,0,0]=4 3739 B9R2.65 BrCC1C2C1COC2 1P028S39 [0,0,0,2,0,0|2,0,0]=4 3740 B9R2.65 ClCC1C2C1CCC2 1P02889P [0,0,0,2,0,0|2,0,0]=4 3741 B9R2.65 NCC1C2C1CCC2 1P028KRZ [0,0,0,2,0,0|2,0,0]=4 3742 B9R2.65 NCC1C2C1COC2 1P01BB4E [0,0,0,2,0,0|2,0,0]=4 3743 B9R2.65 NC[C@@H]1[C@@H]2[C@H]1COC2 1P00ILXL [0,0,0,2,0,0|2,0,0]=4 3744 B9R2.65 OCC1C2C1CCC2 1P01BWGM [0,0,0,2,0,0|1,0,0]=3 3745 B9R2.65 OCC1C2C1CCO2 1P0204US [0,0,0,2,0,0|0,1,0]=3 3746 B9R2.65 OCC1C2C1CNC2 1P002XH6 [0,0,0,2,0,0|2,0,0]=4 3747 B9R2.65 OCC1C2C1COC2 1P00HW66 [0,0,0,2,0,0|2,0,0]=4 3748 B9R2.65 OCC1[C@@H]2[C@H]1CNC2 1P019GM6 [0,0,0,2,0,0|2,0,0]=4 3749 B9R2.65 OC[C@@H]1[C@@H]2[C@H]1CNC2 1P003ALU [0,0,0,2,0,0|2,0,0]=4 3750 B9R2.65 OC[C@@H]1[C@@H]2[C@H]1CNC2 1P00JQHF [0,0,0,2,0,0|2,0,0]=4 3751 B9R2.65 OC[C@@H]1[C@@H]2[C@H]1COC2 1P00HUOI [0,0,0,2,0,0|2,0,0]=4 3752 B9R2.65 SCC1C2C1CCC2 1P028B20 [0,0,0,2,0,0|1,1,0]=4 3753 B9R2.173 C1CC2(C1)CCCN2 1P003APB [0,0,0,2,0,0|2,0,0]=4 3754 B9R2.173 C1CC2(C1)CCCN2 1P01BF2W [0,0,0,2,0,0|2,0,0]=4 3755 B9R2.173 C1CC2(C1)CCCN2 1P01E7YK [0,0,0,2,0,0|2,0,0]=4 3756 B9R2.173 C1CC2(C1)CCCN2 1P01JPDD [0,0,0,2,0,0|2,0,0]=4 3757 B9R2.173 C1CC2(C1)CCNC2 1P003AB5 [0,0,0,2,0,0|2,0,0]=4 3758 B9R2.173 C1CC2(C1)CCNC2 1P00HYGM [0,0,0,2,0,0|2,0,0]=4 3759 B9R2.173 C1CC2(C1)CCNC2 1P019ZUD [0,0,0,2,0,0|2,0,0]=4 3760 B9R2.173 C1CC2(C1)NCCS2 1P01BKVW [0,0,0,2,0,0|2,0,0]=4 3761 B9R2.173 C1CCC2(C1)CCN2 1P00EKFU [0,0,0,2,0,0|2,0,0]=4 3762 B9R2.173 C1OCC2(C1)CNC2 1P003AMR [0,0,0,2,0,0|2,0,0]=4 3763 B9R2.173 C1OCC2(C1)CNC2 1P00CJ8U [0,0,0,2,0,0|2,0,0]=4 3764 B9R2.173 C1OCC2(C1)CNC2 1P00HUVM [0,0,0,2,0,0|2,0,0]=4 3765 B9R2.173 C1OCC2(C1)CNC2 1P01ANEC [0,0,0,2,0,0|2,0,0]=4 3766 B9R2.173 N1CCC2(C1)CCO2 1P000VK3 [0,0,0,2,0,0|2,0,0]=4 3767 B9R2.173 N1CCC2(C1)CCO2 1P01DUT4 [0,0,0,2,0,0|2,0,0]=4 3768 B9R2.173 N1CCC2(C1)CCO2 1P01FKW7 [0,0,0,2,0,0|2,0,0]=4 3769 B9R2.173 O1CCC2(C1)CCN2 1P00HYGX [0,0,0,2,0,0|2,0,0]=4 3770 B9R2.173 O1CCC2(C1)CCN2 1P01C41V [0,0,0,2,0,0|2,0,0]=4 3771 B9R2.5 F[C@@H]1CCC[C@@]12CO2 1P028LK1 [0,0,0,2,0,0|1,0,0]=3 3772 B9R2.5 NC1CCCC12CC2 1P01C0H8 [0,0,0,2,0,0|2,0,0]=4 3773 B9R2.5 OC1CCCC12CC2 1P020506 [0,0,0,2,0,0|1,1,0]=4 3774 B9R2.5 OC1COCC12OC2 1P028RI1 [0,0,0,2,0,0|1,1,0]=4 3775 B9R2.5 O[C@@H]1CCCC12CC2 1P023ND3 [0,0,0,2,0,0|1,1,0]=4 3776 B9R2.5 O[C@H]1CCCC12CC2 1P028T3H [0,0,0,2,0,0|1,1,0]=4 3777 B9R2.20 NC1CC[C@H]2[C@@H]1CC2 1P028WZP [0,0,0,2,0,0|2,0,0]=4 3778 B9R2.24 BrC1C2CCC1CC2 1P001129 [0,0,0,2,0,0|2,0,0]=4 3779 B9R2.24 NC1C2CCC1CC2 1P027URH [0,0,0,2,0,0|2,0,0]=4 3780 B9R2.24 O[C@@H]1[C@H]2CN[C@@H]1CO2 1P02876F [0,0,0,2,0,0|1,1,0]=4 3781 B9R2.24 O[C@H]1[C@@H]2CN[C@H]1CO2 1P01FI8D [0,0,0,2,0,0|1,1,0]=4 3782 B9R2.56 OCC12CNCC1C2 1P00HX1G [0,0,0,2,0,0|2,0,0]=4 3783 B9R2.56 OCC12COCC1C2 1P01B68W [0,0,0,2,0,0|2,0,0]=4 3784 B9R2.56 OCC12NCCC1C2 1P028LD1 [0,0,0,2,0,0|2,0,0]=4 3785 B9R2.56 OC[C@@]12CNC[C@@H]1C2 1P0284I8 [0,0,0,2,0,0|2,0,0]=4 3786 B9R2.56 OC[C@@]12COC[C@@H]1C2 1P0204YG [0,0,0,2,0,0|2,0,0]=4 3787 B9R2.56 OC[C@]12CNC[C@H]1C2 1P00J2WD [0,0,0,2,0,0|2,0,0]=4 3788 B9R2.56 OC[C@]12CNC[C@H]1C2 1P02847F [0,0,0,2,0,0|2,0,0]=4 3789 B9R2.56 OC[C@]12COC[C@H]1C2 1P01XC2J [0,0,0,2,0,0|2,0,0]=4 3790 B9R2.56 OC[C@]12NCC[C@H]1C2 1P027WXJ [0,0,0,2,0,0|2,0,0]=4 3791 B9R2.70 OC[C@@H]1CC[C@H]2[C@@H]1C2 1P027W12 [0,0,0,2,0,0|1,0,0]=3 3792 B9R2.70 OC[C@H]1NC[C@H]2[C@@H]1C2 1P0023NO [0,0,0,2,0,0|2,0,0]=4 3793 B9R2.123 Br[C@@H]1[C@@H]2[C@H]1CCCC2 1P01DVG6 [0,0,0,2,0,0|2,0,0]=4 3794 B9R2.123 NC1C2C1CCCC2 1P019UBT [0,0,0,2,0,0|2,0,0]=4 3795 B9R2.123 NC1C2C1CCCC2 1P01AF2T [0,0,0,2,0,0|2,0,0]=4 3796 B9R2.123 NC1C2C1CCOC2 1P01FJXI [0,0,0,2,0,0|1,0,0]=3 3797 B9R2.123 N[C@@H]1[C@@H]2[C@H]1CCCC2 1P01EIIG [0,0,0,2,0,0|2,0,0]=4 3798 B9R2.52 C1CCC2C(CC1)O2 1P002WAF [0,0,0,2,0,0|1,1,0]=4 3799 B9R2.153 NCC1CC12CCC2 1P01DW1N [0,0,0,2,0,0|2,0,0]=4 3800 B9R2.153 OCC1CC12CCC2 1P01BICP [0,0,0,2,0,0|1,0,0]=3 3801 B9R2.153 OCC1CC12CNC2 1P0281WA [0,0,0,2,0,0|2,0,0]=4 3802 B9R2.153 SCC1CC12CCC2 1P028DGO [0,0,0,2,0,0|1,1,0]=4 3803 B9R2.33 NC1C[C@@H]2[C@H](C1)CC2 1P028K61 [0,0,0,2,0,0|2,0,0]=4 3804 B9R2.6 CC12CCNCC1C2 1P00IL7Z [0,0,0,2,0,0|2,0,0]=4 3805 B9R2.6 NC12CCCCC1C2 1P00ILN6 [0,0,0,2,0,0|2,0,0]=4 3806 B9R2.6 N[C@@]12CCOC[C@@H]1C2 1P0288O9 [0,0,0,2,0,0|1,0,0]=3 3807 B9R2.87 NC(C1CC1)C2CC2 1P0038RK [0,0,0,2,0,0|2,0,0]=4 3808 B9R2.87 NC(C1CC1)C2CC2 1P003CGI [0,0,0,2,0,0|2,0,0]=4 3809 B9R2.87 OC(C1CC1)C2CC2 1P003PV4 [0,0,0,2,0,0|1,1,0]=4 3810 B9R2.118 NC1(CCC1)C2CC2 1P01E8J8 [0,0,0,2,0,0|2,0,0]=4 3811 B9R2.118 OC1(CCC1)C2CC2 1P027KBV [0,0,0,2,0,0|1,1,0]=4 3812 B9R2.118 OC1(COC1)C2CO2 1P028UTR [0,0,0,2,0,0|1,1,0]=4