0 B9R0.2 BrCCCCCCC(=O)C 1P01IQK0 [0,0,0,0,0,0|1,0,2]=3 1 B9R0.2 BrCCCCCCC(=O)O 1P0030VL [0,0,0,0,0,0|2,0,2]=4 2 B9R0.2 BrCCCCCOC(=O)C 1P001QP0 [0,0,0,0,0,0|2,0,1]=3 3 B9R0.2 C=CCCCCCC(=O)C 1P00E10B [0,0,0,0,0,0|0,0,4]=4 4 B9R0.2 CC(=O)NCCOCCBr 1P01ALI2 [0,0,0,0,0,0|3,0,1]=4 5 B9R0.2 CC(=O)OCCOCCCl 1P006YP5 [0,0,0,0,0,0|3,0,1]=4 6 B9R0.2 CC(=O)OCCOCCO 1P002KN7 [0,0,0,0,0,0|3,0,1]=4 7 B9R0.2 CCCC=CC=CC(=O)C 1P028NTR [0,0,0,0,0,0|0,0,2]=2 8 B9R0.2 CCCCC#CCC(=O)O 1P0202F5 [0,0,0,0,0,0|1,0,3]=4 9 B9R0.2 CCCCCC#CC(=O)O 1P003IAH [0,0,0,0,0,0|1,0,2]=3 10 B9R0.2 CCCCCCCC(=O)N 1P003TQ1 [0,0,0,0,0,0|1,0,2]=3 11 B9R0.2 CCCCCCCC(=O)O 1P000LTK [0,0,0,0,0,0|1,0,2]=3 12 B9R0.2 CCCCCCCC(=O)O 1P0084UG [0,0,0,0,0,0|1,0,2]=3 13 B9R0.2 CCCCCCCC(=O)O 1P00C261 [0,0,0,0,0,0|1,0,2]=3 14 B9R0.2 CCCCCCCC(=O)[O-] 1P002BYU [0,0,0,0,0,0|1,0,2]=3 15 B9R0.2 CCCCCCCC(=S)O 1P005MUY [0,0,0,0,0,0|1,0,3]=4 16 B9R0.2 CCCCCCCC(Br)C 1P003H97 [0,0,0,0,0,0|1,0,3]=4 17 B9R0.2 CCCCCCCC(C)C 1P003I6K [0,0,0,0,0,0|1,0,3]=4 18 B9R0.2 CCCCCCCC(O)C 1P003TQR [0,0,0,0,0,0|0,0,4]=4 19 B9R0.2 CCCCCCCN(C)C 1P00DEHQ [0,0,0,0,0,0|2,0,2]=4 20 B9R0.2 CCCCCCC[13C](=O)O 1P00EB19 [0,0,0,0,0,0|1,0,2]=3 21 B9R0.2 CCCCCCNC(=S)N 1P002LE1 [0,0,0,0,0,0|2,1,1]=4 22 B9R0.2 CCCCCCOC(=O)C 1P001HZT [0,0,0,0,0,0|1,0,1]=2 23 B9R0.2 CCCCCCOC(=O)Cl 1P003RDX [0,0,0,0,0,0|2,0,1]=3 24 B9R0.2 CCCCCCOC(=O)N 1P002LSP [0,0,0,0,0,0|2,0,1]=3 25 B9R0.2 CCCCCOCC(=O)O 1P01A8CF [0,0,0,0,0,0|2,0,1]=3 26 B9R0.2 CCCCC\C=C\B(O)O 1P00EC3G [0,0,0,0,0,0|2,0,1]=3 27 B9R0.2 CCCCC\C=C\C(=O)C 1P00348G [0,0,0,0,0,0|0,0,0]=0 28 B9R0.2 CCCCC\C=C\C(=O)O 1P003VDD [0,0,0,0,0,0|1,0,0]=1 29 B9R0.2 CCCCOCCC(=O)O 1P00FNFX [0,0,0,0,0,0|2,0,2]=4 30 B9R0.2 CCCCSCCC(=O)O 1P00C2MV [0,0,0,0,0,0|2,0,2]=4 31 B9R0.2 CCCOCCCC(=O)O 1P028OX8 [0,0,0,0,0,0|2,0,2]=4 32 B9R0.2 CCCOCCOC(=O)Cl 1P01AM09 [0,0,0,0,0,0|3,0,1]=4 33 B9R0.2 CCC\C=C\C=C\C(=O)O 1P006ZC7 [0,0,0,0,0,0|1,0,2]=3 34 B9R0.2 CCC\C=C\COC(=O)C 1P002QI7 [0,0,0,0,0,0|1,0,3]=4 35 B9R0.2 CCNCCCCC(=O)O 1P01BKR1 [0,0,0,0,0,0|2,0,2]=4 36 B9R0.2 CCOCCCCC(=O)O 1P024HT6 [0,0,0,0,0,0|2,0,2]=4 37 B9R0.2 CCOCCCNC(=O)N 1P019PIL [0,0,0,0,0,0|3,0,1]=4 38 B9R0.2 CCOCCOCC(=O)O 1P0053WB [0,0,0,0,0,0|3,0,1]=4 39 B9R0.2 CC\C=C/CCOC(=O)C 1P003RQD [0,0,0,0,0,0|1,0,3]=4 40 B9R0.2 CNCCCCCC(=O)O 1P0016VD [0,0,0,0,0,0|2,0,2]=4 41 B9R0.2 COCCCCCC(=O)O 1P00C9GI [0,0,0,0,0,0|2,0,2]=4 42 B9R0.2 COCCCCOC(=O)C 1P001N77 [0,0,0,0,0,0|2,0,1]=3 43 B9R0.2 CS(=O)C=CCCN=C=S 1P00E9ZF [0,0,0,0,0,0|3,0,1]=4 44 B9R0.2 CSCCCCCC(=O)O 1P01IG8G [0,0,0,0,0,0|2,0,2]=4 45 B9R0.2 ClCCCCCNC(=O)C 1P01BJF9 [0,0,0,0,0,0|2,0,1]=3 46 B9R0.2 ClCCCCCOC(=O)C 1P0029ON [0,0,0,0,0,0|2,0,1]=3 47 B9R0.2 NCCCCCCC(=O)C 1P01C3V1 [0,0,0,0,0,0|1,0,2]=3 48 B9R0.2 NCCCCCCC(=O)O 1P003NTK [0,0,0,0,0,0|2,0,2]=4 49 B9R0.2 NCCCCCCC(=O)O 1P003NTM [0,0,0,0,0,0|2,0,2]=4 50 B9R0.2 NCCCCCNC(=O)C 1P003SM2 [0,0,0,0,0,0|2,0,1]=3 51 B9R0.2 NCCCCCNC(=O)C 1P009SKF [0,0,0,0,0,0|2,0,1]=3 52 B9R0.2 NCCCCNCC(=O)C 1P028TKH [0,0,0,0,0,0|2,0,1]=3 53 B9R0.2 NCCCC\C=C\C(=O)O 1P028PA8 [0,0,0,0,0,0|2,0,0]=2 54 B9R0.2 NCCSCCC=C(C)C 1P028KK9 [0,0,0,0,0,0|3,0,1]=4 55 B9R0.2 OCCCCCCC(=O)N 1P01QB8W [0,0,0,0,0,0|2,0,2]=4 56 B9R0.2 OCCCCCCC(=O)O 1P0034V2 [0,0,0,0,0,0|2,0,2]=4 57 B9R0.2 OCCCCNCC(=O)O 1P00I01L [0,0,0,0,0,0|3,0,1]=4 58 B9R0.2 SCCCCCCC(=O)O 1P00E2S1 [0,0,0,0,0,0|2,0,2]=4 59 B8R0.4 CCCCCC=CC=O 1P002OF1 [1,0,0,0,0,0|0,0,0]=1 60 B8R0.4 CCCCCCCC=C 1P000LUB [1,0,0,0,0,0|0,0,3]=4 61 B8R0.4 CCCCCCCC=O 1P000LU9 [1,0,0,0,0,0|0,0,2]=3 62 B8R0.4 CCCCCCCNC 1P003TIJ [1,0,0,0,0,0|1,0,2]=4 63 B8R0.4 CCCCCCN=C=O 1P003RDZ [1,0,0,0,0,0|1,0,2]=4 64 B8R0.4 CCCCC\C=C\C=O 1P003CH1 [1,0,0,0,0,0|0,0,0]=1 65 B8R0.4 CCCCC\C=C\CO 1P003VDB [1,0,0,0,0,0|0,0,2]=3 66 B8R0.4 CCCCN=CCCC 1P00E0N1 [1,0,0,0,0,0|1,0,2]=4 67 B8R0.4 CCC\C=C\C=C\C=O 1P0030BR [1,0,0,0,0,0|0,0,2]=3 68 B8R0.4 CCOCCOCC=O 1P01B6Z8 [1,0,0,0,0,0|2,0,1]=4 69 B8R0.4 COCCCCCC=O 1P02890L [1,0,0,0,0,0|1,0,2]=4 70 B8R0.4 OCCCC\C=C/CC 1P003PG7 [1,0,0,0,0,0|1,0,1]=3 71 B8R0.7 BrCCCCCC(=O)C 1P01AV5V [1,0,0,0,0,0|1,0,1]=3 72 B8R0.7 BrCCCCCC(=O)Cl 1P0039BS [1,0,0,0,0,0|2,0,1]=4 73 B8R0.7 BrCCCCCC(=O)N 1P00EADM [1,0,0,0,0,0|2,0,1]=4 74 B8R0.7 BrCCCCCC(=O)O 1P003NLF [1,0,0,0,0,0|2,0,1]=4 75 B8R0.7 BrCCCCOC(=O)C 1P0034F1 [1,0,0,0,0,0|2,0,0]=3 76 B8R0.7 BrCCOCCC(=O)C 1P01FIMW [1,0,0,0,0,0|2,0,1]=4 77 B8R0.7 C#CCCCSC(=O)C 1P024LZE [1,0,0,0,0,0|1,0,2]=4 78 B8R0.7 C=CCCCCC(=O)C 1P00D0BP [1,0,0,0,0,0|0,0,3]=4 79 B8R0.7 CC#CCCCC(=O)C 1P01HMO4 [1,0,0,0,0,0|0,0,3]=4 80 B8R0.7 CCCCC#CC(=O)O 1P001G2G [1,0,0,0,0,0|1,0,2]=4 81 B8R0.7 CCCCC=CC(=O)C 1P001XGQ [1,0,0,0,0,0|0,0,0]=1 82 B8R0.7 CCCCC=CC(=O)O 1P002ENX [1,0,0,0,0,0|1,0,0]=2 83 B8R0.7 CCCCCCC(=N)N 1P028G7P [1,0,0,0,0,0|2,0,1]=4 84 B8R0.7 CCCCCCC(=O)C 1P003IAB [1,0,0,0,0,0|0,0,1]=2 85 B8R0.7 CCCCCCC(=O)Cl 1P003QE1 [1,0,0,0,0,0|1,0,1]=3 86 B8R0.7 CCCCCCC(=O)N 1P0037KH [1,0,0,0,0,0|1,0,1]=3 87 B8R0.7 CCCCCCC(=O)O 1P003RBO [1,0,0,0,0,0|1,0,1]=3 88 B8R0.7 CCCCCCC(=O)[O-] 1P0002NY [1,0,0,0,0,0|1,0,1]=3 89 B8R0.7 CCCCCCC(Br)C 1P00IAED [1,0,0,0,0,0|1,0,2]=4 90 B8R0.7 CCCCCCC(C)C 1P003I6O [1,0,0,0,0,0|1,0,2]=4 91 B8R0.7 CCCCCCC(N)C 1P003H0D [1,0,0,0,0,0|1,0,2]=4 92 B8R0.7 CCCCCCC(O)C 1P000KE8 [1,0,0,0,0,0|0,0,3]=4 93 B8R0.7 CCCCCCN(=O)=O 1P003F13 [1,0,0,0,0,0|2,0,1]=4 94 B8R0.7 CCCCCC[C@@H](O)C 1P003CXP [1,0,0,0,0,0|0,0,3]=4 95 B8R0.7 CCCCCC[C@H](N)C 1P003CPO [1,0,0,0,0,0|1,0,2]=4 96 B8R0.7 CCCCCC[C@H](O)C 1P003CSG [1,0,0,0,0,0|0,0,3]=4 97 B8R0.7 CCCCCNC(C)C 1P019MGM [1,0,0,0,0,0|2,0,1]=4 98 B8R0.7 CCCCCOC(=O)C 1P0034XL [1,0,0,0,0,0|1,0,0]=2 99 B8R0.7 CCCCCOC(=O)Cl 1P003PAE [1,0,0,0,0,0|2,0,0]=3 100 B8R0.7 CCCCCOC(=S)[S-] 1P003OCT [1,0,0,0,0,0|2,1,0]=4 101 B8R0.7 CCCCNCC(=O)N 1P019NIT [1,0,0,0,0,0|2,0,1]=4 102 B8R0.7 CCCCNCC(=O)O 1P00J7X7 [1,0,0,0,0,0|2,0,1]=4 103 B8R0.7 CCCCOCC(=O)Cl 1P028I2X [1,0,0,0,0,0|2,0,1]=4 104 B8R0.7 CCCCOCC(=O)O 1P002R5S [1,0,0,0,0,0|2,0,1]=4 105 B8R0.7 CCCCSCC(=O)O 1P002AX9 [1,0,0,0,0,0|2,0,1]=4 106 B8R0.7 CCCC\C=C\B(O)O 1P00C1EK [1,0,0,0,0,0|2,0,1]=4 107 B8R0.7 CCCC\C=C\C(=O)C 1P0076C0 [1,0,0,0,0,0|0,0,0]=1 108 B8R0.7 CCCNCCC(=O)O 1P01ELYG [1,0,0,0,0,0|2,0,1]=4 109 B8R0.7 CCCOCCC(=O)O 1P002BD9 [1,0,0,0,0,0|2,0,1]=4 110 B8R0.7 CCCSCCC(=O)Cl 1P028IX2 [1,0,0,0,0,0|2,0,1]=4 111 B8R0.7 CCCS\C=C/C(=O)O 1P028EBP [1,0,0,0,0,0|2,0,0]=3 112 B8R0.7 CCNCCCC(=O)O 1P002K4U [1,0,0,0,0,0|2,0,1]=4 113 B8R0.7 CCOCCCC(=O)O 1P019NUT [1,0,0,0,0,0|2,0,1]=4 114 B8R0.7 CCOCCNC(=O)N 1P019ZX5 [1,0,0,0,0,0|3,0,0]=4 115 B8R0.7 CCOCCOC(=O)Cl 1P00E93I [1,0,0,0,0,0|3,0,0]=4 116 B8R0.7 CC\C=C\C=C\C(=O)O 1P028PCP [1,0,0,0,0,0|1,0,2]=4 117 B8R0.7 CNCCCCC(=O)O 1P01DX5C [1,0,0,0,0,0|2,0,1]=4 118 B8R0.7 CNCCCNC(=O)C 1P01AJNL [1,0,0,0,0,0|2,0,0]=3 119 B8R0.7 COCCCCC(=O)O 1P006CGN [1,0,0,0,0,0|2,0,1]=4 120 B8R0.7 COCCCNC(=O)N 1P007DUD [1,0,0,0,0,0|3,0,0]=4 121 B8R0.7 COCCCOC(=O)C 1P01BITH [1,0,0,0,0,0|2,0,0]=3 122 B8R0.7 COCCCOC(=O)Cl 1P027VNF [1,0,0,0,0,0|3,0,0]=4 123 B8R0.7 COCCOCC(=O)C 1P0089H1 [1,0,0,0,0,0|2,0,1]=4 124 B8R0.7 CSCCCCC(=O)O 1P005LP5 [1,0,0,0,0,0|2,0,1]=4 125 B8R0.7 CSCCCOC(=O)C 1P001X2X [1,0,0,0,0,0|2,0,0]=3 126 B8R0.7 ClCCCCCC(=O)Cl 1P003NN4 [1,0,0,0,0,0|2,0,1]=4 127 B8R0.7 ClCCCCCC(=O)O 1P0034TE [1,0,0,0,0,0|2,0,1]=4 128 B8R0.7 ClCCCCNC(=O)C 1P01BKNG [1,0,0,0,0,0|2,0,0]=3 129 B8R0.7 ClCCCCOC(=O)C 1P0034GO [1,0,0,0,0,0|2,0,0]=3 130 B8R0.7 ClCOCCOC(=O)C 1P0077FB [1,0,0,0,0,0|3,0,0]=4 131 B8R0.7 FCCCCCC(=O)O 1P00CWI0 [1,0,0,0,0,0|2,0,1]=4 132 B8R0.7 ICCCCCC(=O)O 1P01I3B5 [1,0,0,0,0,0|2,0,1]=4 133 B8R0.7 N#CCCCCC(=O)C 1P01C3NZ [1,0,0,0,0,0|1,0,2]=4 134 B8R0.7 NCCCCCC(=O)C 1P00IKV4 [1,0,0,0,0,0|1,0,1]=3 135 B8R0.7 NCCCCCC(=O)N 1P00CN40 [1,0,0,0,0,0|2,0,1]=4 136 B8R0.7 NCCCCCC(=O)O 1P0034SA [1,0,0,0,0,0|2,0,1]=4 137 B8R0.7 NCCCCCC(=O)O 1P00D9C9 [1,0,0,0,0,0|2,0,1]=4 138 B8R0.7 NCCCCNC(=O)C 1P00244C [1,0,0,0,0,0|2,0,0]=3 139 B8R0.7 NCCCCNC(=O)C 1P003T5V [1,0,0,0,0,0|2,0,0]=3 140 B8R0.7 NCCCCNC(=O)N 1P01AJJ7 [1,0,0,0,0,0|3,0,0]=4 141 B8R0.7 NCCCCSC(=O)C 1P01XFJ1 [1,0,0,0,0,0|2,0,0]=3 142 B8R0.7 OCCCCCC(=O)N 1P01DN53 [1,0,0,0,0,0|2,0,1]=4 143 B8R0.7 OCCCCCC(=O)O 1P000INE [1,0,0,0,0,0|2,0,1]=4 144 B8R0.7 OCCCCCC(=O)[O-] 1P0036KW [1,0,0,0,0,0|2,0,1]=4 145 B8R0.7 OCCC\C=C\C(C)C 1P028X40 [1,0,0,0,0,0|2,0,1]=4 146 B8R0.7 OCCS\C=C/C(=O)O 1P028O4K [1,0,0,0,0,0|3,0,0]=4 147 B8R0.7 SCCCCCC(=O)O 1P0025EW [1,0,0,0,0,0|2,0,1]=4 148 B8R0.7 [O-]C(=O)C=CCCSC 1P028BF9 [1,0,0,0,0,0|2,0,0]=3 149 B8R0.7 [O-]CCCCCC(=O)O 1P00DYY3 [1,0,0,0,0,0|2,0,1]=4 150 B10R0.3 BrCC[C@H](CCC=C(C)C)C 1P006UQ5 [0,1,0,0,0,0|2,0,1]=4 151 B10R0.3 CCCC(CCCC(=O)C)C 1P01BVX1 [0,1,0,0,0,0|0,0,2]=3 152 B10R0.3 CCCC(CCCC(=O)O)C 1P01A0AJ [0,1,0,0,0,0|1,0,2]=4 153 B10R0.3 CCCC(CCOC(=O)C)S 1P00132H [0,1,0,0,0,0|1,0,1]=3 154 B10R0.3 OCCC(CCC=C(C)C)C 1P002TWQ [0,1,0,0,0,0|2,0,1]=4 155 B10R0.3 OCC[C@@H](CCC=C(C)C)C 1P00HCNB [0,1,0,0,0,0|2,0,1]=4 156 B10R0.3 OCC[C@H](CCC=C(C)C)C 1P0036ZV [0,1,0,0,0,0|2,0,1]=4 157 B10R0.4 BrCCCCCCCC(=O)O 1P0025H0 [0,1,0,0,0,0|1,0,2]=4 158 B10R0.4 CCCCCCC=CC(=O)O 1P0033VR [0,1,0,0,0,0|1,0,0]=2 159 B10R0.4 CCCCCCCCC(=O)C 1P00355G [0,1,0,0,0,0|0,0,2]=3 160 B10R0.4 CCCCCCCCC(=O)Cl 1P003TQU [0,1,0,0,0,0|1,0,2]=4 161 B10R0.4 CCCCCCCCC(=O)N 1P00846Q [0,1,0,0,0,0|1,0,2]=4 162 B10R0.4 CCCCCCCCC(=O)O 1P008436 [0,1,0,0,0,0|1,0,2]=4 163 B10R0.4 CCCCCCCCC(=O)[O-] 1P001CZ2 [0,1,0,0,0,0|1,0,2]=4 164 B10R0.4 CCCCCCCCS(=O)C 1P028UHO [0,1,0,0,0,0|1,0,2]=4 165 B10R0.4 CCCCCCCOC(=O)C 1P003RBQ [0,1,0,0,0,0|0,0,2]=3 166 B10R0.4 CCCCCCCOC(=O)Cl 1P003RBR [0,1,0,0,0,0|1,0,2]=4 167 B10R0.4 CCCCCCCOC(=O)N 1P01BVVT [0,1,0,0,0,0|1,0,2]=4 168 B10R0.4 CCCCCCOCC(=O)O 1P00EDND [0,1,0,0,0,0|1,0,2]=4 169 B10R0.4 CCCCCC\C=C\B(O)O 1P00BY3H [0,1,0,0,0,0|2,0,1]=4 170 B10R0.4 CCCCCC\C=C\C(=O)C 1P003JTL [0,1,0,0,0,0|0,0,0]=1 171 B10R0.4 CCCCCNCCC(=O)O 1P028U7J [0,1,0,0,0,0|1,0,2]=4 172 B10R0.4 CCCCC\C=C\CC(=O)O 1P003KAT [0,1,0,0,0,0|1,0,0]=2 173 B10R0.4 CCCCOCCOC(=O)C 1P003HA8 [0,1,0,0,0,0|1,0,1]=3 174 B10R0.4 CCOCCCCCC(=O)O 1P01BS9O [0,1,0,0,0,0|1,0,2]=4 175 B10R0.4 CNCCCCCCC(=O)O 1P006J34 [0,1,0,0,0,0|1,0,2]=4 176 B10R0.4 COCCOCCCC(=O)C 1P0285MG [0,1,0,0,0,0|1,0,2]=4 177 B10R0.4 CSCCCCCCC(=O)O 1P007BNP [0,1,0,0,0,0|1,0,2]=4 178 B10R0.4 ClCCCCCCCC(=O)O 1P027KB7 [0,1,0,0,0,0|1,0,2]=4 179 B10R0.4 ClCCCCCCOC(=O)C 1P00CN8A [0,1,0,0,0,0|1,0,1]=3 180 B10R0.4 NCCCCCCCC(=O)O 1P0001OY [0,1,0,0,0,0|1,0,2]=4 181 B10R0.4 NCCCCCCCC(=O)O 1P00BLJO [0,1,0,0,0,0|1,0,2]=4 182 B10R0.4 NCCCCCCNC(=O)C 1P00E415 [0,1,0,0,0,0|1,0,1]=3 183 B10R0.4 NCCCCCCNC(=O)O 1P006XFU [0,1,0,0,0,0|2,0,1]=4 184 B10R0.4 NCCCCCCOC(=O)C 1P0280XS [0,1,0,0,0,0|1,0,1]=3 185 B10R0.4 NCCCCCCSC(=O)C 1P01ADJ3 [0,1,0,0,0,0|1,0,1]=3 186 B10R0.4 OCCCCCCCC(=O)C 1P00BUQ9 [0,1,0,0,0,0|0,0,2]=3 187 B10R0.4 OCCCCCCCC(=O)O 1P005Y9C [0,1,0,0,0,0|1,0,2]=4 188 B10R0.6 C#CCCCC(=O)CC(=O)C 1P0283IF [0,1,0,0,0,0|0,0,3]=4 189 B10R0.6 CCCCCC(=O)OC(C)C 1P003TBZ [0,1,0,0,0,0|2,0,1]=4 190 B10R0.6 CCCCCC(CC(=O)C)C 1P00FHYK [0,1,0,0,0,0|0,0,2]=3 191 B10R0.6 CCCCCC(CC(=O)O)C 1P00EBFF [0,1,0,0,0,0|1,0,2]=4 192 B10R0.6 CCCCCC(CC(=O)O)O 1P009ARC [0,1,0,0,0,0|1,0,2]=4 193 B10R0.6 CCCCC[C@@H](CC(=O)O)O 1P00IY3K [0,1,0,0,0,0|1,0,2]=4 194 B10R0.6 CCCCC[C@H](CC(=O)O)O 1P0070VP [0,1,0,0,0,0|1,0,2]=4 195 B10R0.6 CCCCOC(=O)CC(=O)C 1P003O3S [0,1,0,0,0,0|1,0,1]=3 196 B10R0.6 COCCOC(=O)CC(=O)C 1P003I0S [0,1,0,0,0,0|2,0,1]=4 197 B10R0.22 CCCCCCCP(=O)(C)C 1P01I14U [0,1,0,0,0,0|1,0,2]=4 198 B10R0.22 CCCCCCOS(=O)(=O)C 1P001W6A [0,1,0,0,0,0|2,0,1]=4 199 B10R0.55 CCC(CCCCC(=O)O)C 1P00DA2H [0,1,0,0,0,0|1,0,2]=4 200 B10R0.55 CCC(CCCCC(=O)O)N 1P028DYY [0,1,0,0,0,0|1,0,2]=4 201 B10R0.74 BrCCCCCCC(=O)OC 1P00DA2P [0,1,0,0,0,0|1,0,2]=4 202 B10R0.74 BrCCCCCNC(=O)CN 1P01FT43 [0,1,0,0,0,0|2,0,1]=4 203 B10R0.74 CCCCCC#CC(=O)OC 1P0035MV [0,1,0,0,0,0|0,0,2]=3 204 B10R0.74 CCCCCCCC(=O)CC 1P003JTK [0,1,0,0,0,0|0,0,2]=3 205 B10R0.74 CCCCCCCC(=O)NN 1P00IBLL [0,1,0,0,0,0|1,0,2]=4 206 B10R0.74 CCCCCCCC(=O)NO 1P003TJ8 [0,1,0,0,0,0|1,0,2]=4 207 B10R0.74 CCCCCCCC(=O)N[O-] 1P003P5N [0,1,0,0,0,0|1,0,2]=4 208 B10R0.74 CCCCCCCC(=O)OC 1P003SI8 [0,1,0,0,0,0|0,0,2]=3 209 B10R0.74 CCCCCCCC(=O)OF 1P006Y7R [0,1,0,0,0,0|1,0,2]=4 210 B10R0.74 CCCCCCCN(N=O)C 1P001UJ2 [0,1,0,0,0,0|1,0,2]=4 211 B10R0.74 CCCCCCNC(=O)CCl 1P019PVI [0,1,0,0,0,0|1,0,1]=3 212 B10R0.74 CCCCCCOC(=O)C=C 1P002QKI [0,1,0,0,0,0|1,0,2]=4 213 B10R0.74 CCCCCCOC(=O)CS 1P00290R [0,1,0,0,0,0|1,0,1]=3 214 B10R0.74 CCCCC\C=C\C(=O)OC 1P003SJJ [0,1,0,0,0,0|0,0,0]=1 215 B10R0.74 CCOCCCNC(=O)CCl 1P008YLP [0,1,0,0,0,0|2,0,1]=4 216 B10R0.74 COC(=O)\C=C\CCCCN 1P028HI6 [0,1,0,0,0,0|1,0,0]=2 217 B10R0.74 ClCCCCCCC(=O)OC 1P002RXX [0,1,0,0,0,0|1,0,2]=4 218 B10R0.74 NCCCCCCC(=O)NC 1P0293CS [0,1,0,0,0,0|1,0,2]=4 219 B10R0.74 NCCCCCCC(=O)OC 1P0021XN [0,1,0,0,0,0|1,0,2]=4 220 B10R0.74 NCCCCCCC(=O)OC 1P0287A7 [0,1,0,0,0,0|1,0,2]=4 221 B10R0.74 OCCCCCCC(=O)OC 1P019FHS [0,1,0,0,0,0|1,0,2]=4 222 B10R0.75 CCCCCCC(=O)N(C)C 1P008V5K [0,1,0,0,0,0|2,0,1]=4 223 B10R0.75 CCCCCCC(C(=O)O)Br 1P002SU4 [0,1,0,0,0,0|1,0,2]=4 224 B10R0.75 CCCCCCC(C(=O)O)C 1P007KB5 [0,1,0,0,0,0|1,0,2]=4 225 B10R0.75 CCCCCCC(C(=O)O)F 1P001Q6N [0,1,0,0,0,0|1,0,2]=4 226 B10R0.75 CCCCCCC(C(=O)O)N 1P003H0E [0,1,0,0,0,0|1,0,2]=4 227 B10R0.75 CCCCCCC(C(=O)O)O 1P003HW1 [0,1,0,0,0,0|1,0,2]=4 228 B10R0.75 CCCCCC[C@@H](C(=O)O)N 1P000DOY [0,1,0,0,0,0|1,0,2]=4 229 B10R0.75 CCCCCC[C@H](C(=O)O)N 1P0083H5 [0,1,0,0,0,0|1,0,2]=4 230 B10R0.75 CCCCCNC(=O)C(Cl)C 1P019L62 [0,1,0,0,0,0|2,0,1]=4 231 B10R0.75 CCOCCOC(=O)C(=C)C 1P002OO9 [0,1,0,0,0,0|3,0,0]=4 232 B10R0.75 ClCCCCCC(=O)C(=O)O 1P004G1N [0,1,0,0,0,0|2,0,1]=4 233 B10R0.75 NCCCCCN(C(=O)C)O 1P01BHKJ [0,1,0,0,0,0|2,0,1]=4 234 B10R0.78 CCCCC(=CCC(=O)O)C 1P028FDC [0,1,0,0,0,0|1,0,2]=4 235 B10R0.78 CCCCC(CCC(=O)C)C 1P02885F [0,1,0,0,0,0|0,0,2]=3 236 B10R0.78 CCCCC(CCC(=O)O)C 1P003M8Z [0,1,0,0,0,0|1,0,2]=4 237 B10R0.78 CCCCC(CCC(=O)O)O 1P008OUG [0,1,0,0,0,0|1,0,2]=4 238 B10R0.97 CC(=CCC\C=C\C(=O)O)C 1P004COM [0,1,0,0,0,0|1,0,2]=4 239 B10R0.97 CC(CCC=CCC(=O)O)N 1P0292EH [0,1,0,0,0,0|1,0,2]=4 240 B10R0.97 CC(CCCCCC(=O)O)C 1P003879 [0,1,0,0,0,0|1,0,2]=4 241 B10R0.97 CC(CCCCCC(=O)O)O 1P00B3V8 [0,1,0,0,0,0|1,0,2]=4 242 B10R0.97 CC(CCCOCC(=O)O)C 1P019Y19 [0,1,0,0,0,0|2,0,1]=4 243 B10R1.10 CCCC1CC(=O)CCO1 1P01AIPQ [0,0,0,1,0,0|1,0,2]=4 244 B10R1.10 CCCC1CC=CC(=O)O1 1P007W4T [0,0,0,1,0,0|1,0,0]=2 245 B10R1.10 CCCC1CCCC(=O)O1 1P003N9J [0,0,0,1,0,0|1,0,2]=4 246 B10R1.10 CCOC1CCCC(=O)C1 1P00AF2G [0,0,0,1,0,0|1,0,2]=4 247 B10R1.10 COCC1CCNC(=O)C1 1P01BXX1 [0,0,0,1,0,0|2,0,1]=4 248 B10R1.10 NCCC1CCNC(=O)C1 1P028I51 [0,0,0,1,0,0|2,0,1]=4 249 B10R1.10 OCCC1CCNC(=O)C1 1P028OER [0,0,0,1,0,0|2,0,1]=4 250 B10R1.16 CCCCC1CCC(=O)O1 1P003R78 [0,0,0,1,0,0|1,0,2]=4 251 B10R1.16 CCCCC1CNC(=O)C1 1P027RAQ [0,0,0,1,0,0|1,0,1]=3 252 B10R1.16 CCCCN1C=C[NH+](C1)C 1P0020HV [0,0,0,1,0,0|3,0,0]=4 253 B10R1.16 CCCCN1C=C[NH+](C1)C 1P002STR [0,0,0,1,0,0|3,0,0]=4 254 B10R1.16 CCCC[n+]1ccn(c1)C 1P003376 [0,0,0,1,0,0|3,0,0]=4 255 B10R1.16 CCCC[n+]1ccn(c1)C 1P0033AA [0,0,0,1,0,0|3,0,0]=4 256 B10R1.16 CCCC[n+]1ccn(c1)C 1P003EMU [0,0,0,1,0,0|3,0,0]=4 257 B10R1.16 CCCC[n+]1ccn(c1)C 1P003EMV [0,0,0,1,0,0|3,0,0]=4 258 B10R1.16 CCCC[n+]1ccn(c1)C 1P003EMZ [0,0,0,1,0,0|3,0,0]=4 259 B10R1.16 CCCCn1cc[n+](c1)C 1P0020AM [0,0,0,1,0,0|3,0,0]=4 260 B10R1.16 CCCCn1cc[n+](c1)C 1P003375 [0,0,0,1,0,0|3,0,0]=4 261 B10R1.16 CCCCn1cc[n+](c1)C 1P003BI2 [0,0,0,1,0,0|3,0,0]=4 262 B10R1.16 CCCCn1cc[n+](c1)C 1P003EMX [0,0,0,1,0,0|3,0,0]=4 263 B10R1.16 CCCCn1cc[n+](c1)C 1P003EMY [0,0,0,1,0,0|3,0,0]=4 264 B10R1.16 CCCCn1cc[n+](c1)C 1P003EN1 [0,0,0,1,0,0|3,0,0]=4 265 B10R1.16 CCCCn1cc[n+](c1)C 1P003EN2 [0,0,0,1,0,0|3,0,0]=4 266 B10R1.16 CCCCn1cc[n+](c1)C 1P003EN3 [0,0,0,1,0,0|3,0,0]=4 267 B10R1.16 CCCCn1cc[n+](c1)C 1P003EN4 [0,0,0,1,0,0|3,0,0]=4 268 B10R1.16 CCCCn1cc[n+](c1)C 1P003EN5 [0,0,0,1,0,0|3,0,0]=4 269 B10R1.16 CCCCn1cc[n+](c1)C 1P005BB2 [0,0,0,1,0,0|3,0,0]=4 270 B10R1.16 CCCCn1cc[n+](c1)C 1P00I5SN [0,0,0,1,0,0|3,0,0]=4 271 B10R1.16 CCNCc1ccc(o1)C 1P00J2EX [0,0,0,1,0,0|1,0,2]=4 272 B10R1.16 Cc1ccc(s1)CCCN 1P00016G [0,0,0,1,0,0|1,1,1]=4 273 B10R1.16 Cc1ccn(n1)CCCN 1P00EALH [0,0,0,1,0,0|3,0,0]=4 274 B10R1.18 CC(=O)C=C1CCCCC1 1P01A5S0 [0,0,0,1,0,0|0,0,0]=1 275 B10R1.18 CC(=O)CC1CCCCC1 1P003PM0 [0,0,0,1,0,0|0,0,2]=3 276 B10R1.18 CC(=O)CC1CCCCN1 1P01I82G [0,0,0,1,0,0|1,0,2]=4 277 B10R1.18 CC(=O)CC1CCCCO1 1P001074 [0,0,0,1,0,0|1,0,2]=4 278 B10R1.18 CC(=O)CC1CCCOC1 1P028Z8C [0,0,0,1,0,0|1,0,2]=4 279 B10R1.18 CC(=O)CC1CCNCC1 1P00G7J0 [0,0,0,1,0,0|1,0,2]=4 280 B10R1.18 CC(=O)CC1CCOCC1 1P018SDW [0,0,0,1,0,0|1,0,2]=4 281 B10R1.18 CC(=O)CN1CCCCC1 1P0063EP [0,0,0,1,0,0|1,0,1]=3 282 B10R1.18 CC(=O)CN1CCCCC1 1P028FQ0 [0,0,0,1,0,0|1,0,1]=3 283 B10R1.18 CC(=O)CN1CCNCC1 1P01ASHW [0,0,0,1,0,0|2,0,1]=4 284 B10R1.18 CC(=O)CN1CCOCC1 1P0064UV [0,0,0,1,0,0|2,0,1]=4 285 B10R1.18 CC(=O)NC1CCCCC1 1P003AIC [0,0,0,1,0,0|1,0,1]=3 286 B10R1.18 CC(=O)NC1CCCNC1 1P003SVR [0,0,0,1,0,0|2,0,1]=4 287 B10R1.18 CC(=O)NC1CCCNC1 1P028E86 [0,0,0,1,0,0|2,0,1]=4 288 B10R1.18 CC(=O)NC1CCNCC1 1P003L2Z [0,0,0,1,0,0|2,0,1]=4 289 B10R1.18 CC(=O)NC1CCNCC1 1P00EL5C [0,0,0,1,0,0|2,0,1]=4 290 B10R1.18 CC(=O)OC1=CCCCC1 1P003EPT [0,0,0,1,0,0|1,0,1]=3 291 B10R1.18 CC(=O)OC1CCCNC1 1P019SO6 [0,0,0,1,0,0|2,0,1]=4 292 B10R1.18 CC(=O)OC1CCNCC1 1P00IJ3J [0,0,0,1,0,0|2,0,1]=4 293 B10R1.18 ClC(=O)CC1CCCCC1 1P003PM1 [0,0,0,1,0,0|1,0,2]=4 294 B10R1.18 ClC(=O)NC1CCCCC1 1P00E04S [0,0,0,1,0,0|2,0,1]=4 295 B10R1.18 ClC(=O)OC1CCCCC1 1P00117N [0,0,0,1,0,0|2,0,1]=4 296 B10R1.18 NC(=O)CC1CCCCC1 1P001MYY [0,0,0,1,0,0|1,0,2]=4 297 B10R1.18 NC(=O)NC1CCCCC1 1P003PMH [0,0,0,1,0,0|2,0,1]=4 298 B10R1.18 NC(=O)OC1CCCCC1 1P009M1X [0,0,0,1,0,0|2,0,1]=4 299 B10R1.18 OC(=O)C=C1CCCCC1 1P001O6J [0,0,0,1,0,0|1,0,0]=2 300 B10R1.18 OC(=O)C=C1CCNCC1 1P00G8PA [0,0,0,1,0,0|2,0,0]=3 301 B10R1.18 OC(=O)C=C1CCOCC1 1P000UQW [0,0,0,1,0,0|2,0,0]=3 302 B10R1.18 OC(=O)C=C1CCSCC1 1P01A4W1 [0,0,0,1,0,0|2,0,0]=3 303 B10R1.18 OC(=O)CC1=CCCCC1 1P0024QW [0,0,0,1,0,0|1,0,2]=4 304 B10R1.18 OC(=O)CC1CCCCC1 1P0039T4 [0,0,0,1,0,0|1,0,2]=4 305 B10R1.18 OC(=O)CN1CCCCC1 1P003F3Q [0,0,0,1,0,0|2,0,1]=4 306 B10R1.18 OC(=O)CN1CCCCC1 1P00C8MO [0,0,0,1,0,0|2,0,1]=4 307 B10R1.18 OC(=O)CN1CCCCC1 1P00J3XO [0,0,0,1,0,0|2,0,1]=4 308 B10R1.18 [O-][N+](=O)C=C1CCOCC1 1P007XGH [0,0,0,1,0,0|3,0,0]=4 309 B10R1.24 CCCCCC1CC(=O)C1 1P007HYO [0,0,0,1,0,0|0,0,2]=3 310 B10R1.39 CCC1CCNC1C(=O)O 1P01ELUU [0,0,0,1,0,0|2,0,1]=4 311 B10R1.39 CC[C@@H]1CCN[C@H]1C(=O)N 1P028MGU [0,0,0,1,0,0|2,0,1]=4 312 B10R1.39 CC[C@@H]1CCO[C@@H]1C(=O)O 1P01B6S5 [0,0,0,1,0,0|2,0,1]=4 313 B10R1.39 CCn1cccc1C(=O)C 1P0077WO [0,0,0,1,0,0|1,0,2]=4 314 B10R1.39 CCn1nccc1C(=O)C 1P005WF1 [0,0,0,1,0,0|2,0,1]=4 315 B10R1.39 NCC1CCCN1C(=O)C 1P027ZUE [0,0,0,1,0,0|2,0,1]=4 316 B10R1.39 OCC1CCCN1C(=O)C 1P002VBD [0,0,0,1,0,0|2,0,1]=4 317 B10R1.39 OC[C@@H]1CCCN1C(=O)C 1P00FXUU [0,0,0,1,0,0|2,0,1]=4 318 B10R1.39 OC[C@H]1CCCN1C(=O)C 1P01C3S3 [0,0,0,1,0,0|2,0,1]=4 319 B10R1.61 BrC1=C(CCCC1)C(=O)C 1P009YD9 [0,0,0,1,0,0|1,0,2]=4 320 B10R1.61 CC1CCCC=C1C(=O)O 1P00IAO0 [0,0,0,1,0,0|1,0,0]=2 321 B10R1.61 CC1CCCCC1C(=O)C 1P01ANMD [0,0,0,1,0,0|0,0,2]=3 322 B10R1.61 CC1CCCCC1C(=O)O 1P003I1W [0,0,0,1,0,0|1,0,2]=4 323 B10R1.61 CC1CCCCN1C(=O)Cl 1P00F7F3 [0,0,0,1,0,0|2,0,1]=4 324 B10R1.61 CC1CCCNC1C(=O)O 1P01BG17 [0,0,0,1,0,0|2,0,1]=4 325 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)O 1P01B2PG [0,0,0,1,0,0|2,0,1]=4 326 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O 1P01DFKN [0,0,0,1,0,0|2,0,1]=4 327 B10R1.64 OC(=O)C=C1CCCC1C 1P019Z0N [0,0,0,1,0,0|1,0,0]=2 328 B10R1.64 OC(=O)CC1CCCC1C 1P000D73 [0,0,0,1,0,0|1,0,2]=4 329 B10R1.64 OC(=O)CN1CCCC1C 1P01BCAO [0,0,0,1,0,0|2,0,1]=4 330 B10R1.66 CC(=O)CCC1CCCC1 1P01AKUJ [0,0,0,1,0,0|0,0,2]=3 331 B10R1.66 CC(=O)NCC1CCCN1 1P0283RW [0,0,0,1,0,0|2,0,1]=4 332 B10R1.66 CC(=O)NCC1CNCC1 1P01BBAV [0,0,0,1,0,0|2,0,1]=4 333 B10R1.66 CC(=O)NCC1CNCC1 1P01C52W [0,0,0,1,0,0|2,0,1]=4 334 B10R1.66 CC(=O)NCC1CSCC1 1P028APU [0,0,0,1,0,0|2,0,1]=4 335 B10R1.66 CC(=O)OCC1CCCO1 1P003V5M [0,0,0,1,0,0|2,0,1]=4 336 B10R1.66 CC(=O)SCC1CCCC1 1P01B1OM [0,0,0,1,0,0|1,0,1]=3 337 B10R1.66 ClC(=O)CCC1CCCC1 1P003JTJ [0,0,0,1,0,0|1,0,2]=4 338 B10R1.66 NC(=O)CNC1CCCC1 1P01ABG4 [0,0,0,1,0,0|2,0,1]=4 339 B10R1.66 NC(=O)\C=C\C1=NCCC1 1P00CTH0 [0,0,0,1,0,0|2,0,1]=4 340 B10R1.66 OB(\C=C\C1CCCC1)O 1P001SRK [0,0,0,1,0,0|2,0,1]=4 341 B10R1.66 OC(=O)C#CC1CCCC1 1P00EK2I [0,0,0,1,0,0|1,0,2]=4 342 B10R1.66 OC(=O)C=CC1CCCC1 1P009NUJ [0,0,0,1,0,0|1,0,0]=2 343 B10R1.66 OC(=O)CCC1CCCC1 1P001CDX [0,0,0,1,0,0|1,0,2]=4 344 B10R1.66 OC(=O)CNC1CCCC1 1P019VWN [0,0,0,1,0,0|2,0,1]=4 345 B10R1.66 OC(=O)CNC1CCCC1 1P01DJHL [0,0,0,1,0,0|2,0,1]=4 346 B10R1.66 OC(=O)COC1CCCC1 1P0033C1 [0,0,0,1,0,0|2,0,1]=4 347 B10R1.66 OC(=O)CSC1CCCC1 1P00DG2O [0,0,0,1,0,0|2,0,1]=4 348 B10R1.66 [O-][N+](=O)\C=C\C1CCCC1 1P00IKJQ [0,0,0,1,0,0|2,0,0]=3 349 B10R1.73 OC(=O)CCCC1CC1C 1P028O8W [0,0,0,1,0,0|1,0,2]=4 350 B10R1.77 CC1CCCCCC(=O)N1 1P028IQS [0,0,0,1,0,0|1,0,2]=4 351 B10R1.78 O=C1CCCCCCCC1 1P00C7CT [0,0,0,1,0,0|0,0,2]=3 352 B10R1.78 O=C1CCCCCCCN1 1P003H15 [0,0,0,1,0,0|1,0,1]=3 353 B10R1.126 OC(=O)CCCCC1CC1 1P00K991 [0,0,0,1,0,0|1,0,2]=4 354 B10R1.127 OC(=O)C=CCN1CCC1 1P028OJJ [0,0,0,1,0,0|2,0,0]=3 355 B10R1.127 OC(=O)CCCC1CCC1 1P01AMP5 [0,0,0,1,0,0|1,0,2]=4 356 B10R1.127 OC(=O)COCC1CCC1 1P028P2X [0,0,0,1,0,0|2,0,1]=4 357 B10R1.144 CCCCC1CC1C(=O)O 1P006ZHL [0,0,0,1,0,0|1,0,2]=4 358 B10R1.156 CC[C@@H]1C[C@H]1CNC(=O)N 1P028WUJ [0,0,0,1,0,0|2,0,1]=4 359 B10R1.162 COC1CCCNC(=O)C1 1P028FU0 [0,0,0,1,0,0|2,0,1]=4 360 B10R1.348 CC(=O)C1CCCCCC1 1P01A6Y8 [0,0,0,1,0,0|0,0,2]=3 361 B10R1.348 CC(=O)C1CCOCCC1 1P028J7Q [0,0,0,1,0,0|1,0,2]=4 362 B10R1.348 CC(=O)N1CCNCCC1 1P003T5N [0,0,0,1,0,0|2,0,1]=4 363 B10R1.348 CC(=O)N1CCNCCC1 1P0091EI [0,0,0,1,0,0|2,0,1]=4 364 B10R1.348 CC(=O)N1CCNCCC1 1P0284DU [0,0,0,1,0,0|2,0,1]=4 365 B10R1.348 CC(=O)N1CCOCCC1 1P028ZHG [0,0,0,1,0,0|2,0,1]=4 366 B10R1.348 CC(=O)N1OCCOCC1 1P028L13 [0,0,0,1,0,0|3,0,0]=4 367 B10R1.348 ClC(=O)C1CCCCCC1 1P006RTF [0,0,0,1,0,0|1,0,2]=4 368 B10R1.348 ClC(=O)N1CCCCCC1 1P002VB1 [0,0,0,1,0,0|2,0,1]=4 369 B10R1.348 NC(=O)C1CCCCCC1 1P00AYOE [0,0,0,1,0,0|1,0,2]=4 370 B10R1.348 NC(=O)C1CCCCCN1 1P027XSW [0,0,0,1,0,0|2,0,1]=4 371 B10R1.348 NC(=O)N1CCCCCC1 1P00FRJL [0,0,0,1,0,0|2,0,1]=4 372 B10R1.348 OC(=O)C1=CCCCCC1 1P019TE3 [0,0,0,1,0,0|1,0,0]=2 373 B10R1.348 OC(=O)C1=CCCOCC1 1P01C48Q [0,0,0,1,0,0|2,0,0]=3 374 B10R1.348 OC(=O)C1CCCCCC1 1P001E2H [0,0,0,1,0,0|1,0,2]=4 375 B10R1.348 OC(=O)C1CCCCCN1 1P006VWQ [0,0,0,1,0,0|2,0,1]=4 376 B10R1.348 OC(=O)C1CCCCCN1 1P01AKH0 [0,0,0,1,0,0|2,0,1]=4 377 B10R1.348 OC(=O)C1CCCCCO1 1P028XUW [0,0,0,1,0,0|2,0,1]=4 378 B10R1.348 OC(=O)[C@@H]1CCCCCN1 1P009E6I [0,0,0,1,0,0|2,0,1]=4 379 B10R1.348 OC(=O)[C@H]1CCCCCN1 1P01JUND [0,0,0,1,0,0|2,0,1]=4 380 B7R0.1 BrCCCCCC=C 1P0034UK [2,0,0,0,0,0|1,0,1]=4 381 B7R0.1 C=CCCCNCC 1P01EMH2 [2,0,0,0,0,0|1,0,1]=4 382 B7R0.1 CCC=CC=CC=O 1P00E9KG [2,0,0,0,0,0|0,0,2]=4 383 B7R0.1 CCCCCCC=C 1P0033AH [2,0,0,0,0,0|0,0,1]=3 384 B7R0.1 CCCCCCC=O 1P003RBK [2,0,0,0,0,0|0,0,1]=3 385 B7R0.1 CCCCCCNC 1P003TIY [2,0,0,0,0,0|1,0,1]=4 386 B7R0.1 CCCCCCNC 1P0071Q4 [2,0,0,0,0,0|1,0,1]=4 387 B7R0.1 CCCCCCOC 1P003TIU [2,0,0,0,0,0|1,0,1]=4 388 B7R0.1 CCCCCCSC 1P0028ZM [2,0,0,0,0,0|1,0,1]=4 389 B7R0.1 CCCCCN=C=O 1P003U2Z [2,0,0,0,0,0|1,0,1]=4 390 B7R0.1 CCCCOCC=C 1P003O6A [2,0,0,0,0,0|1,0,1]=4 391 B7R0.1 CCCCOCC=O 1P002VRW [2,0,0,0,0,0|1,0,1]=4 392 B7R0.1 CCCC\C=C\C=O 1P002H9Q [2,0,0,0,0,0|0,0,0]=2 393 B7R0.1 CC\C=C\C=C\C=O 1P003VBB [2,0,0,0,0,0|0,0,2]=4 394 B7R0.1 CNCCCCC=C 1P004T6Q [2,0,0,0,0,0|1,0,1]=4 395 B7R0.1 CNCCCCC=C 1P00DFP1 [2,0,0,0,0,0|1,0,1]=4 396 B7R0.1 COCCCCC=O 1P004U88 [2,0,0,0,0,0|1,0,1]=4 397 B7R0.1 CSCCCCC=O 1P028FY9 [2,0,0,0,0,0|1,0,1]=4 398 B7R0.1 ClCCCCCC=O 1P006UWS [2,0,0,0,0,0|1,0,1]=4 399 B7R0.1 ICCCCCC=C 1P00KGQU [2,0,0,0,0,0|1,0,1]=4 400 B7R0.1 NCCCCCC=C 1P01BBBF [2,0,0,0,0,0|1,0,1]=4 401 B7R0.1 O=CCCCOCC 1P0281KP [2,0,0,0,0,0|1,0,1]=4 402 B7R0.1 OCCCCCC=C 1P003NOS [2,0,0,0,0,0|1,0,1]=4 403 B7R0.1 OCCCCCC=O 1P00CLL5 [2,0,0,0,0,0|1,0,1]=4 404 B7R0.1 OCCCCOC=C 1P0026EY [2,0,0,0,0,0|2,0,0]=4 405 B7R0.1 OCCC\C=C/CC 1P003PFW [2,0,0,0,0,0|1,0,1]=4 406 B7R0.4 BrCCCCC(=C)C 1P028CFP [2,0,0,0,0,0|2,0,0]=4 407 B7R0.4 BrCCCCC(=O)C 1P0007J6 [2,0,0,0,0,0|1,0,0]=3 408 B7R0.4 BrCCCCC(=O)Cl 1P003N20 [2,0,0,0,0,0|2,0,0]=4 409 B7R0.4 BrCCCCC(=O)O 1P002J3W [2,0,0,0,0,0|2,0,0]=4 410 B7R0.4 BrCCCCC(=O)[O-] 1P00ERAQ [2,0,0,0,0,0|2,0,0]=4 411 B7R0.4 C#CCCCC(=O)C 1P01BVPS [2,0,0,0,0,0|0,0,2]=4 412 B7R0.4 CC(=O)NCCCBr 1P019XXZ [2,0,0,0,0,0|2,0,0]=4 413 B7R0.4 CC(=O)NCCCCl 1P001DGW [2,0,0,0,0,0|2,0,0]=4 414 B7R0.4 CC(=O)NCCCN 1P00CJ9K [2,0,0,0,0,0|2,0,0]=4 415 B7R0.4 CC(=O)NCCCN 1P00DL1J [2,0,0,0,0,0|2,0,0]=4 416 B7R0.4 CC(=O)NCCCO 1P009RY1 [2,0,0,0,0,0|2,0,0]=4 417 B7R0.4 CC(=O)OCCCCl 1P003JS4 [2,0,0,0,0,0|2,0,0]=4 418 B7R0.4 CC(=O)OCCCI 1P00EKA4 [2,0,0,0,0,0|2,0,0]=4 419 B7R0.4 CC(=O)SCCCCl 1P000UI6 [2,0,0,0,0,0|2,0,0]=4 420 B7R0.4 CC(=O)SCCCO 1P01DU4A [2,0,0,0,0,0|2,0,0]=4 421 B7R0.4 CCCC=CC(=O)C 1P003JZ4 [2,0,0,0,0,0|0,0,0]=2 422 B7R0.4 CCCCCC(=N)N 1P00J1UF [2,0,0,0,0,0|2,0,0]=4 423 B7R0.4 CCCCCC(=N)N 1P028M17 [2,0,0,0,0,0|2,0,0]=4 424 B7R0.4 CCCCCC(=O)C 1P0033SO [2,0,0,0,0,0|0,0,0]=2 425 B7R0.4 CCCCCC(=O)Cl 1P003RDM [2,0,0,0,0,0|1,0,0]=3 426 B7R0.4 CCCCCC(=O)N 1P003RDF [2,0,0,0,0,0|1,0,0]=3 427 B7R0.4 CCCCCC(=O)O 1P0035GM [2,0,0,0,0,0|1,0,0]=3 428 B7R0.4 CCCCCC(=O)[O-] 1P0002NZ [2,0,0,0,0,0|1,0,0]=3 429 B7R0.4 CCCCCC(=S)N 1P001WHQ [2,0,0,0,0,0|1,1,0]=4 430 B7R0.4 CCCCCC(C)C 1P003I61 [2,0,0,0,0,0|1,0,1]=4 431 B7R0.4 CCCCCC(N)C 1P000KEH [2,0,0,0,0,0|1,0,1]=4 432 B7R0.4 CCCCCC(O)C 1P00DX8F [2,0,0,0,0,0|0,0,2]=4 433 B7R0.4 CCCCCN(C)C 1P028LRM [2,0,0,0,0,0|2,0,0]=4 434 B7R0.4 CCCCC[C@@H](O)C 1P003CX9 [2,0,0,0,0,0|0,0,2]=4 435 B7R0.4 CCCCC[C@H](O)C 1P003CKJ [2,0,0,0,0,0|0,0,2]=4 436 B7R0.4 CCCCC[N+](=O)[O-] 1P00EG5W [2,0,0,0,0,0|2,0,0]=4 437 B7R0.4 CCCCNC(=O)C 1P007VII [2,0,0,0,0,0|1,0,0]=3 438 B7R0.4 CCCCNC(=O)Cl 1P00D7IO [2,0,0,0,0,0|2,0,0]=4 439 B7R0.4 CCCCNC(=O)N 1P0035TZ [2,0,0,0,0,0|2,0,0]=4 440 B7R0.4 CCCCOC(=O)C 1P000KEE [2,0,0,0,0,0|1,0,0]=3 441 B7R0.4 CCCCOC(=O)N 1P003TBD [2,0,0,0,0,0|2,0,0]=4 442 B7R0.4 CCCCSC(=O)C 1P003UQS [2,0,0,0,0,0|1,0,0]=3 443 B7R0.4 CCCCSC(=O)Cl 1P001A84 [2,0,0,0,0,0|2,0,0]=4 444 B7R0.4 CCCNCC(=O)N 1P01AM1O [2,0,0,0,0,0|2,0,0]=4 445 B7R0.4 CCCNCC(=O)O 1P019WR9 [2,0,0,0,0,0|2,0,0]=4 446 B7R0.4 CCCOCC(=O)O 1P00DDPU [2,0,0,0,0,0|2,0,0]=4 447 B7R0.4 CCCSCC(=O)C 1P01CANS [2,0,0,0,0,0|1,0,0]=3 448 B7R0.4 CCCSCC(=O)O 1P002AXA [2,0,0,0,0,0|2,0,0]=4 449 B7R0.4 CCC\C=C\C(=O)O 1P00HTPU [2,0,0,0,0,0|1,0,0]=3 450 B7R0.4 CCNCCC(=O)N 1P003IOR [2,0,0,0,0,0|2,0,0]=4 451 B7R0.4 CCNCCC(=O)O 1P019WSK [2,0,0,0,0,0|2,0,0]=4 452 B7R0.4 CCOC=CC(=O)Cl 1P01A0FZ [2,0,0,0,0,0|2,0,0]=4 453 B7R0.4 CCOC=CC(=O)O 1P003AAM [2,0,0,0,0,0|2,0,0]=4 454 B7R0.4 CCOCC=C(C)C 1P007Q3A [2,0,0,0,0,0|2,0,0]=4 455 B7R0.4 CCOCCC(=O)O 1P003JUP [2,0,0,0,0,0|2,0,0]=4 456 B7R0.4 CCO\C=C\C(=O)Cl 1P00IBEN [2,0,0,0,0,0|2,0,0]=4 457 B7R0.4 CCO\C=C\C(=O)O 1P001ERC [2,0,0,0,0,0|2,0,0]=4 458 B7R0.4 CCSCCC(=O)Cl 1P0286NR [2,0,0,0,0,0|2,0,0]=4 459 B7R0.4 CCSCCC(=O)O 1P00FDIY [2,0,0,0,0,0|2,0,0]=4 460 B7R0.4 CNCCCC(=O)O 1P0034AB [2,0,0,0,0,0|2,0,0]=4 461 B7R0.4 CNCCCC(=O)O 1P007DUH [2,0,0,0,0,0|2,0,0]=4 462 B7R0.4 CNCCNC(=O)C 1P01A2SE [2,0,0,0,0,0|2,0,0]=4 463 B7R0.4 CNCCNC(=O)C 1P01AF4E [2,0,0,0,0,0|2,0,0]=4 464 B7R0.4 CNC\C=C\C(=O)O 1P027WD3 [2,0,0,0,0,0|2,0,0]=4 465 B7R0.4 COCC=CC(=O)O 1P01DNM5 [2,0,0,0,0,0|2,0,0]=4 466 B7R0.4 COCCCC(=O)C 1P00B6HE [2,0,0,0,0,0|1,0,0]=3 467 B7R0.4 COCCCC(=O)N 1P027LNZ [2,0,0,0,0,0|2,0,0]=4 468 B7R0.4 COCCCC(=O)O 1P002VN5 [2,0,0,0,0,0|2,0,0]=4 469 B7R0.4 COC\C=C\C(=O)O 1P00EFQT [2,0,0,0,0,0|2,0,0]=4 470 B7R0.4 CSCC=CC(=O)O 1P028A6U [2,0,0,0,0,0|2,0,0]=4 471 B7R0.4 CSCCCC(=O)Cl 1P0286K0 [2,0,0,0,0,0|2,0,0]=4 472 B7R0.4 CSCCCC(=O)N 1P028VPN [2,0,0,0,0,0|2,0,0]=4 473 B7R0.4 CSCCCC(=O)O 1P00MDZI [2,0,0,0,0,0|2,0,0]=4 474 B7R0.4 C\C=C\C=C\C(=O)C 1P003GC2 [2,0,0,0,0,0|0,0,2]=4 475 B7R0.4 ClCCCCC(=O)C 1P0007J5 [2,0,0,0,0,0|1,0,0]=3 476 B7R0.4 ClCCCCC(=O)Cl 1P001PXW [2,0,0,0,0,0|2,0,0]=4 477 B7R0.4 ClCCCCC(=O)N 1P019Y9G [2,0,0,0,0,0|2,0,0]=4 478 B7R0.4 ClCCCCC(=O)O 1P0034Q2 [2,0,0,0,0,0|2,0,0]=4 479 B7R0.4 FCCCCC(=O)[O-] 1P02875F [2,0,0,0,0,0|2,0,0]=4 480 B7R0.4 FCCSCC(=O)C 1P01B2Y7 [2,0,0,0,0,0|2,0,0]=4 481 B7R0.4 ICCCCC(=O)O 1P027L56 [2,0,0,0,0,0|2,0,0]=4 482 B7R0.4 NCCCCC(=O)N 1P01A4SH [2,0,0,0,0,0|2,0,0]=4 483 B7R0.4 NCCCCC(=O)O 1P00390H [2,0,0,0,0,0|2,0,0]=4 484 B7R0.4 NCCCCC(=O)O 1P003MVH [2,0,0,0,0,0|2,0,0]=4 485 B7R0.4 NCCCCC(=O)O 1P00HZV1 [2,0,0,0,0,0|2,0,0]=4 486 B7R0.4 NCCCCC(=O)O 1P01FNTV [2,0,0,0,0,0|2,0,0]=4 487 B7R0.4 O=C(N)CCNCC 1P01KEQK [2,0,0,0,0,0|2,0,0]=4 488 B7R0.4 OCCCCC(=O)C 1P00BGAI [2,0,0,0,0,0|1,0,0]=3 489 B7R0.4 OCCCCC(=O)N 1P002ZKN [2,0,0,0,0,0|2,0,0]=4 490 B7R0.4 OCCCCC(=O)[O-] 1P003ALZ [2,0,0,0,0,0|2,0,0]=4 491 B7R0.4 OCCCCC(=O)[O-] 1P01AA46 [2,0,0,0,0,0|2,0,0]=4 492 B7R0.4 SCCCCC(=O)O 1P002ZTK [2,0,0,0,0,0|2,0,0]=4 493 B9R0.5 CCCCCC(=CCO)C 1P028SJY [1,1,0,0,0,0|0,0,2]=4 494 B9R0.5 CCCCCC(=O)OC=C 1P0030VB [1,1,0,0,0,0|1,0,1]=4 495 B9R0.5 CCCCCC(=O)OCC 1P000KDJ [1,1,0,0,0,0|1,0,1]=4 496 B9R0.45 CCCCCCCCC=O 1P000LU5 [1,1,0,0,0,0|0,0,2]=4 497 B9R0.45 CCCCCCCNC=O 1P00F2XX [1,1,0,0,0,0|0,0,2]=4 498 B9R0.45 CCCCCC\C=C/CO 1P003PEU [1,1,0,0,0,0|0,0,1]=3 499 B9R0.45 CCCCCC\C=C\C=O 1P002H9P [1,1,0,0,0,0|0,0,0]=2 500 B9R0.45 CCCCCC\C=C\CO 1P003VD9 [1,1,0,0,0,0|0,0,1]=3 501 B9R0.45 CCCCC\C=C/CCO 1P003PFK [1,1,0,0,0,0|0,0,1]=3 502 B9R0.45 CCCCC\C=C\CC=C 1P028052 [1,1,0,0,0,0|0,0,1]=3 503 B9R0.45 CCCCC\C=C\CCO 1P00867N [1,1,0,0,0,0|0,0,1]=3 504 B9R0.45 CCCC\C=C/CCC=O 1P00BH3T [1,1,0,0,0,0|0,0,2]=4 505 B9R0.45 CCCC\C=C\C=C\C=O 1P00IM07 [1,1,0,0,0,0|0,0,1]=3 506 B9R0.45 CC\C=C/CC\C=C\C=O 1P003R1K [1,1,0,0,0,0|0,0,1]=3 507 B9R0.45 CC\C=C\CC\C=C\C=O 1P0021QJ [1,1,0,0,0,0|0,0,1]=3 508 B9R0.45 O=CCCCC\C=C/CC 1P003PGB [1,1,0,0,0,0|0,0,2]=4 509 B9R0.45 O=CCCCC\C=C\CC 1P00BVNX [1,1,0,0,0,0|0,0,2]=4 510 B9R0.45 OCCCCCCCC=O 1P007QFH [1,1,0,0,0,0|0,0,2]=4 511 B9R0.45 OCCCCC\C=C/CC 1P003PGA [1,1,0,0,0,0|0,0,1]=3 512 B9R0.46 CCCCCCC(=O)C=C 1P006VOS [1,1,0,0,0,0|0,0,2]=4 513 B9R0.46 CCCCCCC(=O)CC 1P003TQS [1,1,0,0,0,0|0,0,2]=4 514 B9R0.46 CCCCCCC(=O)OC 1P003SH2 [1,1,0,0,0,0|1,0,1]=4 515 B9R0.1 CCC(CCCC(=O)O)C 1P007TWS [1,1,0,0,0,0|1,0,1]=4 516 B9R0.1 CCC(CCCC(=O)[O-])O 1P028EKM [1,1,0,0,0,0|1,0,1]=4 517 B9R0.1 CN(CC)CC=CC(=O)O 1P027XTK [1,1,0,0,0,0|2,0,0]=4 518 B9R0.1 COC(CCOC(=O)C)C 1P00I8VE [1,1,0,0,0,0|2,0,0]=4 519 B9R0.4 CC(OC(=O)Cl)CCCC 1P00BKD3 [1,1,0,0,0,0|2,0,0]=4 520 B9R0.4 CCCCC(=O)CC(=O)C 1P001DGE [1,1,0,0,0,0|0,0,1]=3 521 B9R0.4 CCCCC(=O)OC(=O)C 1P007Z4H [1,1,0,0,0,0|1,0,0]=3 522 B9R0.4 CCCCC(CC(=O)O)C 1P00DEMS [1,1,0,0,0,0|1,0,1]=4 523 B9R0.4 CCCCC(CC(=O)O)N 1P003JEA [1,1,0,0,0,0|1,0,1]=4 524 B9R0.4 CCCCC(CC(=O)O)O 1P0021PJ [1,1,0,0,0,0|1,0,1]=4 525 B9R0.4 CCCC[C@@H](CC(=O)O)C 1P00E9G5 [1,1,0,0,0,0|1,0,1]=4 526 B9R0.4 CCCC[C@@H](CC(=O)O)N 1P028ZHI [1,1,0,0,0,0|1,0,1]=4 527 B9R0.4 CCCC[C@H](CC(=O)O)N 1P01C415 [1,1,0,0,0,0|1,0,1]=4 528 B9R0.4 CCCOC(=O)CC(=O)C 1P00262G [1,1,0,0,0,0|1,0,1]=4 529 B9R0.47 CCCCCC(=O)C(=O)O 1P000VJ8 [1,1,0,0,0,0|1,0,0]=3 530 B9R0.47 CCCCCC(=O)N(C)C 1P003T1W [1,1,0,0,0,0|2,0,0]=4 531 B9R0.47 CCCCCC(C(=O)O)C 1P003I62 [1,1,0,0,0,0|1,0,1]=4 532 B9R0.47 CCCCCC(C(=O)O)F 1P001Q6O [1,1,0,0,0,0|1,0,1]=4 533 B9R0.47 CCCCCC(C(=O)O)N 1P003H03 [1,1,0,0,0,0|1,0,1]=4 534 B9R0.47 CCCCCC(C(=O)O)O 1P00EZ41 [1,1,0,0,0,0|1,0,1]=4 535 B9R0.47 CCCCC[C@@H](C(=O)O)N 1P00DCUE [1,1,0,0,0,0|1,0,1]=4 536 B9R0.47 CCCCC[C@H](C(=O)O)N 1P0037WI [1,1,0,0,0,0|1,0,1]=4 537 B9R0.47 CCCCNC(=O)C(=C)C 1P00BGYT [1,1,0,0,0,0|2,0,0]=4 538 B9R0.47 CCCCOC(=O)C(=O)N 1P003TZ8 [1,1,0,0,0,0|2,0,0]=4 539 B9R0.47 CCSCCC(=O)C(=O)[O-] 1P027WKX [1,1,0,0,0,0|2,0,0]=4 540 B9R0.47 [O-]C(=O)C(=O)OCCCC 1P0014UE [1,1,0,0,0,0|2,0,0]=4 541 B9R0.48 CC(CCC)COC(=O)Cl 1P01E4FP [1,1,0,0,0,0|2,0,0]=4 542 B9R0.48 CCCC(=O)CCC(=O)C 1P00399S [1,1,0,0,0,0|0,0,2]=4 543 B9R0.48 CCOC(=O)\C=C\C(=O)C 1P00054H [1,1,0,0,0,0|1,0,1]=4 544 B9R0.48 CCOC(COC(=O)C)C 1P00F1KY [1,1,0,0,0,0|2,0,0]=4 545 B9R0.55 CC(=O)CCCCC(=O)C 1P001TQG [1,1,0,0,0,0|0,0,2]=4 546 B9R0.55 CC(CCCCC(=O)O)C 1P00GS4R [1,1,0,0,0,0|1,0,1]=4 547 B9R0.55 CC(CCCCC(=O)O)N 1P01AJKO [1,1,0,0,0,0|1,0,1]=4 548 B9R0.55 CC(CCCCC(=O)[O-])O 1P0286L6 [1,1,0,0,0,0|1,0,1]=4 549 B9R0.55 CC(CC\C=C\C(=O)O)C 1P028B0G [1,1,0,0,0,0|1,0,0]=3 550 B9R0.55 CN(CCCCC(=O)C)C 1P01A66E [1,1,0,0,0,0|1,0,1]=4 551 B9R0.55 CN(CCCNC(=O)C)C 1P00I6IQ [1,1,0,0,0,0|2,0,0]=4 552 B11R0.45 CCCC(CCOC(=O)C)SC 1P003IPY [0,2,0,0,0,0|1,0,1]=4 553 B11R0.2 CCCCCCC(=O)CC(=O)O 1P00CZI6 [0,2,0,0,0,0|1,0,1]=4 554 B11R0.2 CCCCCCC(OC(=O)C)C 1P002ABP [0,2,0,0,0,0|0,0,2]=4 555 B11R0.30 CC(=O)CCCCCCC(=O)C 1P001WL3 [0,2,0,0,0,0|0,0,2]=4 556 B11R0.40 BrCCCCCCCC(=O)CCl 1P028CR2 [0,2,0,0,0,0|0,0,2]=4 557 B11R0.40 BrCCCCCCCC(=O)OC 1P007N2N [0,2,0,0,0,0|0,0,2]=4 558 B11R0.40 CCCCCCC#CC(=O)OC 1P003S5M [0,2,0,0,0,0|0,0,2]=4 559 B11R0.40 CCCCCCCCC(=O)OC 1P001Z2N [0,2,0,0,0,0|0,0,2]=4 560 B11R0.40 CCCCCC\C=C\C(=O)OC 1P001M99 [0,2,0,0,0,0|0,0,0]=2 561 B11R0.40 CCCCC\C=C\CC(=O)OC 1P003R1M [0,2,0,0,0,0|0,0,0]=2 562 B11R0.40 CCCCOCCNC(=O)CCl 1P019WWN [0,2,0,0,0,0|1,0,1]=4 563 B11R0.40 NCCCCCCCC(=O)OC 1P008NEX [0,2,0,0,0,0|0,0,2]=4 564 B11R0.40 NCCCCCOCC(=O)OC 1P01JM3T [0,2,0,0,0,0|1,0,1]=4 565 B11R0.40 OCCCCCCCC(=O)OC 1P0028RG [0,2,0,0,0,0|0,0,2]=4 566 B11R0.42 CCCCCCCC(=O)C(=O)O 1P000WJX [0,2,0,0,0,0|1,0,1]=4 567 B11R0.42 CCCCCCCC(=O)N(C)C 1P0084HS [0,2,0,0,0,0|0,0,2]=4 568 B11R0.42 CCCCCCOC(=O)C(C)C 1P002NV1 [0,2,0,0,0,0|1,0,1]=4 569 B11R0.42 NCCCCCNC(=O)C(=O)O 1P028C6Q [0,2,0,0,0,0|2,0,0]=4 570 B11R0.46 CCCCCC(=O)CCC(=O)O 1P00EGEK [0,2,0,0,0,0|1,0,1]=4 571 B11R0.46 CCCCCC(=O)NCC(=O)O 1P006Y4A [0,2,0,0,0,0|1,0,1]=4 572 B11R0.46 CCCCOC(=O)C=CC(=O)O 1P019PLU [0,2,0,0,0,0|1,0,1]=4 573 B11R0.46 CCCCOC(=O)CCC(=O)C 1P002AEJ [0,2,0,0,0,0|1,0,1]=4 574 B11R0.148 C=CCCCCCCOC(=O)C 1P003O3F [0,2,0,0,0,0|1,0,1]=4 575 B11R0.148 CCCCCC=CCCC(=O)O 1P002T4A [0,2,0,0,0,0|1,0,0]=3 576 B11R0.148 CCCCCCCC=CC(=O)O 1P00ABWS [0,2,0,0,0,0|1,0,0]=3 577 B11R0.148 CCCCCCCCCC(=O)C 1P003SI6 [0,2,0,0,0,0|0,0,2]=4 578 B11R0.148 CCCCCCCCNC(=O)C 1P01B9HX [0,2,0,0,0,0|0,0,2]=4 579 B11R0.148 CCCCCCCCOC(=O)C 1P003TXL [0,2,0,0,0,0|0,0,2]=4 580 B11R0.148 CCCCCCC\C=C\C(=O)O 1P00366C [0,2,0,0,0,0|1,0,0]=3 581 B11R0.148 CCCCCC\C=C\CC(=O)O 1P003JTM [0,2,0,0,0,0|1,0,0]=3 582 B11R0.148 CCCCC\C=C\C=C\C(=O)O 1P0030BO [0,2,0,0,0,0|1,0,0]=3 583 B11R0.148 CCCC\C=C/CCOC(=O)C 1P00G1PH [0,2,0,0,0,0|0,0,2]=4 584 B11R0.148 CCOCCOCCOC(=O)C 1P003PYQ [0,2,0,0,0,0|1,0,1]=4 585 B11R0.148 O=CCCCCCCOC(=O)C 1P002YT1 [0,2,0,0,0,0|1,0,1]=4 586 B11R0.139 CCCCCC(=O)C(C(=O)C)C 1P00097W [0,2,0,0,0,0|0,0,1]=3 587 B11R0.154 CCCCCC(=O)CC(=O)OC 1P00BG4L [0,2,0,0,0,0|0,0,1]=3 588 B11R0.154 CCCCCC(CC(=O)OC)O 1P00FED7 [0,2,0,0,0,0|0,0,2]=4 589 B11R0.154 CCCCCC(NC(=O)CCl)C 1P019PVN [0,2,0,0,0,0|1,0,1]=4 590 B11R0.154 CCCCCC(OC(=O)CCl)C 1P00D64D [0,2,0,0,0,0|1,0,1]=4 591 B11R0.154 CCCCNC(=O)NC(=O)CCl 1P00CDWW [0,2,0,0,0,0|2,0,0]=4 592 B11R0.29 CC(CCCNC(=O)C(=O)O)N 1P028CAS [0,2,0,0,0,0|2,0,0]=4 593 B11R0.4 CCCCCCCC(=O)CCC 1P001KLF [0,2,0,0,0,0|0,0,2]=4 594 B11R0.4 CCCCCCCC(=O)OCC 1P003QV5 [0,2,0,0,0,0|0,0,2]=4 595 B11R0.4 CCCCCCNC(=O)CC#N 1P00DBV6 [0,2,0,0,0,0|1,0,1]=4 596 B11R0.4 CCCCCCNC(=O)CCC 1P0008GS [0,2,0,0,0,0|1,0,1]=4 597 B11R0.4 CCCCCCOC(=O)C=CC 1P002FCG [0,2,0,0,0,0|1,0,1]=4 598 B11R0.4 CCCCCCOC(=O)CC#N 1P007NP0 [0,2,0,0,0,0|1,0,1]=4 599 B11R0.4 CCCCCCOC(=O)CCC 1P002THL [0,2,0,0,0,0|1,0,1]=4 600 B11R0.4 CCCCCCOC(=O)COC 1P01KKGO [0,2,0,0,0,0|1,0,1]=4 601 B11R0.142 CCCCCCC(=C)C(=O)OC 1P00D0B1 [0,2,0,0,0,0|0,0,1]=3 602 B11R0.142 CCCCCCC(C(=O)OC)Br 1P0035MM [0,2,0,0,0,0|0,0,2]=4 603 B11R0.142 CCCCCC[C@@H](C(=O)OC)N 1P01JN3A [0,2,0,0,0,0|0,0,2]=4 604 B11R0.164 CCCCC(COC(=O)C)CC 1P003HOG [0,2,0,0,0,0|1,0,1]=4 605 B9R1.5 CC1CCCCCC1=O 1P01B1UZ [1,0,0,1,0,0|0,0,2]=4 606 B9R1.5 O=C1CNCCCC1C 1P0290ML [1,0,0,1,0,0|1,0,1]=4 607 B9R1.5 O=C1NCCCCC1C 1P002JFG [1,0,0,1,0,0|1,0,1]=4 608 B9R1.8 CNCC1CCC=CC1 1P01A6SB [1,0,0,1,0,0|1,0,1]=4 609 B9R1.8 C\C=N\N1CCCCC1 1P028YDQ [1,0,0,1,0,0|2,0,0]=4 610 B9R1.8 N#CC=C1CCCCC1 1P00DS7G [1,0,0,1,0,0|1,0,1]=4 611 B9R1.8 NCCC1CCC=CC1 1P00D6VD [1,0,0,1,0,0|1,0,1]=4 612 B9R1.8 NCCC1CCC=CC1 1P01EI7T [1,0,0,1,0,0|1,0,1]=4 613 B9R1.8 NCC[C@H]1CCC=CC1 1P027VP1 [1,0,0,1,0,0|1,0,1]=4 614 B9R1.8 O=CC=C1CCCCC1 1P00AYH6 [1,0,0,1,0,0|0,0,0]=2 615 B9R1.8 O=CCC1=CCCCC1 1P00CT8D [1,0,0,1,0,0|0,0,2]=4 616 B9R1.8 O=CCC1CCCCC1 1P003AIZ [1,0,0,1,0,0|0,0,2]=4 617 B9R1.8 O=CCN1CCCCC1 1P01DNP3 [1,0,0,1,0,0|1,0,1]=4 618 B9R1.8 O=CNC1=CCCCC1 1P00763S [1,0,0,1,0,0|1,0,1]=4 619 B9R1.8 O=CNC1CCCCC1 1P003TDS [1,0,0,1,0,0|1,0,1]=4 620 B9R1.8 OCC=C1CCCCC1 1P0064VQ [1,0,0,1,0,0|0,0,2]=4 621 B9R1.12 CCCCC1NCC=C1 1P00J2HL [1,0,0,1,0,0|1,0,1]=4 622 B9R1.12 CCCCc1ccco1 1P003HAJ [1,0,0,1,0,0|0,0,2]=4 623 B9R1.12 CCCCc1cccs1 1P001DL3 [1,0,0,1,0,0|0,1,1]=4 624 B9R1.12 CCCCn1cccn1 1P00DSOY [1,0,0,1,0,0|2,0,0]=4 625 B9R1.12 N#C\C=C\C1CCCC1 1P003JTH [1,0,0,1,0,0|1,0,1]=4 626 B9R1.12 O=CCCC1CCCC1 1P00EEF2 [1,0,0,1,0,0|0,0,2]=4 627 B9R1.15 CCC1CCCCC1=O 1P003HOA [1,0,0,1,0,0|0,0,2]=4 628 B9R1.15 CCC1CCCNC1=O 1P001WKR [1,0,0,1,0,0|1,0,1]=4 629 B9R1.15 CCC1CCCOC1=O 1P00CY9J [1,0,0,1,0,0|1,0,1]=4 630 B9R1.15 CCC1CCOCC1=O 1P01DW0C [1,0,0,1,0,0|1,0,1]=4 631 B9R1.16 O=CCCCC1CC1C 1P028T5D [1,0,0,1,0,0|0,0,2]=4 632 B9R1.33 CC=C[C@@H]1CCC[C@H]1O 1P028WGE [1,0,0,1,0,0|1,0,1]=4 633 B9R1.33 CCCC1CCCC1=O 1P000J0L [1,0,0,1,0,0|0,0,2]=4 634 B9R1.33 CCCC1CCNC1=O 1P027UUD [1,0,0,1,0,0|1,0,1]=4 635 B9R1.33 CCCn1nccc1C 1P00D199 [1,0,0,1,0,0|2,0,0]=4 636 B9R1.50 BrC1=CCCCCCC1 1P01BELB [1,0,0,1,0,0|1,0,1]=4 637 B9R1.50 BrC1CCCC=CCC1 1P00CMWI [1,0,0,1,0,0|1,0,1]=4 638 B9R1.50 NC1CCCC=CCC1 1P01EMNJ [1,0,0,1,0,0|1,0,1]=4 639 B9R1.50 NC1CCCCCC=C1 1P01BAOA [1,0,0,1,0,0|1,0,1]=4 640 B9R1.50 O1C(CCCCCC1)=O 1P01FWHU [1,0,0,1,0,0|1,0,1]=4 641 B9R1.50 O=C1CCCCCCC1 1P00354H [1,0,0,1,0,0|0,0,2]=4 642 B9R1.50 O=C1CCCCCCN1 1P00IC5V [1,0,0,1,0,0|1,0,1]=4 643 B9R1.50 O=C1NCCCCC=C1 1P007WTH [1,0,0,1,0,0|1,0,0]=3 644 B9R1.50 OC1CCCC=CCC1 1P00GARS [1,0,0,1,0,0|1,0,1]=4 645 B9R1.50 O[C@H]1CCCC=CCC1 1P00CIJB [1,0,0,1,0,0|1,0,1]=4 646 B9R1.83 O=CCCCCC1CC1 1P028XAO [1,0,0,1,0,0|0,0,2]=4 647 B9R1.89 BrCC1CCC=CCC1 1P01BLBD [1,0,0,1,0,0|1,0,1]=4 648 B9R1.89 COC1=NCCCCC1 1P003NWP [1,0,0,1,0,0|2,0,0]=4 649 B9R1.89 N#CC1=CCCCCC1 1P0029D0 [1,0,0,1,0,0|1,0,1]=4 650 B9R1.89 NCC1CCC=CCC1 1P01EMGN [1,0,0,1,0,0|1,0,1]=4 651 B9R1.89 O=CC1CCCCCC1 1P00C13Z [1,0,0,1,0,0|0,0,2]=4 652 B9R1.89 O=CN1CCCCCC1 1P002R01 [1,0,0,1,0,0|1,0,1]=4 653 B9R1.89 OCC1CCC=CCC1 1P001Z81 [1,0,0,1,0,0|1,0,1]=4 654 B9R1.2 BrCC1CCCC(=O)C1 1P028EEN [1,0,0,1,0,0|1,0,1]=4 655 B9R1.2 CCC1CC(=O)C=CC1 1P01HMG3 [1,0,0,1,0,0|0,0,0]=2 656 B9R1.2 CCC1CC(=O)CCO1 1P00D327 [1,0,0,1,0,0|1,0,1]=4 657 B9R1.2 CCC1CC=CC(=O)O1 1P020M7D [1,0,0,1,0,0|1,0,0]=3 658 B9R1.2 CCC1CCCC(=O)C1 1P007OXD [1,0,0,1,0,0|0,0,1]=3 659 B9R1.2 CCC1CCCC(=O)O1 1P007IBP [1,0,0,1,0,0|1,0,1]=4 660 B9R1.2 CCC1CCNC(=O)C1 1P01BHCU [1,0,0,1,0,0|1,0,0]=3 661 B9R1.2 CCN1CCCC(=O)C1 1P00BZZV [1,0,0,1,0,0|1,0,1]=4 662 B9R1.2 CCN1CCNC(=O)C1 1P00IBYI [1,0,0,1,0,0|2,0,0]=4 663 B9R1.2 CNC1CCCC(=O)C1 1P027VLO [1,0,0,1,0,0|1,0,1]=4 664 B9R1.2 COC1CCCC(=O)C1 1P0079W8 [1,0,0,1,0,0|1,0,1]=4 665 B9R1.2 CSC1CCCC(=O)C1 1P01BFPY [1,0,0,1,0,0|1,0,1]=4 666 B9R1.2 ClCC1CCCC(=O)C1 1P01C5LG [1,0,0,1,0,0|1,0,1]=4 667 B9R1.2 NCC1CCNC(=O)C1 1P001CGJ [1,0,0,1,0,0|2,0,0]=4 668 B9R1.2 NCC1CCNC(=O)C1 1P00A305 [1,0,0,1,0,0|2,0,0]=4 669 B9R1.2 NCC1CCNC(=O)C1 1P02874S [1,0,0,1,0,0|2,0,0]=4 670 B9R1.2 OCC1CCNC(=O)C1 1P00E3Y5 [1,0,0,1,0,0|2,0,0]=4 671 B9R1.6 CC(=O)C1=CNCCC1 1P019L18 [1,0,0,1,0,0|1,0,0]=3 672 B9R1.6 CC(=O)C1=COCCC1 1P01BSDK [1,0,0,1,0,0|1,0,0]=3 673 B9R1.6 CC(=O)C1=COCCO1 1P01A0MG [1,0,0,1,0,0|2,0,0]=4 674 B9R1.6 CC(=O)C1CCCCC1 1P00337P [1,0,0,1,0,0|0,0,1]=3 675 B9R1.6 CC(=O)C1CCCCN1 1P007DH9 [1,0,0,1,0,0|1,0,1]=4 676 B9R1.6 CC(=O)C1CCCCO1 1P01BY6Z [1,0,0,1,0,0|1,0,1]=4 677 B9R1.6 CC(=O)C1CCCNC1 1P00G51Z [1,0,0,1,0,0|1,0,1]=4 678 B9R1.6 CC(=O)C1CCCNC1 1P00H3H8 [1,0,0,1,0,0|1,0,1]=4 679 B9R1.6 CC(=O)C1CCCOC1 1P01A63Q [1,0,0,1,0,0|1,0,1]=4 680 B9R1.6 CC(=O)C1CCNCC1 1P0031UL [1,0,0,1,0,0|1,0,1]=4 681 B9R1.6 CC(=O)C1CCOCC1 1P001387 [1,0,0,1,0,0|1,0,1]=4 682 B9R1.6 CC(=O)C1CCSCC1 1P01AFVX [1,0,0,1,0,0|1,0,1]=4 683 B9R1.6 CC(=O)C1CC[NH2+]CC1 1P0037H4 [1,0,0,1,0,0|1,0,1]=4 684 B9R1.6 CC(=O)N1CCCCC1 1P003DKT [1,0,0,1,0,0|1,0,0]=3 685 B9R1.6 CC(=O)N1CCCCO1 1P0288PQ [1,0,0,1,0,0|2,0,0]=4 686 B9R1.6 CC(=O)N1CCCOC1 1P028Z9H [1,0,0,1,0,0|2,0,0]=4 687 B9R1.6 CC(=O)N1CCNCC1 1P001A8W [1,0,0,1,0,0|2,0,0]=4 688 B9R1.6 CC(=O)N1CCOCC1 1P003L3L [1,0,0,1,0,0|2,0,0]=4 689 B9R1.6 CC(=O)[C@@H]1CCCCN1 1P01ANWE [1,0,0,1,0,0|1,0,1]=4 690 B9R1.6 CC(=O)[C@H]1CCCCN1 1P01ANWF [1,0,0,1,0,0|1,0,1]=4 691 B9R1.6 CC(C1=CCCCC1)N 1P00J224 [1,0,0,1,0,0|1,0,1]=4 692 B9R1.6 CP(=O)C1CCCCC1 1P020LQM [1,0,0,1,0,0|1,0,1]=4 693 B9R1.6 ClC(=O)C1CCCCC1 1P003545 [1,0,0,1,0,0|1,0,1]=4 694 B9R1.6 ClC(=O)N1CCCCC1 1P001BE0 [1,0,0,1,0,0|2,0,0]=4 695 B9R1.6 NC(=O)C1=CCNCC1 1P028UNB [1,0,0,1,0,0|2,0,0]=4 696 B9R1.6 NC(=O)C1=CNCCC1 1P00FAZF [1,0,0,1,0,0|2,0,0]=4 697 B9R1.6 NC(=O)C1CCCCC1 1P003PL8 [1,0,0,1,0,0|1,0,1]=4 698 B9R1.6 NC(=O)N1CCCCC1 1P003F3R [1,0,0,1,0,0|2,0,0]=4 699 B9R1.6 OC(=O)C1=CCCCC1 1P003EPS [1,0,0,1,0,0|1,0,0]=3 700 B9R1.6 OC(=O)C1=CCCCO1 1P0034MW [1,0,0,1,0,0|2,0,0]=4 701 B9R1.6 OC(=O)C1=CCCNC1 1P00EFBN [1,0,0,1,0,0|2,0,0]=4 702 B9R1.6 OC(=O)C1=CCCOC1 1P00022F [1,0,0,1,0,0|2,0,0]=4 703 B9R1.6 OC(=O)C1=CCCSC1 1P01AI3M [1,0,0,1,0,0|2,0,0]=4 704 B9R1.6 OC(=O)C1=CCNCC1 1P00330Q [1,0,0,1,0,0|2,0,0]=4 705 B9R1.6 OC(=O)C1=CCOCC1 1P01A72P [1,0,0,1,0,0|2,0,0]=4 706 B9R1.6 OC(=O)C1=COCCC1 1P00CLQT [1,0,0,1,0,0|2,0,0]=4 707 B9R1.6 OC(=O)C1CCCCC1 1P003546 [1,0,0,1,0,0|1,0,1]=4 708 B9R1.6 OC(=O)N1CCCCC1 1P01JI0G [1,0,0,1,0,0|2,0,0]=4 709 B9R1.6 [O-]C(=O)C1CCCCC1 1P003RPR [1,0,0,1,0,0|1,0,1]=4 710 B9R1.6 [O-][N+](=O)C1=CCCCC1 1P0033AB [1,0,0,1,0,0|2,0,0]=4 711 B9R1.7 CCCC1CCC(=O)C1 1P00348R [1,0,0,1,0,0|0,0,1]=3 712 B9R1.7 CCCC1CCC(=O)O1 1P00HB0Y [1,0,0,1,0,0|1,0,1]=4 713 B9R1.7 CCCC1CNC(=O)C1 1P00JDD1 [1,0,0,1,0,0|1,0,0]=3 714 B9R1.7 CCCC1COC(=O)O1 1P008882 [1,0,0,1,0,0|2,0,0]=4 715 B9R1.7 CCC[C@H]1COC(=O)C1 1P00ELOJ [1,0,0,1,0,0|1,0,0]=3 716 B9R1.7 NCCC1CNC(=O)C1 1P01B5FR [1,0,0,1,0,0|2,0,0]=4 717 B9R1.7 OCCC1CNC(=O)C1 1P00KBMW [1,0,0,1,0,0|2,0,0]=4 718 B9R1.9 CCCCC1CC(=O)C1 1P028FK0 [1,0,0,1,0,0|0,0,1]=3 719 B9R1.9 CCCOC1CC(=O)C1 1P0289SK [1,0,0,1,0,0|1,0,1]=4 720 B9R1.9 COCCC1CC(=O)C1 1P01FJOE [1,0,0,1,0,0|1,0,1]=4 721 B9R1.9 CSCCC1CC(=O)C1 1P028D5Q [1,0,0,1,0,0|1,0,1]=4 722 B9R1.13 CC(=O)CC1CCCC1 1P008SLB [1,0,0,1,0,0|0,0,1]=3 723 B9R1.13 CC(=O)CC1CCCO1 1P007EYH [1,0,0,1,0,0|1,0,1]=4 724 B9R1.13 CC(=O)CC1COCC1 1P019Z4V [1,0,0,1,0,0|1,0,1]=4 725 B9R1.13 CC(=O)NC1CCCC1 1P007O81 [1,0,0,1,0,0|1,0,0]=3 726 B9R1.13 CC(=O)NC1CNCC1 1P003SVY [1,0,0,1,0,0|2,0,0]=4 727 B9R1.13 CC(=O)N[C@@H]1CNCC1 1P000FCJ [1,0,0,1,0,0|2,0,0]=4 728 B9R1.13 CC(=O)N[C@@H]1CNCC1 1P0074XR [1,0,0,1,0,0|2,0,0]=4 729 B9R1.13 CC(=O)N[C@H]1CNCC1 1P0010CO [1,0,0,1,0,0|2,0,0]=4 730 B9R1.13 CC(=O)N[C@H]1CNCC1 1P01FZDA [1,0,0,1,0,0|2,0,0]=4 731 B9R1.13 CC(=O)OC1CCCO1 1P001VUK [1,0,0,1,0,0|2,0,0]=4 732 B9R1.13 CC(=O)O[C@@H]1CNCC1 1P028V0L [1,0,0,1,0,0|2,0,0]=4 733 B9R1.13 CC(=O)O[C@H]1CNCC1 1P028UIC [1,0,0,1,0,0|2,0,0]=4 734 B9R1.13 CC(=O)SC1COCC1 1P00KE4L [1,0,0,1,0,0|2,0,0]=4 735 B9R1.13 NC(=O)C=C1CCCC1 1P019YXN [1,0,0,1,0,0|1,0,0]=3 736 B9R1.13 NC(=O)CC1CCCC1 1P019LSV [1,0,0,1,0,0|1,0,1]=4 737 B9R1.13 NC(=O)NC1CCCC1 1P000J5N [1,0,0,1,0,0|2,0,0]=4 738 B9R1.13 OC(=O)C=C1CCCC1 1P002EXR [1,0,0,1,0,0|1,0,0]=3 739 B9R1.13 OC(=O)CC1CCCC1 1P003PNA [1,0,0,1,0,0|1,0,1]=4 740 B9R1.41 CC(=O)C1CCOC1C 1P028OOD [1,0,0,1,0,0|1,0,1]=4 741 B9R1.41 CC1=C(CCC1)C(=O)C 1P00CZS8 [1,0,0,1,0,0|0,0,1]=3 742 B9R1.41 CC1=C(CCC1)C(=O)O 1P005QP8 [1,0,0,1,0,0|1,0,1]=4 743 B9R1.41 CC1CCCC1C(=O)O 1P00DC0Z [1,0,0,1,0,0|1,0,1]=4 744 B9R1.41 CC1CCCN1C(=O)C 1P01EIRL [1,0,0,1,0,0|1,0,0]=3 745 B9R1.41 CC1CCCN1C(=O)Cl 1P01EN8D [1,0,0,1,0,0|2,0,0]=4 746 B9R1.46 C[C@@H]1C[C@H]1CCC(=O)O 1P02888H [1,0,0,1,0,0|1,0,1]=4 747 B9R1.46 C[C@@H]1C[C@H]1\C=C\C(=O)O 1P028CVI [1,0,0,1,0,0|1,0,0]=3 748 B9R1.48 CC1CCCCC(=O)N1 1P002C1H [1,0,0,1,0,0|1,0,1]=4 749 B9R1.48 CC1CCCCC(=O)O1 1P006UKN [1,0,0,1,0,0|1,0,1]=4 750 B9R1.48 CC1NCCNC(=O)C1 1P00IGPY [1,0,0,1,0,0|2,0,0]=4 751 B9R1.48 CN1CCCNC(=O)C1 1P006X1N [1,0,0,1,0,0|2,0,0]=4 752 B9R1.48 C[C@@H]1CCCOC(=O)C1 1P002E70 [1,0,0,1,0,0|1,0,0]=3 753 B9R1.67 CC(=O)N[C@@H]1CC[C@H]1O 1P0285YS [1,0,0,1,0,0|2,0,0]=4 754 B9R1.67 CC(=O)OC1CCC1O 1P0209BQ [1,0,0,1,0,0|2,0,0]=4 755 B9R1.84 CC(=O)NCC1CCN1 1P028URZ [1,0,0,1,0,0|2,0,0]=4 756 B9R1.84 CC(=O)OCC1CNC1 1P0286NK [1,0,0,1,0,0|2,0,0]=4 757 B9R1.84 ClC(=O)OCC1CCC1 1P01RKX6 [1,0,0,1,0,0|2,0,0]=4 758 B9R1.84 NC(=O)NCC1CCC1 1P028YD3 [1,0,0,1,0,0|2,0,0]=4 759 B9R1.84 OC(=O)C=CC1CCC1 1P019UII [1,0,0,1,0,0|1,0,0]=3 760 B9R1.84 OC(=O)CCC1CCC1 1P00D98Y [1,0,0,1,0,0|1,0,1]=4 761 B9R1.84 OC(=O)\C=C\C1CCC1 1P01DH74 [1,0,0,1,0,0|1,0,0]=3 762 B9R1.84 [O-][N+](=O)C=CC1CCC1 1P028G5P [1,0,0,1,0,0|2,0,0]=4 763 B9R1.85 NC(=O)NCCC1CC1 1P028ACL [1,0,0,1,0,0|2,0,0]=4 764 B9R1.85 OC(=O)CCCC1CC1 1P01AL1K [1,0,0,1,0,0|1,0,1]=4 765 B9R1.86 CC[C@@H]1C[C@H]1CC(=O)O 1P0285MJ [1,0,0,1,0,0|1,0,1]=4 766 B9R1.96 CCC1CCC1C(=O)O 1P01DXWD [1,0,0,1,0,0|1,0,1]=4 767 B11R1.90 OC(=O)\C=C\C1CCCN1C 1P028761 [0,1,0,1,0,0|1,0,0]=3 768 B11R1.157 CC1CCCN(C1)CC(=O)C 1P004QO1 [0,1,0,1,0,0|1,0,1]=4 769 B11R1.172 CC(=O)NCCN1CCCC1 1P01C5PA [0,1,0,1,0,0|1,0,1]=4 770 B11R1.172 OC(=O)\C=C\CN1CCCC1 1P004XKA [0,1,0,1,0,0|1,0,0]=3 771 B11R1.924 CC(=O)SCCC1(O)CCC1 1P01C2WG [0,1,0,1,0,0|1,0,1]=4 772 B11R1.24 CCCC[n+]1cccc(c1)C 1P000OQM [0,1,0,1,0,0|1,0,1]=4 773 B11R1.24 CCCC[n+]1cccc(c1)C 1P002U7S [0,1,0,1,0,0|1,0,1]=4 774 B11R1.24 CCCC[n+]1cccc(c1)C 1P003F0P [0,1,0,1,0,0|1,0,1]=4 775 B11R1.24 CCCC[n+]1cccc(c1)C 1P003TBO [0,1,0,1,0,0|1,0,1]=4 776 B11R1.24 CCCC[n+]1cccc(c1)C 1P006AIC [0,1,0,1,0,0|1,0,1]=4 777 B11R1.24 NCCCC1CCNC(=O)C1 1P028OE7 [0,1,0,1,0,0|1,0,1]=4 778 B11R1.27 CCCCCC1CCC(=O)O1 1P00HAPV [0,1,0,1,0,0|1,0,1]=4 779 B11R1.27 CCCCCC1OC(=O)C=C1 1P00389N [0,1,0,1,0,0|1,0,0]=3 780 B11R1.27 CCCCCN1C=C[NH+](C1)C 1P007GEE [0,1,0,1,0,0|2,0,0]=4 781 B11R1.27 CCCCC[n+]1ccn(c1)C 1P00IMZM [0,1,0,1,0,0|2,0,0]=4 782 B11R1.27 CCCCC[n+]1ccn(c1)C 1P01XDRZ [0,1,0,1,0,0|2,0,0]=4 783 B11R1.27 CCCCCc1cc(on1)N 1P01A8ZA [0,1,0,1,0,0|1,0,1]=4 784 B11R1.27 CCCCCc1ccc(s1)Br 1P00BNTS [0,1,0,1,0,0|1,1,0]=4 785 B11R1.27 CCCCCn1ccc(n1)I 1P028GRO [0,1,0,1,0,0|2,0,0]=4 786 B11R1.27 CCCCCn1ccc(n1)N 1P00JVJM [0,1,0,1,0,0|2,0,0]=4 787 B11R1.27 Cc1csc(n1)CCCCN 1P01AA8H [0,1,0,1,0,0|2,0,0]=4 788 B11R1.53 OCC1CCCCN1C(=O)C 1P00B76J [0,1,0,1,0,0|1,0,1]=4 789 B11R1.86 CC(=O)CC1CCCCN1C 1P007SE6 [0,1,0,1,0,0|0,0,2]=4 790 B11R1.86 CC(=O)CN1CCCCC1C 1P002PCG [0,1,0,1,0,0|0,0,2]=4 791 B11R1.86 CC(=O)NC1CCNCC1C 1P01FKSZ [0,1,0,1,0,0|1,0,1]=4 792 B11R1.86 CC(=O)OC1CCCCC1C 1P00IANZ [0,1,0,1,0,0|0,0,2]=4 793 B11R1.91 CC(=CCC1CCCNC1)C 1P028U3L [0,1,0,1,0,0|1,0,1]=4 794 B11R1.91 CC(=O)C=CN1CCOCC1 1P024KN3 [0,1,0,1,0,0|1,0,0]=3 795 B11R1.91 CC(=O)CCC1CCCCC1 1P00BPDU [0,1,0,1,0,0|0,0,2]=4 796 B11R1.91 CC(=O)CCN1CCCCC1 1P001X4F [0,1,0,1,0,0|0,0,2]=4 797 B11R1.91 CC(=O)CCN1CCCCC1 1P01B8SZ [0,1,0,1,0,0|0,0,2]=4 798 B11R1.91 CC(=O)NCC1CCCCN1 1P01A0YD [0,1,0,1,0,0|1,0,1]=4 799 B11R1.91 CC(=O)NCC1CCCNC1 1P00GVVU [0,1,0,1,0,0|1,0,1]=4 800 B11R1.91 CC(=O)NCC1CCNCC1 1P005KSZ [0,1,0,1,0,0|1,0,1]=4 801 B11R1.91 CC(=O)NCC1CCNCC1 1P00J1QR [0,1,0,1,0,0|1,0,1]=4 802 B11R1.91 CC(=O)NCC1CCNCC1 1P019UNP [0,1,0,1,0,0|1,0,1]=4 803 B11R1.91 CC(=O)OCC1CCCCC1 1P003PMC [0,1,0,1,0,0|0,0,2]=4 804 B11R1.91 CC(=O)OCC1CCCCN1 1P01A2M9 [0,1,0,1,0,0|1,0,1]=4 805 B11R1.91 CC(=O)SCC1CCCOC1 1P01EBKV [0,1,0,1,0,0|1,0,1]=4 806 B11R1.91 OC(=O)\C=C\C1CCCCC1 1P00EG02 [0,1,0,1,0,0|1,0,0]=3 807 B11R1.91 OC(=O)\C=C\C1CCOCC1 1P01ZZ7C [0,1,0,1,0,0|1,0,0]=3 808 B11R1.91 [O-][N+](=O)\C=C\C1CCCCC1 1P0011PT [0,1,0,1,0,0|2,0,0]=4 809 B11R1.101 O=C1CCCCCCCCC1 1P001MVM [0,1,0,1,0,0|0,0,2]=4 810 B11R1.101 O=C1CCCCCCCCN1 1P028KAM [0,1,0,1,0,0|0,0,2]=4 811 B11R1.107 O=C1CCCCCCC(=O)O1 1P008YF6 [0,1,0,1,0,0|1,0,0]=3 812 B11R1.143 CC(=O)N1CCCCCC1=O 1P002HSS [0,1,0,1,0,0|1,0,0]=3 813 B11R1.143 [O-]C(=O)C1CCCCCC1=O 1P0287T1 [0,1,0,1,0,0|1,0,1]=4 814 B11R1.271 CC(=O)OC[C@@H]1CC[C@@H]1CO 1P01JUSM [0,1,0,1,0,0|1,0,1]=4 815 B11R1.271 CC(=O)OC[C@H]1CC[C@H]1CO 1P02234D [0,1,0,1,0,0|1,0,1]=4 816 B11R1.706 CC(=O)N1CCCCCCC1 1P003WKA [0,1,0,1,0,0|0,0,2]=4 817 B11R1.742 CC(=O)CN1CCCCCC1 1P0091AW [0,1,0,1,0,0|0,0,2]=4 818 B11R1.742 CC(=O)CN1CCCCCC1 1P00I53A [0,1,0,1,0,0|0,0,2]=4 819 B11R1.742 OC(=O)C=C1CCCCCC1 1P01XCGE [0,1,0,1,0,0|1,0,0]=3 820 B11R1.34 CCCC1CC(=CC(=O)C1)C 1P00I7T3 [0,1,0,1,0,0|0,0,0]=2 821 B11R1.34 CCCC1CC(=O)CC(=O)C1 1P00EFHY [0,1,0,1,0,0|0,0,1]=3 822 B11R1.77 CC(=O)CC(=O)C1CCCO1 1P027ZIO [0,1,0,1,0,0|1,0,1]=4 823 B11R1.156 CC(=O)C1=C(C)CCCC1=O 1P00DS24 [0,1,0,1,0,0|0,0,1]=3 824 B11R1.156 CC1CCCC(N1C(=O)C)C 1P01WUOY [0,1,0,1,0,0|1,0,1]=4 825 B11R1.230 CCCCC1CC(=O)OC1=O 1P0029EB [0,1,0,1,0,0|1,0,0]=3 826 B11R1.230 CCCCC1NC(=O)NC1=O 1P019Y6M [0,1,0,1,0,0|2,0,0]=4 827 B11R1.230 CCCCC1OC(=O)NC1=O 1P00BI1Y [0,1,0,1,0,0|2,0,0]=4 828 B11R1.230 CCCCN1CC(=O)NC1=O 1P003F0U [0,1,0,1,0,0|2,0,0]=4 829 B11R1.230 CCCCn1nc(cc1N)C 1P007FC8 [0,1,0,1,0,0|2,0,0]=4 830 B11R1.230 CCCNC1CC(=O)NC1=O 1P00E71H [0,1,0,1,0,0|2,0,0]=4 831 B11R1.928 CC(=O)CC1(N)CCCCC1 1P028GSS [0,1,0,1,0,0|0,0,2]=4 832 B11R1.20 CC1CCC(CC1)NC(=O)C 1P01CARD [0,1,0,1,0,0|1,0,1]=4 833 B11R1.20 CC1CC\C(=C\C(=O)O)\CC1 1P003FDQ [0,1,0,1,0,0|1,0,0]=3 834 B11R1.20 CN1CCC(=CC(=O)O)CC1 1P00G54L [0,1,0,1,0,0|2,0,0]=4 835 B11R1.20 CN1CCC(=CC(=O)O)CC1 1P01A66U [0,1,0,1,0,0|2,0,0]=4 836 B11R1.20 NC1CCC(CC1)NC(=O)C 1P00BBXR [0,1,0,1,0,0|1,0,1]=4 837 B11R1.20 NC1CCC(CC1)NC(=O)C 1P019U2L [0,1,0,1,0,0|1,0,1]=4 838 B11R1.20 OC1CCC(CC1)NC(=O)C 1P002NFL [0,1,0,1,0,0|1,0,1]=4 839 B11R1.20 O[C@@H]1CC[C@H](CC1)NC(=O)C 1P003VED [0,1,0,1,0,0|1,0,1]=4 840 B11R1.23 COC(=O)C1CC=CC(=O)C1 1P01B6M1 [0,1,0,1,0,0|1,0,1]=4 841 B11R1.75 CC(CCC1CCC(=O)C1)C 1P01ANTN [0,1,0,1,0,0|0,0,2]=4 842 B11R1.75 CC(CCc1ccc(o1)C)N 1P019SHK [0,1,0,1,0,0|0,0,2]=4 843 B11R1.1 CCCC[n+]1ccc(cc1)C 1P0035TW [0,1,0,1,0,0|2,0,0]=4 844 B11R1.1 CCCC[n+]1ccc(cc1)C 1P003EN8 [0,1,0,1,0,0|2,0,0]=4 845 B11R1.1 CCCC[n+]1ccc(cc1)C 1P003EN9 [0,1,0,1,0,0|2,0,0]=4 846 B11R1.1 CCCC[n+]1ccc(cc1)C 1P003TBQ [0,1,0,1,0,0|2,0,0]=4 847 B11R1.25 BrCC(=O)CCC1CCCC1 1P01ACHI [0,1,0,1,0,0|0,0,2]=4 848 B11R1.25 COC(=O)CCC1CCCC1 1P00CT6N [0,1,0,1,0,0|0,0,2]=4 849 B11R1.25 COC(=O)CNC1CCCC1 1P003S1R [0,1,0,1,0,0|1,0,1]=4 850 B11R1.25 COC(=O)CNC1CCCC1 1P00BBM6 [0,1,0,1,0,0|1,0,1]=4 851 B11R1.40 BrCC(=O)NC1CCCCC1 1P00EBP4 [0,1,0,1,0,0|1,0,1]=4 852 B11R1.40 CCC(=O)NC1CCCCC1 1P009RGW [0,1,0,1,0,0|1,0,1]=4 853 B11R1.40 COC(=O)C=C1CCCCC1 1P0074HU [0,1,0,1,0,0|0,0,0]=2 854 B11R1.40 COC(=O)C=C1CCCOC1 1P01ACOG [0,1,0,1,0,0|1,0,0]=3 855 B11R1.40 COC(=O)C=C1CCOCC1 1P0018YR [0,1,0,1,0,0|1,0,0]=3 856 B11R1.40 COC(=O)C=C1COCCN1 1P0282V5 [0,1,0,1,0,0|2,0,0]=4 857 B11R1.40 COC(=O)CC1CCCCC1 1P003SGM [0,1,0,1,0,0|0,0,2]=4 858 B11R1.40 ClCC(=O)CC1CCCCC1 1P028ZY1 [0,1,0,1,0,0|0,0,2]=4 859 B11R1.40 ClCC(=O)NC1CCCCC1 1P002OC4 [0,1,0,1,0,0|1,0,1]=4 860 B11R1.40 ClCC(=O)OC1CCCCC1 1P00682P [0,1,0,1,0,0|1,0,1]=4 861 B11R1.40 NCC(=O)NC1CCCCC1 1P001JSI [0,1,0,1,0,0|1,0,1]=4 862 B11R1.40 NCC(=O)OC1CCCCC1 1P019U7A [0,1,0,1,0,0|1,0,1]=4 863 B11R1.40 OCC(=O)NC1CCCCC1 1P01AHRS [0,1,0,1,0,0|1,0,1]=4 864 B11R1.40 SCC(=O)OC1CCCCC1 1P001YJZ [0,1,0,1,0,0|1,0,1]=4 865 B11R1.59 CC[C@@H]1CCN[C@@H]1C(=O)OC 1P027OYF [0,1,0,1,0,0|1,0,1]=4 866 B11R1.59 CC[C@H]1CCN[C@@H]1C(=O)OC 1P01Z9PV [0,1,0,1,0,0|1,0,1]=4 867 B11R1.59 CC[C@H]1CCN[C@H]1C(=O)OC 1P027OZ6 [0,1,0,1,0,0|1,0,1]=4 868 B11R1.214 CCCCc1ccc(o1)C=O 1P01OZ91 [0,1,0,1,0,0|1,0,1]=4 869 B11R1.214 CCCCc1ccc(s1)C=O 1P00IKNK [0,1,0,1,0,0|1,0,1]=4 870 B11R1.222 COC(=O)C1=CCCCC1O 1P028BL3 [0,1,0,1,0,0|1,0,0]=3 871 B11R1.222 COC(=O)C1NCCCC1C 1P02855W [0,1,0,1,0,0|1,0,1]=4 872 B11R1.222 ClCC(=O)N1CCCCC1C 1P00DHKY [0,1,0,1,0,0|1,0,1]=4 873 B11R1.222 NCC(=O)C1CCCCC1C 1P028KU7 [0,1,0,1,0,0|0,0,2]=4 874 B11R1.228 COC(=O)\C=C/1\CCCN1C 1P003S1E [0,1,0,1,0,0|1,0,0]=3 875 B11R1.757 CCCCOC1=CC(=O)C1=O 1P01IZ80 [0,1,0,1,0,0|1,0,1]=4 876 B11R1.852 BrCC(=O)C1CCCCCC1 1P00ATOI [0,1,0,1,0,0|0,0,2]=4 877 B11R1.852 CCC(=O)C1CCCCCC1 1P01IS6W [0,1,0,1,0,0|0,0,2]=4 878 B11R1.852 CNC(=O)C1CCCCCN1 1P028JLB [0,1,0,1,0,0|1,0,1]=4 879 B11R1.852 COC(=O)C1=CCCCCC1 1P01A1E9 [0,1,0,1,0,0|0,0,0]=2 880 B11R1.852 COC(=O)C1CCCCCC1 1P00ELT1 [0,1,0,1,0,0|0,0,2]=4 881 B11R1.852 COC(=O)C1CCCCCN1 1P00CLV0 [0,1,0,1,0,0|1,0,1]=4 882 B11R1.852 COC(=O)C1CCCCCO1 1P027U3J [0,1,0,1,0,0|1,0,1]=4 883 B11R1.852 ClCC(=O)C1CCCCCC1 1P00DTP0 [0,1,0,1,0,0|0,0,2]=4 884 B11R1.852 ClCC(=O)N1CCCCCC1 1P00DDLF [0,1,0,1,0,0|1,0,1]=4 885 B11R1.852 NCC(=C1CCCCCC1)F 1P028E46 [0,1,0,1,0,0|1,0,1]=4 886 B11R1.852 NCC(=O)C1CCCCCC1 1P028C0S [0,1,0,1,0,0|0,0,2]=4 887 B11R1.852 OCC(=O)N1CCCCCC1 1P01A9SU [0,1,0,1,0,0|1,0,1]=4 888 B11R1.35 O=C(C(=O)O)NC1CCCC1 1P0027W1 [0,1,0,1,0,0|2,0,0]=4 889 B11R1.35 OC(=O)C(=CC1CSCC1)C 1P027Y6D [0,1,0,1,0,0|2,0,0]=4 890 B11R1.36 CC(C(=O)C)C1CCCCC1 1P002A4Y [0,1,0,1,0,0|0,0,2]=4 891 B11R1.36 FC(=C1CCCCC1)C(=O)O 1P028OIY [0,1,0,1,0,0|1,0,0]=3 892 B11R1.36 FC(=C1CCNCC1)C(=O)O 1P028E0F [0,1,0,1,0,0|2,0,0]=4 893 B11R1.36 O=C(C(=O)O)C1CCCCC1 1P00DNA5 [0,1,0,1,0,0|1,0,1]=4 894 B11R1.36 O=C(C(=O)O)N1CCCCC1 1P00DDDK [0,1,0,1,0,0|2,0,0]=4 895 B11R1.167 C[C@@H]1CC[C@H](N(C1)C(=O)C)C 1P0288VO [0,1,0,1,0,0|1,0,1]=4 896 B11R1.713 CC(=O)NCC1(O)CCCC1 1P01BBK8 [0,1,0,1,0,0|1,0,1]=4 897 B11R2.35 O=C1C=CNC(C1)C2CC2 1P027YJP [0,0,0,2,0,0|1,0,0]=3 898 B11R2.35 O=C1C=COC(C1)C2CC2 1P01BUN3 [0,0,0,2,0,0|1,0,0]=3 899 B11R2.35 O=C1CCCC(C1)C2CC2 1P01AKDI [0,0,0,2,0,0|0,0,2]=4 900 B11R2.36 O=C1CCC2C(C1)CCC2 1P01GHZ6 [0,0,0,2,0,0|0,0,2]=4 901 B11R2.36 O=C1CC[C@H]2[C@@H](C1)CCC2 1P00NQDF [0,0,0,2,0,0|0,0,2]=4 902 B11R2.106 O=C1NNC[C@H]2[C@@H]1CCC2 1P027ZDS [0,0,0,2,0,0|2,0,0]=4 903 B11R2.678 O=C1CC2CCCC(C1)C2 1P000263 [0,0,0,2,0,0|0,0,2]=4 904 B11R2.678 O=C1CC2CCCN(C1)C2 1P00BMVM [0,0,0,2,0,0|1,0,1]=4 905 B11R2.1478 O=C1C=CCC2(C1)CCC2 1P01G7AL [0,0,0,2,0,0|0,0,0]=2 906 B11R2.1478 O=C1CCCC2(C1)CCC2 1P00NWSE [0,0,0,2,0,0|0,0,2]=4 907 B11R2.1478 O=C1NCCC2(C1)CCC2 1P01KKJW [0,0,0,2,0,0|1,0,1]=4 908 B11R2.1478 O=C1OCCC2(C1)CCC2 1P01C69D [0,0,0,2,0,0|1,0,1]=4 909 B11R2.1 O=C1CCC2C1CCCC2 1P00CFXK [0,0,0,2,0,0|0,0,2]=4 910 B11R2.1 O=C1CCC2N1CCCC2 1P007LJM [0,0,0,2,0,0|1,0,1]=4 911 B11R2.1 O=C1NCC2C1CCCC2 1P00BVXP [0,0,0,2,0,0|1,0,1]=4 912 B11R2.1 O=C1NC[C@H]2[C@@H]1CCCC2 1P00865D [0,0,0,2,0,0|1,0,1]=4 913 B11R2.1 O=C1OCC2C1CCCC2 1P01DU6Y [0,0,0,2,0,0|1,0,1]=4 914 B11R2.1 O=C1OC[C@H]2[C@@H]1CCCC2 1P005N8F [0,0,0,2,0,0|1,0,1]=4 915 B11R2.10 O=C1C=C2C(S1)CCNC2 1P000GHN [0,0,0,2,0,0|2,0,0]=4 916 B11R2.10 O=C1CC2C(=C1)CCCC2 1P01E7HW [0,0,0,2,0,0|0,0,0]=2 917 B11R2.10 O=C1CC2C(C1)CCCC2 1P01BJW6 [0,0,0,2,0,0|0,0,2]=4 918 B11R2.10 O=C1CC2N(C1)CCCC2 1P01A36Q [0,0,0,2,0,0|1,0,1]=4 919 B11R2.10 O=C1CC2N(C1)CCCC2 1P01EKB9 [0,0,0,2,0,0|1,0,1]=4 920 B11R2.10 O=C1CC2N(N1)CCCC2 1P0280KY [0,0,0,2,0,0|2,0,0]=4 921 B11R2.10 O=C1C[C@H]2[C@@H](N1)CCCC2 1P009L8O [0,0,0,2,0,0|1,0,1]=4 922 B11R2.10 O=c1cc2n([nH]1)CCCC2 1P01X0Y8 [0,0,0,2,0,0|2,0,0]=4 923 B11R2.352 O=C1NCC(C1)C2CCC2 1P00BIQ9 [0,0,0,2,0,0|1,0,1]=4 924 B11R2.359 O=C1NCC2CC(C1)CC2 1P01C7OM [0,0,0,2,0,0|1,0,1]=4 925 B11R2.748 O=C1C=CC2(C1)CCCC2 1P01EMG9 [0,0,0,2,0,0|0,0,0]=2 926 B11R2.748 O=C1CNC2(C1)CCCC2 1P02815B [0,0,0,2,0,0|1,0,1]=4 927 B11R2.748 O=C1COC2(C1)CCCC2 1P0205LV [0,0,0,2,0,0|1,0,1]=4 928 B11R2.748 O=C1NCC2(C1)CCCC2 1P005VG2 [0,0,0,2,0,0|1,0,1]=4 929 B11R2.748 O=C1OCC2(C1)CCCC2 1P01AGNF [0,0,0,2,0,0|1,0,1]=4 930 B11R2.433 O=C1CC2CCC(N1)CC2 1P01C3NL [0,0,0,2,0,0|1,0,1]=4 931 B11R2.703 O=C1CC2(C1)CCCCC2 1P01A24S [0,0,0,2,0,0|0,0,2]=4 932 B11R2.703 O=C1CC2(N1)CCCCC2 1P002P2Z [0,0,0,2,0,0|1,0,1]=4 933 B11R2.11 O=C1CC(C1)C2CCCC2 1P01C37I [0,0,0,2,0,0|0,0,2]=4 934 B11R2.711 O=C1NC2C1CCCCC2 1P019YTG [0,0,0,2,0,0|1,0,1]=4 935 B11R2.845 CC(=O)C1CC2CC1CC2 1P00EADR [0,0,0,2,0,0|0,0,2]=4 936 B11R2.845 OC(=O)C1=CC2CC1CC2 1P005TVB [0,0,0,2,0,0|1,0,0]=3 937 B11R2.813 CC(=O)C12CCCCC1O2 1P001NMX [0,0,0,2,0,0|1,0,1]=4 938 B11R2.814 OC(=O)C1=CC2C1CCC2 1P028PS2 [0,0,0,2,0,0|1,0,0]=3