"molecule_id","AAC","AECC","ALOGP","ALOGP2","AMR","AMW","ARR","ATS1e","ATS1i","ATS1m","ATS1p","ATS1s","ATS1v","ATS2e","ATS2i","ATS2m","ATS2p","ATS2s","ATS2v","ATS3e","ATS3i","ATS3m","ATS3p","ATS3s","ATS3v","ATS4e","ATS4i","ATS4m","ATS4p","ATS4s","ATS4v","ATS5e","ATS5i","ATS5m","ATS5p","ATS5s","ATS5v","ATS6e","ATS6i","ATS6m","ATS6p","ATS6s","ATS6v","ATS7e","ATS7i","ATS7m","ATS7p","ATS7s","ATS7v","ATS8e","ATS8i","ATS8m","ATS8p","ATS8s","ATS8v","ATSC1e","ATSC1i","ATSC1m","ATSC1p","ATSC1s","ATSC1v","ATSC2e","ATSC2i","ATSC2m","ATSC2p","ATSC2s","ATSC2v","ATSC3e","ATSC3i","ATSC3m","ATSC3p","ATSC3s","ATSC3v","ATSC4e","ATSC4i","ATSC4m","ATSC4p","ATSC4s","ATSC4v","ATSC5e","ATSC5i","ATSC5m","ATSC5p","ATSC5s","ATSC5v","ATSC6e","ATSC6i","ATSC6m","ATSC6p","ATSC6s","ATSC6v","ATSC7e","ATSC7i","ATSC7m","ATSC7p","ATSC7s","ATSC7v","ATSC8e","ATSC8i","ATSC8m","ATSC8p","ATSC8s","ATSC8v","BAC","BBI","BIC0","BIC1","BIC2","BIC3","BIC4","BIC5","BID","BLI","BLTA96","BLTD48","BLTF96","C.","C.001","C.002","C.003","C.005","C.006","C.016","C.019","C.024","C.025","C.026","C.028","C.029","C.040","C.041","CATS2D_00_DD","CATS2D_00_DP","CATS2D_00_PP","CATS2D_01_LL","CATS2D_02_AA","CATS2D_02_AL","CATS2D_02_AP","CATS2D_02_DA","CATS2D_02_DL","CATS2D_02_LL","CATS2D_02_PL","CATS2D_03_AA","CATS2D_03_AL","CATS2D_03_DL","CATS2D_03_LL","CATS2D_03_PL","CATS2D_04_AA","CATS2D_04_AL","CATS2D_04_AP","CATS2D_04_DA","CATS2D_04_DL","CATS2D_04_LL","CATS2D_04_PL","CATS2D_05_AA","CATS2D_05_AL","CATS2D_05_AP","CATS2D_05_DA","CATS2D_05_DL","CATS2D_05_LL","CATS2D_05_PL","CATS2D_06_AA","CATS2D_06_AL","CATS2D_06_AP","CATS2D_06_DA","CATS2D_06_DD","CATS2D_06_DL","CATS2D_06_DP","CATS2D_06_LL","CATS2D_06_PL","CATS2D_07_AA","CATS2D_07_AL","CATS2D_07_DL","CATS2D_07_LL","CATS2D_07_PL","CATS2D_08_AA","CATS2D_08_AL","CATS2D_08_DA","CATS2D_08_DD","CATS2D_08_DL","CATS2D_08_LL","CATS2D_08_PL","CATS2D_09_AA","CATS2D_09_AL","CATS2D_09_DL","CATS2D_09_LL","CATS2D_09_PL","CENT","Chi0_AEA.bo.","Chi0_AEA.dm.","Chi0_AEA.ed.","Chi0_AEA.ri.","Chi0_EA","Chi0_EA.bo.","Chi0_EA.dm.","Chi0_EA.ed.","Chi0_EA.ri.","Chi1_AEA.bo.","Chi1_AEA.dm.","Chi1_AEA.ed.","Chi1_AEA.ri.","Chi1_EA","Chi1_EA.bo.","Chi1_EA.dm.","Chi1_EA.ed.","Chi1_EA.ri.","CIC0","CIC1","CIC2","CIC3","CIC4","CIC5","CID","Cl.089","CMC.50","CMC.80","cRo5","CSI","DBI","D.Dtr05","D.Dtr06","DECC","DELS","Depressant.50","Depressant.80","DLS_01","DLS_02","DLS_03","DLS_04","DLS_06","DLS_07","DLS_cons","Dz","ECC","Eig01_AEA.bo.","Eig01_AEA.dm.","Eig01_AEA.ed.","Eig01_AEA.ri.","Eig01_EA","Eig01_EA.bo.","Eig01_EA.dm.","Eig01_EA.ed.","Eig01_EA.ri.","Eig02_AEA.bo.","Eig02_AEA.dm.","Eig02_AEA.ed.","Eig02_AEA.ri.","Eig02_EA","Eig02_EA.bo.","Eig02_EA.dm.","Eig02_EA.ed.","Eig02_EA.ri.","Eig03_AEA.bo.","Eig03_AEA.dm.","Eig03_AEA.ed.","Eig03_AEA.ri.","Eig03_EA","Eig03_EA.bo.","Eig03_EA.dm.","Eig03_EA.ed.","Eig03_EA.ri.","Eig04_AEA.bo.","Eig04_AEA.dm.","Eig04_AEA.ed.","Eig04_AEA.ri.","Eig04_EA","Eig04_EA.bo.","Eig04_EA.dm.","Eig04_EA.ed.","Eig04_EA.ri.","Eig05_AEA.bo.","Eig05_AEA.dm.","Eig05_AEA.ed.","Eig05_AEA.ri.","Eig05_EA","Eig05_EA.bo.","Eig05_EA.dm.","Eig05_EA.ed.","Eig05_EA.ri.","Eig06_AEA.bo.","Eig06_AEA.dm.","Eig06_AEA.ed.","Eig06_AEA.ri.","Eig06_EA","Eig06_EA.bo.","Eig06_EA.dm.","Eig06_EA.ed.","Eig06_EA.ri.","Eig07_AEA.bo.","Eig07_AEA.dm.","Eig07_AEA.ed.","Eig07_AEA.ri.","Eig07_EA","Eig07_EA.bo.","Eig07_EA.dm.","Eig07_EA.ed.","Eig07_EA.ri.","Eig08_AEA.bo.","Eig08_AEA.dm.","Eig08_AEA.ed.","Eig08_AEA.ri.","Eig08_EA","Eig08_EA.bo.","Eig08_EA.dm.","Eig08_EA.ed.","Eig08_EA.ri.","Eig09_AEA.bo.","Eig09_AEA.dm.","Eig09_AEA.ed.","Eig09_AEA.ri.","Eig09_EA","Eig09_EA.bo.","Eig09_EA.ed.","Eig09_EA.ri.","Eig10_AEA.bo.","Eig10_AEA.dm.","Eig10_AEA.ed.","Eig10_AEA.ri.","Eig10_EA","Eig10_EA.bo.","Eig10_EA.ed.","Eig10_EA.ri.","Eig11_AEA.bo.","Eig11_AEA.dm.","Eig11_AEA.ed.","Eig11_AEA.ri.","Eig11_EA","Eig11_EA.bo.","Eig11_EA.ed.","Eig11_EA.ri.","Eig12_AEA.bo.","Eig12_AEA.dm.","Eig12_AEA.ed.","Eig12_AEA.ri.","Eig12_EA","Eig12_EA.bo.","Eig12_EA.ed.","Eig12_EA.ri.","Eig13_AEA.bo.","Eig13_AEA.dm.","Eig13_AEA.ed.","Eig13_AEA.ri.","Eig13_EA","Eig13_EA.bo.","Eig13_EA.ed.","Eig13_EA.ri.","Eig14_AEA.bo.","Eig14_AEA.dm.","Eig14_AEA.ed.","Eig14_AEA.ri.","Eig14_EA","Eig14_EA.bo.","Eig14_EA.ed.","Eig14_EA.ri.","Eig15_AEA.bo.","Eig15_AEA.dm.","Eig15_AEA.ed.","Eig15_AEA.ri.","Eig15_EA","Eig15_EA.bo.","Eig15_EA.ed.","Eig15_EA.ri.","Eta_alpha","Eta_alpha_A","Eta_B","Eta_B_A","Eta_beta","Eta_beta_A","Eta_betaP","Eta_betaP_A","Eta_betaS","Eta_betaS_A","Eta_C","Eta_C_A","Eta_epsi","Eta_epsi_A","Eta_F","Eta_F_A","Eta_FL","Eta_FL_A","Eta_L","Eta_L_A","Eta_sh_p","Eta_sh_y","GATS1e","GATS1i","GATS1m","GATS1p","GATS1s","GATS1v","GATS2e","GATS2i","GATS2m","GATS2p","GATS2s","GATS2v","GATS3e","GATS3i","GATS3m","GATS3p","GATS3s","GATS3v","GATS4e","GATS4i","GATS4m","GATS4p","GATS4s","GATS4v","GATS5e","GATS5i","GATS5m","GATS5p","GATS5s","GATS5v","GATS6e","GATS6i","GATS6m","GATS6p","GATS6s","GATS6v","GATS7e","GATS7i","GATS7m","GATS7p","GATS7s","GATS7v","GATS8e","GATS8i","GATS8m","GATS8p","GATS8s","GATS8v","GGI1","GGI10","GGI2","GGI3","GGI4","GGI5","GGI6","GGI7","GGI8","GGI9","GMTI","GMTIV","GNar","H.","H.046","H.047","H.050","H.052","H.053","HDcpx","HNar","HVcpx","Hy","Hypertens.50","Hypertens.80","Hypnotic.80","IAC","IC0","IC1","IC2","IC3","IC4","IC5","ICR","IDDE","IDDM","IDE","IDET","IDM","IDMT","Infective.50","Infective.80","Inflammat.80","ISIZ","IVDE","IVDM","JGI1","JGI10","JGI2","JGI3","JGI4","JGI5","JGI6","JGI7","JGI8","JGI9","JGT","LLS_01","LLS_02","LOC","LPRS","MATS1e","MATS1i","MATS1m","MATS1p","MATS1s","MATS1v","MATS2e","MATS2i","MATS2m","MATS2p","MATS2s","MATS2v","MATS3e","MATS3i","MATS3m","MATS3p","MATS3s","MATS3v","MATS4e","MATS4i","MATS4m","MATS4p","MATS4s","MATS4v","MATS5e","MATS5i","MATS5m","MATS5p","MATS5s","MATS5v","MATS6e","MATS6i","MATS6m","MATS6p","MATS6s","MATS6v","MATS7e","MATS7i","MATS7m","MATS7p","MATS7s","MATS7v","MATS8e","MATS8i","MATS8m","MATS8p","MATS8s","MATS8v","MAXDN","MAXDP","MCD","MDDD","Me","Mi","MLOGP","MLOGP2","Mp","MPC01","MPC02","MPC03","MPC04","MPC05","MPC06","MPC07","MPC08","MPC09","MPC10","MSD","Mv","MW","MWC01","MWC02","MWC03","MWC04","MWC05","MWC06","MWC07","MWC08","MWC09","MWC10","N.","N.067","N.068","N.069","N.072","N.074","N.075","NaaCH","NaaN","nAB","nArCN","nArCONH2","nArNH2","nArOCON","nArOH","nArOR","nArX","nAT","nBM","nBnz","nBO","nBT","nC","nCar","nCb.","nCbH","nCconj","nCIC","nCIR","nCL","nCp","nCrs","nCrt","nCs","nCsp","nCsp2","nCsp3","nCt","nDB","NdO","NdS","NdsCH","NdssC","Neoplastic.50","Neoplastic.80","nH","nHAcc","nHDon","nHet","nHM","nN","nN.CO.2","nO","nPyridines","nPyrrolidines","nR05","nR06","nR.Cs","nRNHR","nRNR2","NRS","nS","NsCH3","NsCl","nSK","NsNH2","NsOH","NssCH2","NssNH","NssO","NssS","NsssCH","NsssN","nTB","NtN","NtsC","nX","O.","O.057","O.058","O.060","ON0","ON0V","ON1","ON1V","PCD","PCR","PDI","PHI","piID","piPC01","piPC02","piPC03","piPC04","piPC05","piPC06","piPC07","piPC08","piPC09","piPC10","PJI2","Pol","Psi_e_0","Psi_e_1","Psi_e_A","Psi_i_0","Psi_i_1","Psi_i_A","Psi_i_s","P_VSA_e_1","P_VSA_e_2","P_VSA_e_3","P_VSA_e_4","P_VSA_e_5","P_VSA_i_1","P_VSA_i_2","P_VSA_i_3","P_VSA_i_4","P_VSA_LogP_1","P_VSA_LogP_2","P_VSA_LogP_3","P_VSA_LogP_4","P_VSA_LogP_5","P_VSA_LogP_6","P_VSA_LogP_7","P_VSA_LogP_8","P_VSA_m_1","P_VSA_m_2","P_VSA_m_3","P_VSA_m_4","P_VSA_MR_1","P_VSA_MR_2","P_VSA_MR_5","P_VSA_MR_6","P_VSA_MR_7","P_VSA_MR_8","P_VSA_p_1","P_VSA_p_2","P_VSA_p_3","P_VSA_s_2","P_VSA_s_3","P_VSA_s_4","P_VSA_s_5","P_VSA_s_6","P_VSA_v_1","P_VSA_v_2","P_VSA_v_3","PW2","PW3","PW4","PW5","Qindex","Ram","RBF","RBN","RDCHI","RDSQ","Rperim","S0K","S.107","S.108","S1K","S2K","S3K","SAacc","SaaCH","SaaN","SaasC","SAdon","SAtot","SCBO","SdO","SdS","SdsCH","SdssC","Se","Si","SIC0","SIC1","SIC2","SIC3","SIC4","SIC5","SM02_AEA.bo.","SM02_AEA.dm.","SM02_AEA.ed.","SM02_AEA.ri.","SM02_EA","SM02_EA.bo.","SM02_EA.dm.","SM02_EA.ed.","SM02_EA.ri.","SM03_AEA.bo.","SM03_AEA.dm.","SM03_AEA.ed.","SM03_AEA.ri.","SM03_EA","SM03_EA.bo.","SM03_EA.dm.","SM03_EA.ed.","SM03_EA.ri.","SM04_AEA.bo.","SM04_AEA.dm.","SM04_AEA.ed.","SM04_AEA.ri.","SM04_EA","SM04_EA.bo.","SM04_EA.dm.","SM04_EA.ed.","SM04_EA.ri.","SM05_AEA.bo.","SM05_AEA.dm.","SM05_AEA.ed.","SM05_AEA.ri.","SM05_EA","SM05_EA.bo.","SM05_EA.dm.","SM05_EA.ed.","SM05_EA.ri.","SM06_AEA.bo.","SM06_AEA.dm.","SM06_AEA.ed.","SM06_AEA.ri.","SM06_EA","SM06_EA.bo.","SM06_EA.dm.","SM06_EA.ed.","SM06_EA.ri.","SM07_AEA.bo.","SM07_AEA.dm.","SM07_AEA.ed.","SM07_AEA.ri.","SM07_EA","SM07_EA.bo.","SM07_EA.dm.","SM07_EA.ed.","SM07_EA.ri.","SM08_AEA.bo.","SM08_AEA.dm.","SM08_AEA.ed.","SM08_AEA.ri.","SM08_EA","SM08_EA.bo.","SM08_EA.dm.","SM08_EA.ed.","SM08_EA.ri.","SM09_AEA.bo.","SM09_AEA.dm.","SM09_AEA.ed.","SM09_AEA.ri.","SM09_EA","SM09_EA.bo.","SM09_EA.dm.","SM09_EA.ed.","SM09_EA.ri.","SM10_AEA.bo.","SM10_AEA.dm.","SM10_AEA.ed.","SM10_AEA.ri.","SM10_EA","SM10_EA.bo.","SM10_EA.dm.","SM10_EA.ed.","SM10_EA.ri.","SM11_AEA.bo.","SM11_AEA.dm.","SM11_AEA.ed.","SM11_AEA.ri.","SM11_EA","SM11_EA.bo.","SM11_EA.dm.","SM11_EA.ed.","SM11_EA.ri.","SM12_AEA.bo.","SM12_AEA.dm.","SM12_AEA.ed.","SM12_AEA.ri.","SM12_EA","SM12_EA.bo.","SM12_EA.dm.","SM12_EA.ed.","SM12_EA.ri.","SM13_AEA.bo.","SM13_AEA.dm.","SM13_AEA.ed.","SM13_AEA.ri.","SM13_EA","SM13_EA.bo.","SM13_EA.dm.","SM13_EA.ed.","SM13_EA.ri.","SM14_AEA.bo.","SM14_AEA.dm.","SM14_AEA.ed.","SM14_AEA.ri.","SM14_EA","SM14_EA.bo.","SM14_EA.dm.","SM14_EA.ed.","SM14_EA.ri.","SM15_AEA.bo.","SM15_AEA.dm.","SM15_AEA.ed.","SM15_AEA.ri.","SM15_EA","SM15_EA.bo.","SM15_EA.dm.","SM15_EA.ed.","SM15_EA.ri.","SMTI","SMTIV","SNar","Sp","SpAD_AEA.bo.","SpAD_AEA.dm.","SpAD_AEA.ed.","SpAD_AEA.ri.","SpAD_EA","SpAD_EA.bo.","SpAD_EA.dm.","SpAD_EA.ed.","SpAD_EA.ri.","SpDiam_AEA.bo.","SpDiam_AEA.dm.","SpDiam_AEA.ed.","SpDiam_AEA.ri.","SpDiam_EA","SpDiam_EA.bo.","SpDiam_EA.dm.","SpDiam_EA.ed.","SpDiam_EA.ri.","SPI","SpMAD_AEA.bo.","SpMAD_AEA.dm.","SpMAD_AEA.ed.","SpMAD_AEA.ri.","SpMAD_EA","SpMAD_EA.bo.","SpMAD_EA.dm.","SpMAD_EA.ed.","SpMAD_EA.ri.","SpMax1_Bh.e.","SpMax1_Bh.i.","SpMax1_Bh.m.","SpMax1_Bh.p.","SpMax1_Bh.s.","SpMax1_Bh.v.","SpMax2_Bh.e.","SpMax2_Bh.i.","SpMax2_Bh.m.","SpMax2_Bh.p.","SpMax2_Bh.s.","SpMax2_Bh.v.","SpMax3_Bh.e.","SpMax3_Bh.i.","SpMax3_Bh.m.","SpMax3_Bh.p.","SpMax3_Bh.s.","SpMax3_Bh.v.","SpMax4_Bh.e.","SpMax4_Bh.i.","SpMax4_Bh.m.","SpMax4_Bh.p.","SpMax4_Bh.s.","SpMax4_Bh.v.","SpMax5_Bh.e.","SpMax5_Bh.i.","SpMax5_Bh.m.","SpMax5_Bh.p.","SpMax5_Bh.s.","SpMax5_Bh.v.","SpMax6_Bh.e.","SpMax6_Bh.i.","SpMax6_Bh.m.","SpMax6_Bh.p.","SpMax6_Bh.s.","SpMax6_Bh.v.","SpMax7_Bh.e.","SpMax7_Bh.i.","SpMax7_Bh.m.","SpMax7_Bh.p.","SpMax7_Bh.s.","SpMax7_Bh.v.","SpMax8_Bh.e.","SpMax8_Bh.i.","SpMax8_Bh.m.","SpMax8_Bh.p.","SpMax8_Bh.s.","SpMax8_Bh.v.","SpMaxA_AEA.bo.","SpMaxA_AEA.dm.","SpMaxA_AEA.ed.","SpMaxA_AEA.ri.","SpMaxA_EA","SpMax_AEA.bo.","SpMaxA_EA.bo.","SpMax_AEA.dm.","SpMaxA_EA.dm.","SpMax_AEA.ed.","SpMaxA_EA.ed.","SpMax_AEA.ri.","SpMaxA_EA.ri.","SpMax_EA","SpMax_EA.bo.","SpMax_EA.dm.","SpMax_EA.ed.","SpMax_EA.ri.","SpMin1_Bh.e.","SpMin1_Bh.i.","SpMin1_Bh.m.","SpMin1_Bh.p.","SpMin1_Bh.s.","SpMin1_Bh.v.","SpMin2_Bh.e.","SpMin2_Bh.i.","SpMin2_Bh.m.","SpMin2_Bh.p.","SpMin2_Bh.s.","SpMin2_Bh.v.","SpMin3_Bh.e.","SpMin3_Bh.i.","SpMin3_Bh.m.","SpMin3_Bh.p.","SpMin3_Bh.s.","SpMin3_Bh.v.","SpMin4_Bh.e.","SpMin4_Bh.i.","SpMin4_Bh.m.","SpMin4_Bh.p.","SpMin4_Bh.s.","SpMin4_Bh.v.","SpMin5_Bh.e.","SpMin5_Bh.i.","SpMin5_Bh.m.","SpMin5_Bh.p.","SpMin5_Bh.s.","SpMin5_Bh.v.","SpMin6_Bh.e.","SpMin6_Bh.i.","SpMin6_Bh.m.","SpMin6_Bh.p.","SpMin6_Bh.s.","SpMin6_Bh.v.","SpMin7_Bh.e.","SpMin7_Bh.i.","SpMin7_Bh.m.","SpMin7_Bh.p.","SpMin7_Bh.s.","SpMin7_Bh.v.","SpMin8_Bh.e.","SpMin8_Bh.i.","SpMin8_Bh.m.","SpMin8_Bh.p.","SpMin8_Bh.s.","SpMin8_Bh.v.","SRW02","SRW04","SRW05","SRW06","SRW07","SRW08","SRW09","SRW10","SsCH3","SsCl","SsNH2","SsOH","SssCH2","SssNH","SssO","SssS","SsssCH","SsssN","StN","StsC","Sv","TIC0","TIC1","TIC2","TIC3","TIC4","TIC5","TIE","TPC","TPSA.NO.","TPSA.Tot.","TRS","TWC","Uc","Ui","Uindex","UNIP","VAR","Vindex","VvdwMG","VvdwZAZ","Vx","Wap","X.","X0","X0A","X0Av","X0sol","X0v","X1","X1A","X1Av","X1Kup","X1Mad","X1MulPer","X1Per","X1sol","X1v","X2","X2A","X2Av","X2sol","X2v","X3","X3A","X3Av","X3sol","X3v","X4","X4A","X4Av","X4sol","X4v","X5","X5A","X5Av","X5sol","X5v","Xindex","XMOD","Xt","Xu","Yindex","ZM1","ZM1Kup","ZM1Mad","ZM1MulPer","ZM1Per","ZM1V","ZM2","ZM2Kup","ZM2Mad","ZM2MulPer","ZM2Per","ZM2V","pXC50"
{1 1.648,2 19.146,3 5.328,4 28.391,5 169.105,6 8.066,7 0.4,8 4.385,9 4.492,10 4.05,11 3.967,12 5.486,13 3.927,14 4.921,15 5.082,16 4.472,17 4.358,18 6.009,19 4.294,20 5.173,21 5.36,22 4.483,23 4.497,24 6.216,25 4.407,26 5.24,27 5.456,28 4.454,29 4.506,30 6.305,31 4.374,32 5.202,33 5.433,34 4.387,35 4.486,36 6.209,37 4.333,38 5.083,39 5.288,40 4.277,41 4.368,42 6.141,43 4.238,44 4.997,45 5.214,46 4.227,47 4.228,48 6.079,49 4.124,50 4.855,51 5.059,52 4.098,53 4.208,54 5.877,55 4.079,56 0.038,57 1.038,58 14.07,59 6.85,60 10.722,61 8.307,62 0.36,63 1.748,64 32.187,65 11.684,66 35.978,67 13.943,68 0.466,69 2.083,70 41.076,71 15.86,72 48.707,73 18.972,74 0.667,75 2.16,76 46.876,77 17.986,78 85.431,79 22.148,80 0.501,81 2.139,82 52.182,83 18.912,84 71.087,85 22.623,86 0.416,87 1.888,88 43.589,89 16.063,90 64.647,91 18.767,92 0.631,93 1.709,94 39.59,95 13.545,96 70.907,97 16.403,98 0.365,99 1.525,100 30.832,101 12.428,102 46.508,103 15.585,104 27,105 62,106 0.254,107 0.559,108 0.706,109 0.802,110 0.845,111 0.851,112 3.741,113 0.979,114 -3.71,115 -3.67,116 -3.5,117 42.5,119 1,121 1,122 6,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 11,136 1,137 12,138 1,139 1,140 1,141 13,142 1,143 1,144 12,145 1,146 9,147 1,148 2,149 8,150 1,151 1,152 2,153 10,154 2,155 1,156 9,159 1,160 16,161 1,163 8,167 2,169 12,170 2,171 2,172 7,173 2,174 12,175 2,176 2,177 2,180 1,181 11,182 1,183 1,184 5,185 1,186 8,187 1,188 4095,189 27.723,190 27.723,191 27.723,192 27.723,193 27.723,194 24.999,195 34.554,196 16.43,197 28.539,198 22.206,199 22.206,200 22.206,201 22.206,202 22.206,203 18,204 43.665,205 7.829,206 23.571,207 4.542,208 2.561,209 1.608,210 0.985,211 0.706,212 0.668,213 4.445,217 1,218 1701,219 3.873,220 134.616,221 649.04,222 3.523,223 39.924,226 0.75,227 0.67,228 0.67,229 0.7,230 0.67,231 1,232 0.71,233 88,234 785,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.952,241 4.506,242 11.323,243 2.982,244 4.335,245 3.688,246 6.417,247 3.96,248 2.983,249 3.895,250 1.192,251 9.812,252 2.919,253 4.078,254 3.555,255 5.804,256 3.651,257 2.674,258 3.675,259 0.98,260 8.023,261 2.613,262 3.941,263 3.361,264 5.481,265 3.543,266 2.62,267 3.448,268 0.86,269 7.275,270 2.438,271 3.653,272 3.036,273 5.413,274 3.508,275 2.555,276 2.956,277 0.86,278 7.155,279 2.407,280 3.617,281 2.95,282 5.347,283 3.249,284 2.311,285 2.674,286 0.8,287 6.904,288 2.155,289 3.422,290 2.885,291 5.15,292 3.055,293 2.121,294 2.617,295 0.8,296 6.259,297 1.99,298 3.303,299 2.549,300 4.928,301 3.013,302 2.079,303 2.544,304 0.553,305 5.695,306 1.921,307 3.253,308 2.494,309 4.889,310 2.856,311 1.868,312 2.403,313 5.234,314 1.841,315 3.114,316 2.455,317 4.76,318 2.668,319 1.799,320 2.115,321 4.933,322 1.517,323 2.877,324 2.216,325 4.445,326 2.407,327 1.46,328 2.024,329 3.923,330 1.384,331 2.773,332 1.716,333 3.724,334 2.379,335 1.416,336 1.743,337 3.131,338 1.337,339 2.532,340 1.687,341 3.604,342 2.216,343 1.275,344 1.5,345 2.996,346 1.166,347 2.5,348 1.529,349 3.466,350 2.016,351 1,352 1.5,353 2.304,354 1.01,355 2.5,356 1.312,357 3.414,358 2,359 1,360 1.475,361 2.275,362 1,363 20.1,364 0.49,365 0.976,366 0.024,367 51.5,368 1.256,369 25,370 0.61,371 26.5,372 0.646,373 38.347,374 0.935,375 43.5,376 0.596,377 43.492,378 1.061,379 10.238,380 0.25,381 9.63,382 0.235,383 0.119,384 0.308,385 0.8,386 1.238,387 0.686,388 0.927,389 0.633,390 0.91,391 0.982,392 1.021,393 0.724,394 0.827,395 0.532,396 0.863,397 1.218,398 0.937,399 0.882,400 0.907,401 0.867,402 0.957,403 0.945,404 0.886,405 0.821,406 0.865,407 0.774,408 0.942,409 0.876,410 0.868,411 1.059,412 0.976,413 0.948,414 0.888,415 1.161,416 1.029,417 1.132,418 1.073,419 1.131,420 1.014,421 1.061,422 0.88,423 0.877,424 0.898,425 1.014,426 0.883,427 0.644,428 0.942,429 0.894,430 0.959,431 0.769,432 1.01,433 8,434 0.295,435 4.222,436 2.917,437 2.184,438 1.216,439 1.005,440 0.602,441 0.316,442 0.32,443 35036,444 92335,445 2.09,446 43.8,448 28,449 2,451 2,452 1.799,453 1.968,454 4.137,455 0.137,459 120.277,460 1.648,461 3.629,462 4.582,463 5.205,464 5.484,465 5.522,466 3.607,467 4.87,468 5.321,469 4.407,470 3613.7,471 9.363,472 70801.8,476 451.857,477 1.363,478 5.294,479 0.178,480 0.007,481 0.068,482 0.046,483 0.038,484 0.022,485 0.02,486 0.013,487 0.007,488 0.008,489 0.408,490 0.33,491 0.63,492 0.632,493 241.31,494 -0.037,495 -0.139,496 0.05,497 -0.025,498 -0.055,499 0.003,500 0.001,501 0.07,502 0.134,503 0.087,504 0.105,505 0.053,506 -0.11,507 0.058,508 0.001,509 0.019,510 -0.002,511 -0.007,512 0.076,513 0.057,514 0.11,515 0.092,516 0.147,517 0.05,518 -0.003,519 0.104,520 0.068,521 0.109,522 0.031,523 0.148,524 -0.116,525 -0.05,526 -0.065,527 -0.027,528 -0.055,529 -0.015,530 0.065,531 0.097,532 0.095,533 0.06,534 0.021,535 0.091,536 0.118,537 0.035,538 0.015,539 0.011,540 0.011,541 -0.01,542 2.224,543 6.239,544 0.707,545 74.546,546 1.003,547 1.116,548 2.478,549 6.141,550 0.696,551 3.829,552 4.143,553 4.394,554 4.635,555 4.828,556 4.82,557 4.963,558 5.075,559 5.176,560 5.313,561 11.02,562 0.653,563 588.81,564 3.829,565 5.371,566 6.213,567 7.081,568 7.938,569 8.809,570 9.674,571 10.548,572 11.418,573 12.295,574 5.5,576 2,578 2,581 12,583 18,585 1,587 1,589 2,591 73,592 22,593 3,594 45,595 77,596 31,597 18,598 6,599 12,600 4,601 5,602 5,607 1,609 23,610 8,612 4,613 2,614 1,615 1,616 4,619 32,620 8,621 2,622 10,623 2,624 4,625 1,626 4,629 1,630 4,631 2,633 2,634 5,635 2,636 1,638 41,639 1,641 7,643 2,644 1,646 3,651 5.5,653 2,654 2,655 20.833,656 13.267,657 9,658 4.315,659 4.102,660 1.469,661 0.986,662 9.877,663 12.847,664 4.078,665 4.61,666 5.113,667 5.63,668 6.125,669 6.274,670 6.679,671 7.045,672 7.366,673 7.733,674 0.923,675 63,676 15.191,677 6.453,678 7.736,679 29.068,680 23.769,681 2.236,682 91.667,683 353.133,684 262.473,685 42.27,687 72.29,688 77.412,689 185.061,690 425.423,691 42.27,692 8.396,693 53.677,694 123.191,695 61.25,696 53.107,698 385.353,699 45.192,700 353.133,701 227.331,702 72.29,703 77.412,704 329.591,705 95.832,706 59.926,707 156.379,708 11.027,709 77.412,710 353.133,711 114.56,712 262.473,713 353.133,714 85.693,715 140.961,717 150.379,718 353.133,719 114.56,720 262.473,721 0.581,722 0.336,723 0.179,724 0.097,725 28,726 13,727 0.13,728 10,729 5.286,730 389.189,731 29,732 207.66,733 1,734 1,735 29.453,736 13.749,737 7.627,738 114.56,739 21.501,741 3.537,742 32.897,743 730.166,744 58,745 24.889,746 5.538,747 1.804,748 0.284,749 73.24,750 81.484,751 0.266,752 0.586,753 0.74,754 0.841,755 0.886,756 0.892,757 5.321,758 2.079,759 6.188,760 6.259,761 4.828,762 5.298,763 3.896,764 6.973,765 4.718,766 6.501,767 1.868,768 7.731,769 5.695,770 4.369,771 4.997,772 3.09,773 7.828,774 4.186,775 7.789,776 1.799,777 9.373,778 5.234,779 6.399,780 7.372,781 6.573,782 10.919,783 6.182,784 9.107,785 1.46,786 11.075,787 4.933,788 6.758,789 7.859,790 6.479,791 12.649,792 6.467,793 10.458,794 1.416,795 12.817,796 3.923,797 8.248,798 9.727,799 9.502,800 15.266,801 7.927,802 11.83,803 1.275,804 14.588,805 3.131,806 9,807 10.594,808 9.746,809 17.381,810 8.602,811 13.221,812 1,813 16.383,814 2.996,815 10.27,816 12.233,817 12.451,818 19.847,819 9.836,820 3.233,821 1,822 18.196,823 2.304,824 11.22,825 13.304,826 12.932,827 22.131,828 10.708,829 2.983,830 11.323,831 20.025,832 2.275,833 12.401,834 14.821,835 15.408,836 24.552,837 11.844,838 2.674,839 9.812,840 21.868,841 3.952,842 13.449,843 16.008,844 16.07,845 26.908,846 12.815,847 2.62,848 8.023,849 23.721,850 3.895,851 14.598,852 17.458,853 18.371,854 29.318,855 13.91,856 2.555,857 7.275,858 25.584,859 3.675,860 15.696,861 18.713,862 19.176,863 31.706,864 14.931,865 2.311,866 7.155,867 27.455,868 3.448,869 16.838,870 20.124,871 21.339,872 34.116,873 16.011,874 2.121,875 6.904,876 29.334,877 2.956,878 17.962,879 21.419,880 22.261,881 36.519,882 17.059,883 32819,884 53743,885 30.224,886 50.796,887 67.608,888 72.618,889 68.854,890 66.854,891 66.69,892 84.107,893 21.101,894 188.124,895 63.035,896 5.481,897 6.912,898 6.544,899 5.287,900 5.233,901 6.952,902 8.641,903 18.496,904 4.982,905 20.69,906 1.502,907 1.614,908 1.53,909 1.486,910 1.482,911 1.869,912 0.469,913 4.181,914 1.401,915 4.016,916 4.037,917 4.223,918 3.951,919 7.438,920 3.939,921 3.928,922 3.949,923 3.92,924 3.849,925 7.427,926 3.848,927 3.866,928 3.925,929 3.824,930 3.803,931 4.958,932 3.798,933 3.842,934 3.878,935 3.78,936 3.655,937 4.875,938 3.661,939 3.647,940 3.662,941 3.723,942 3.617,943 4.848,944 3.559,945 3.529,946 3.587,947 3.395,948 3.361,949 4.723,950 3.352,951 3.338,952 3.391,953 3.381,954 3.092,955 4.64,956 3.117,957 3.199,958 3.292,959 3.258,960 3.078,961 4.412,962 3.031,963 0.1,964 0.109,965 0.152,966 0.092,967 0.072,968 4.481,969 0.088,970 4.912,971 0.1,972 6.859,973 0.252,974 4.152,975 0.066,976 3.233,977 3.952,978 4.506,979 11.323,980 2.982,981 1.936,982 1.92,983 2.028,984 2.036,985 1.336,986 2.037,987 1.888,988 1.865,989 2.02,990 2.031,991 1.134,992 2.029,993 1.859,994 1.838,995 1.98,996 1.988,997 1.118,998 1.987,999 1.797,1000 1.723,1001 1.963,1002 1.935,1003 1.062,1004 1.947,1005 1.54,1006 1.474,1007 1.81,1008 1.757,1009 1.053,1010 1.777,1011 1.428,1012 1.425,1013 1.539,1014 1.574,1015 0.825,1016 1.549,1017 1.235,1018 1.242,1019 1.513,1020 1.535,1021 0.659,1022 1.501,1023 1.214,1024 1.171,1025 1.482,1026 1.459,1027 0.625,1028 1.488,1029 4.511,1030 5.826,1031 2.398,1032 7.326,1033 4.844,1034 8.907,1035 7.002,1036 10.532,1037 2.161,1039 5.436,1041 7.104,1043 11.776,1044 1.265,1046 6.372,1049 47.694,1050 120.277,1051 264.881,1052 334.499,1053 379.983,1054 400.347,1055 403.102,1056 82.668,1057 8.746,1058 90.03,1059 150.36,1060 29,1061 12.835,1062 4.524,1063 3.807,1064 66.979,1065 269,1066 299,1067 0.117,1068 298.534,1069 532.22,1070 720.183,1071 105767,1073 28.769,1074 0.702,1075 0.597,1076 29.623,1077 24.457,1078 19.868,1079 0.442,1080 0.326,1081 13.375,1082 18.511,1083 12.969,1084 10.711,1085 20.565,1086 14.682,1087 17.911,1088 0.289,1089 0.187,1090 19.086,1091 11.565,1092 14.791,1093 0.185,1094 0.103,1095 15.903,1096 8.232,1097 12.198,1098 0.12,1099 0.058,1100 13.586,1101 5.9,1102 9.831,1103 0.079,1104 0.033,1105 11.019,1106 4.08,1107 0.194,1108 131.156,1109 0.182,1110 38.039,1111 0.293,1112 214,1113 630.911,1114 279.243,1115 648.469,1116 877.21,1117 606,1118 249,1119 611.058,1120 302.078,1121 640.87,1122 940.54,1123 602,1124 4.921}
{0 CHEMBL2070412,1 1.648,2 19.634,3 5.328,4 28.391,5 169.105,6 8.066,7 0.4,8 4.385,9 4.492,10 4.05,11 3.967,12 5.486,13 3.927,14 4.921,15 5.082,16 4.472,17 4.358,18 6.012,19 4.294,20 5.173,21 5.36,22 4.47,23 4.497,24 6.219,25 4.403,26 5.234,27 5.457,28 4.42,29 4.499,30 6.25,31 4.361,32 5.189,33 5.423,34 4.381,35 4.467,36 6.214,37 4.309,38 5.059,39 5.265,40 4.241,41 4.339,42 6.083,43 4.206,44 4.952,45 5.166,46 4.232,47 4.214,48 6.018,49 4.115,50 4.848,51 5.035,52 4.141,53 4.223,54 5.939,55 4.106,56 0.038,57 1.038,58 14.07,59 6.85,60 10.645,61 8.307,62 0.36,63 1.748,64 32.187,65 11.684,66 36.179,67 13.943,68 0.481,69 2.083,70 41.095,71 15.859,72 51.453,73 18.958,74 0.526,75 2.157,76 46.858,77 18.013,78 74.673,79 22.232,80 0.593,81 2.105,82 51.886,83 18.844,84 78.188,85 22.782,86 0.453,87 1.832,88 43.213,89 15.736,90 62.466,91 18.217,92 0.571,93 1.642,94 37.762,95 13.153,96 58.831,97 15.988,98 0.344,99 1.527,100 29.526,101 12.119,102 48.406,103 15.001,104 27,105 62,106 0.254,107 0.559,108 0.706,109 0.812,110 0.851,111 0.851,112 3.741,113 0.978,114 -3.71,115 -3.67,116 -3.5,117 42.5,119 1,121 1,122 6,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 11,136 1,137 12,138 1,139 1,140 1,141 13,142 1,143 1,144 13,145 2,146 9,147 2,148 1,149 7,152 1,153 10,154 1,155 2,156 9,157 1,158 1,159 1,160 16,161 1,163 6,169 12,171 2,172 7,173 2,174 12,175 2,176 2,177 3,180 2,181 11,182 2,183 1,184 5,185 1,186 8,187 1,188 4164,189 27.67,190 27.67,191 27.67,192 27.67,193 27.67,194 24.975,195 34.554,196 16.372,197 28.494,198 22.212,199 22.212,200 22.212,201 22.212,202 22.212,203 18.018,204 43.02,205 7.827,206 23.586,207 4.542,208 2.561,209 1.608,210 0.919,211 0.668,212 0.668,213 4.445,217 1,218 1744,219 3.873,220 136.25,221 654.206,222 3.625,223 39.223,226 0.75,227 0.67,228 0.67,229 0.7,230 0.67,231 1,232 0.71,233 88,234 805,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.904,241 4.506,242 11.323,243 2.982,244 4.214,245 3.688,246 5.983,247 3.829,248 2.844,249 3.811,250 1.192,251 8.531,252 2.81,253 4.08,254 3.506,255 5.805,256 3.66,257 2.681,258 3.673,259 0.98,260 8.027,261 2.619,262 3.951,263 3.361,264 5.555,265 3.544,266 2.621,267 3.453,268 0.86,269 7.472,270 2.444,271 3.708,272 3.06,273 5.413,274 3.519,275 2.57,276 3.022,277 0.86,278 7.156,279 2.408,280 3.618,281 2.95,282 5.365,283 3.325,284 2.378,285 2.847,286 0.8,287 6.991,288 2.238,289 3.543,290 2.885,291 5.231,292 3.131,293 2.179,294 2.62,295 0.8,296 6.483,297 2.06,298 3.336,299 2.534,300 4.944,301 3.022,302 2.109,303 2.599,304 0.553,305 5.696,306 1.927,307 3.256,308 2.494,309 4.898,310 2.923,311 1.956,312 2.4,313 5.679,314 1.886,315 3.114,316 2.455,317 4.888,318 2.667,319 1.804,320 2.115,321 5.203,322 1.516,323 2.829,324 2.212,325 4.446,326 2.386,327 1.456,328 1.908,329 3.924,330 1.338,331 2.767,332 1.789,333 3.764,334 2.328,335 1.334,336 1.742,337 3.014,338 1.316,339 2.53,340 1.712,341 3.604,342 2.215,343 1.272,344 1.5,345 2.993,346 1.166,347 2.5,348 1.677,349 3.436,350 2.016,351 1,352 1.5,353 2.323,354 1.01,355 2.5,356 1.184,357 3.414,358 2,359 1,360 1.475,361 2.275,362 1,363 20.1,364 0.49,365 0.993,366 0.024,367 51.5,368 1.256,369 25,370 0.61,371 26.5,372 0.646,373 38.155,374 0.931,375 43.5,376 0.596,377 43.21,378 1.054,379 10.223,380 0.249,381 9.629,382 0.235,383 0.119,384 0.308,385 0.8,386 1.238,387 0.686,388 0.927,389 0.634,390 0.91,391 0.982,392 1.021,393 0.724,394 0.827,395 0.525,396 0.863,397 1.232,398 0.937,399 0.901,400 0.909,401 0.869,402 0.972,403 0.983,404 0.895,405 0.831,406 0.873,407 0.85,408 0.949,409 0.703,410 0.86,411 1.03,412 0.985,413 0.785,414 0.888,415 1.245,416 0.979,417 1.158,418 1.044,419 1.126,420 0.993,421 0.946,422 0.877,423 0.833,424 0.896,425 0.781,426 0.85,427 0.715,428 1.024,429 0.929,430 1.017,431 0.865,432 1.064,433 8.5,434 0.279,435 4,436 2.792,437 2.104,438 1.105,439 1.066,440 0.59,441 0.321,442 0.351,443 35468,444 93959,445 2.09,446 43.8,448 28,449 2,451 2,452 1.799,453 1.968,454 4.191,455 0.137,459 120.277,460 1.648,461 3.629,462 4.582,463 5.27,464 5.522,465 5.522,466 3.698,467 4.87,468 5.32,469 4.434,470 3635.92,471 9.361,472 71685.2,476 451.857,477 1.363,478 5.294,479 0.189,480 0.007,481 0.065,482 0.045,483 0.038,484 0.02,485 0.022,486 0.013,487 0.007,488 0.009,489 0.415,490 0.33,491 0.63,492 0.632,493 241.799,494 -0.037,495 -0.139,496 0.05,497 -0.025,498 -0.056,499 0.003,500 0.001,501 0.07,502 0.134,503 0.087,504 0.112,505 0.053,506 -0.125,507 0.058,508 -0.018,509 0.017,510 -0.002,511 -0.023,512 -0.022,513 0.047,514 0.101,515 0.086,516 0.059,517 0.05,518 0.143,519 0.108,520 0.105,521 0.107,522 0.133,523 0.154,524 -0.148,525 -0.005,526 -0.074,527 0.009,528 -0.096,529 0.007,530 0.115,531 0.1,532 0.142,533 0.074,534 0.095,535 0.132,536 0.099,537 -0.029,538 -0.033,539 -0.052,540 0.02,541 -0.081,542 2.181,543 6.23,544 0.707,545 76.434,546 1.003,547 1.116,548 2.478,549 6.141,550 0.696,551 3.829,552 4.143,553 4.382,554 4.615,555 4.82,556 4.812,557 4.977,558 5.069,559 5.165,560 5.313,561 11.172,562 0.653,563 588.81,564 3.829,565 5.371,566 6.209,567 7.074,568 7.927,569 8.795,570 9.656,571 10.527,572 11.394,573 12.268,574 5.5,576 2,578 2,581 12,583 18,585 1,587 1,589 2,591 73,592 22,593 3,594 45,595 77,596 31,597 18,598 6,599 12,600 4,601 5,602 5,607 1,609 23,610 8,612 4,613 2,614 1,615 1,616 4,619 32,620 8,621 2,622 10,623 2,624 4,625 1,626 4,629 1,630 4,631 2,633 2,634 5,635 2,636 1,638 41,639 1,641 7,643 2,644 1,646 3,651 5.5,653 2,654 2,655 20.833,656 13.267,657 8.972,658 4.308,659 4.014,660 1.459,661 0.986,662 9.877,663 12.76,664 4.078,665 4.61,666 5.104,667 5.616,668 6.125,669 6.271,670 6.695,671 7.036,672 7.358,673 7.737,674 1,675 62,676 15.181,677 6.44,678 7.736,679 29.068,680 23.765,681 2.236,682 91.667,683 353.133,684 262.473,685 42.27,687 72.29,688 77.412,689 185.061,690 425.423,691 42.27,692 8.396,693 53.677,694 123.191,695 61.25,696 53.107,698 385.353,699 45.192,700 353.133,701 227.331,702 72.29,703 77.412,704 329.591,705 95.832,706 59.926,707 156.379,708 11.027,709 77.412,710 353.133,711 114.56,712 262.473,713 353.133,714 85.693,715 140.961,717 150.379,718 353.133,719 114.56,720 262.473,721 0.582,722 0.333,723 0.174,724 0.096,725 28,726 13,727 0.13,728 10,729 5.318,730 386.767,731 29,732 207.66,733 1,734 1,735 29.453,736 13.749,737 7.829,738 114.56,739 21.487,741 3.804,742 32.897,743 730.166,744 58,745 24.635,746 5.539,747 1.814,748 0.349,749 73.24,750 81.484,751 0.266,752 0.586,753 0.74,754 0.851,755 0.892,756 0.892,757 5.321,758 2.109,759 6.184,760 6.483,761 4.828,762 5.298,763 3.896,764 6.957,765 4.718,766 6.501,767 1.956,768 7.721,769 5.696,770 4.369,771 4.997,772 3.09,773 7.776,774 4.186,775 7.787,776 1.804,777 9.353,778 5.679,779 6.392,780 7.366,781 6.573,782 10.854,783 6.176,784 9.102,785 1.456,786 11.043,787 5.203,788 6.735,789 7.833,790 6.479,791 12.539,792 6.441,793 10.448,794 1.334,795 12.77,796 3.924,797 8.223,798 9.702,799 9.502,800 15.148,801 7.9,802 11.814,803 1.272,804 14.526,805 3.014,806 8.953,807 10.537,808 9.746,809 17.239,810 8.548,811 13.197,812 1,813 16.305,814 2.993,815 10.22,816 12.179,817 12.451,818 19.703,819 9.779,820 3.233,821 1,822 18.103,823 2.323,824 11.15,825 13.214,826 12.932,827 21.983,828 10.624,829 2.844,830 11.323,831 19.918,832 2.275,833 12.327,834 14.733,835 15.408,836 24.41,837 11.753,838 2.681,839 8.531,840 21.747,841 3.904,842 13.362,843 15.886,844 16.07,845 26.772,846 12.701,847 2.621,848 8.027,849 23.589,850 3.811,851 14.508,852 17.333,853 18.371,854 29.192,855 13.786,856 2.57,857 7.472,858 25.443,859 3.673,860 15.598,861 18.558,862 19.176,863 31.59,864 14.789,865 2.378,866 7.156,867 27.307,868 3.453,869 16.738,870 19.963,871 21.339,872 34.011,873 15.858,874 2.179,875 6.991,876 29.18,877 3.022,878 17.858,879 21.232,880 22.261,881 36.425,882 16.891,883 33226,884 54538,885 30.224,886 50.796,887 67.636,888 72.704,889 68.67,890 66.876,891 66.714,892 84.127,893 21.101,894 187.683,895 63.059,896 5.481,897 6.912,898 6.544,899 5.287,900 5.233,901 6.904,902 8.641,903 18.496,904 4.982,905 20.834,906 1.503,907 1.616,908 1.526,909 1.486,910 1.483,911 1.869,912 0.469,913 4.171,914 1.401,915 4.015,916 4.036,917 4.223,918 3.95,919 7.438,920 3.938,921 3.927,922 3.949,923 3.915,924 3.848,925 7.427,926 3.847,927 3.868,928 3.926,929 3.824,930 3.804,931 4.957,932 3.8,933 3.843,934 3.88,935 3.783,936 3.656,937 4.877,938 3.661,939 3.648,940 3.662,941 3.723,942 3.618,943 4.858,944 3.56,945 3.529,946 3.588,947 3.4,948 3.361,949 4.723,950 3.352,951 3.344,952 3.39,953 3.382,954 3.111,955 4.634,956 3.129,957 3.198,958 3.291,959 3.268,960 3.057,961 4.412,962 3.018,963 0.1,964 0.109,965 0.152,966 0.092,967 0.072,968 4.481,969 0.087,970 4.912,971 0.1,972 6.859,973 0.252,974 4.152,975 0.066,976 3.233,977 3.904,978 4.506,979 11.323,980 2.982,981 1.935,982 1.919,983 2.028,984 2.036,985 1.336,986 2.037,987 1.888,988 1.865,989 2.02,990 2.03,991 1.134,992 2.028,993 1.861,994 1.84,995 1.98,996 1.988,997 1.117,998 1.987,999 1.797,1000 1.723,1001 1.963,1002 1.938,1003 1.062,1004 1.948,1005 1.54,1006 1.474,1007 1.81,1008 1.758,1009 1.054,1010 1.777,1011 1.43,1012 1.426,1013 1.539,1014 1.581,1015 0.825,1016 1.554,1017 1.236,1018 1.242,1019 1.513,1020 1.526,1021 0.659,1022 1.495,1023 1.206,1024 1.169,1025 1.483,1026 1.458,1027 0.626,1028 1.483,1029 4.511,1030 5.826,1031 2.398,1032 7.322,1033 4.844,1034 8.897,1035 7.002,1036 10.513,1037 2.162,1039 5.344,1041 7.114,1043 11.768,1044 1.272,1046 6.378,1049 47.694,1050 120.277,1051 264.881,1052 334.499,1053 384.738,1054 403.102,1055 403.102,1056 81.242,1057 8.746,1058 90.03,1059 150.36,1060 29,1061 12.81,1062 4.524,1063 3.807,1064 66.99,1065 272,1066 299,1067 0.115,1068 298.534,1069 532.22,1070 720.183,1071 105767,1073 28.769,1074 0.702,1075 0.597,1076 29.623,1077 24.457,1078 19.851,1079 0.441,1080 0.326,1081 13.369,1082 18.491,1083 12.961,1084 10.704,1085 20.548,1086 14.676,1087 17.996,1088 0.29,1089 0.187,1090 19.17,1091 11.597,1092 14.763,1093 0.187,1094 0.104,1095 15.875,1096 8.206,1097 11.987,1098 0.12,1099 0.059,1100 13.374,1101 5.863,1102 9.807,1103 0.08,1104 0.033,1105 10.995,1106 4.067,1107 0.192,1108 131.055,1109 0.182,1110 38.125,1111 0.288,1112 214,1113 630.911,1114 279.243,1115 648.663,1116 876.63,1117 606,1118 248,1119 610.058,1120 300.745,1121 640.15,1122 937.36,1123 601,1124 5.301}
{0 CHEMBL2070413,1 1.648,2 20.146,3 5.328,4 28.391,5 169.105,6 8.066,7 0.4,8 4.385,9 4.492,10 4.05,11 3.967,12 5.486,13 3.927,14 4.921,15 5.082,16 4.472,17 4.358,18 6.012,19 4.294,20 5.173,21 5.36,22 4.47,23 4.497,24 6.222,25 4.403,26 5.234,27 5.457,28 4.406,29 4.498,30 6.253,31 4.356,32 5.184,33 5.424,34 4.344,35 4.459,36 6.154,37 4.295,38 5.044,39 5.253,40 4.233,41 4.317,42 6.089,43 4.179,44 4.925,45 5.141,46 4.193,47 4.18,48 5.953,49 4.079,50 4.795,51 4.977,52 4.146,53 4.208,54 5.869,55 4.096,56 0.038,57 1.038,58 14.07,59 6.85,60 10.645,61 8.307,62 0.36,63 1.748,64 32.187,65 11.684,66 36.102,67 13.943,68 0.481,69 2.083,70 41.095,71 15.859,72 51.654,73 18.958,74 0.541,75 2.157,76 46.877,77 18.012,78 77.419,79 22.218,80 0.452,81 2.101,82 51.868,83 18.871,84 67.431,85 22.866,86 0.546,87 1.798,88 42.918,89 15.668,90 69.567,91 18.376,92 0.609,93 1.585,94 37.387,95 12.827,96 56.65,97 15.438,98 0.284,99 1.46,100 27.697,101 11.727,102 36.33,103 14.586,104 27,105 62,106 0.254,107 0.559,108 0.691,109 0.776,110 0.821,111 0.834,112 3.741,113 0.978,114 -3.71,115 -3.67,116 -3.5,117 42.5,119 1,121 1,122 6,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 11,136 1,137 12,138 1,139 1,140 1,141 13,142 1,143 1,144 13,145 2,146 9,147 2,148 1,149 8,152 2,153 10,154 2,155 1,156 8,160 16,162 1,163 6,164 1,165 1,169 12,171 2,172 5,174 12,176 2,177 3,180 2,181 11,182 2,183 1,184 6,185 2,186 8,187 2,188 4233,189 27.67,190 27.67,191 27.67,192 27.67,193 27.67,194 24.975,195 34.554,196 16.331,197 28.494,198 22.195,199 22.195,200 22.195,201 22.195,202 22.195,203 18.012,204 43.02,205 7.801,206 23.571,207 4.542,208 2.561,209 1.706,210 1.154,211 0.86,212 0.777,213 4.444,217 1,218 1790,219 3.873,220 138.116,221 660.16,222 3.718,223 38.743,226 0.75,227 0.67,228 0.67,229 0.7,230 0.67,231 1,232 0.71,233 88,234 826,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.903,241 4.506,242 11.323,243 2.982,244 4.185,245 3.688,246 5.932,247 3.798,248 2.811,249 3.78,250 1.192,251 8.268,252 2.788,253 4.082,254 3.501,255 5.806,256 3.666,257 2.687,258 3.672,259 0.98,260 8.033,261 2.622,262 3.956,263 3.361,264 5.582,265 3.546,266 2.621,267 3.456,268 0.86,269 7.596,270 2.448,271 3.742,272 3.063,273 5.413,274 3.525,275 2.578,276 3.082,277 0.86,278 7.156,279 2.408,280 3.619,281 2.95,282 5.37,283 3.357,284 2.407,285 2.882,286 0.8,287 7.015,288 2.274,289 3.567,290 2.885,291 5.245,292 3.147,293 2.197,294 2.621,295 0.8,296 6.539,297 2.072,298 3.34,299 2.531,300 4.952,301 3.023,302 2.11,303 2.602,304 0.553,305 5.76,306 1.929,307 3.256,308 2.493,309 4.907,310 2.932,311 1.967,312 2.4,313 5.695,314 1.89,315 3.114,316 2.455,317 4.889,318 2.667,319 1.804,320 2.115,321 5.205,322 1.515,323 2.801,324 2.211,325 4.446,326 2.385,327 1.455,328 1.784,329 3.925,330 1.338,331 2.744,332 1.859,333 3.779,334 2.268,335 1.288,336 1.724,337 2.998,338 1.252,339 2.5,340 1.714,341 3.604,342 2.211,343 1.234,344 1.5,345 2.933,346 1.164,347 2.5,348 1.68,349 3.414,350 2,351 1,352 1.5,353 2.275,354 1,355 2.5,356 1.157,357 3.414,358 2,359 1,360 1.5,361 2.275,362 1,363 20.1,364 0.49,365 0.993,366 0.024,367 51.5,368 1.256,369 25,370 0.61,371 26.5,372 0.646,373 38.004,374 0.927,375 43.5,376 0.596,377 42.986,378 1.048,379 10.223,380 0.249,381 9.629,382 0.235,383 0.119,384 0.308,385 0.8,386 1.238,387 0.686,388 0.927,389 0.634,390 0.91,391 0.982,392 1.021,393 0.724,394 0.827,395 0.526,396 0.863,397 1.232,398 0.937,399 0.901,400 0.909,401 0.863,402 0.972,403 0.996,404 0.895,405 0.849,406 0.875,407 0.852,408 0.963,409 0.742,410 0.869,411 1.04,412 0.993,413 0.864,414 0.895,415 1.046,416 0.97,417 1.125,418 1.055,419 0.937,420 0.994,421 1.036,422 0.816,423 0.853,424 0.858,425 0.765,426 0.82,427 0.565,428 1.028,429 0.88,430 1.02,431 0.586,432 1.035,433 8.5,434 0.312,435 4.222,436 2.667,437 2.104,438 1.105,439 0.985,440 0.637,441 0.313,442 0.356,443 35900,444 95583,445 2.09,446 43.8,448 28,449 2,451 2,452 1.798,453 1.968,454 4.224,455 0.137,459 120.277,460 1.648,461 3.629,462 4.484,463 5.036,464 5.33,465 5.412,466 3.756,467 4.821,468 5.319,469 4.463,470 3659.28,471 9.358,472 72558.8,476 451.857,477 1.363,478 5.294,479 0.189,480 0.008,481 0.068,482 0.043,483 0.039,484 0.021,485 0.021,486 0.014,487 0.007,488 0.008,489 0.418,490 0.33,491 0.63,492 0.632,493 242.272,494 -0.037,495 -0.139,496 0.05,497 -0.025,498 -0.056,499 0.003,500 0.001,501 0.07,502 0.134,503 0.087,504 0.111,505 0.053,506 -0.125,507 0.058,508 -0.018,509 0.017,510 0.003,511 -0.023,512 -0.035,513 0.047,514 0.083,515 0.084,516 0.058,517 0.036,518 0.042,519 0.097,520 0.095,521 0.101,522 0.041,523 0.154,524 0.022,525 -0.001,526 -0.032,527 0.005,528 0.021,529 0.013,530 0.086,531 0.156,532 0.138,533 0.119,534 0.052,535 0.162,536 0.159,537 -0.033,538 0.015,539 -0.04,540 0.106,541 -0.042,542 2.153,543 6.224,544 0.707,545 78.322,546 1.003,547 1.116,548 2.478,549 6.141,550 0.696,551 3.829,552 4.143,553 4.382,554 4.605,555 4.812,556 4.82,557 4.97,558 5.081,559 5.153,560 5.303,561 11.332,562 0.653,563 588.81,564 3.829,565 5.371,566 6.209,567 7.072,568 7.925,569 8.792,570 9.652,571 10.522,572 11.388,573 12.261,574 5.5,576 2,578 2,581 12,583 18,585 1,587 1,589 2,591 73,592 22,593 3,594 45,595 77,596 31,597 18,598 6,599 12,600 4,601 5,602 5,607 1,609 23,610 8,612 4,613 2,614 1,615 1,616 4,619 32,620 8,621 2,622 10,623 2,624 4,625 1,626 4,629 1,630 4,631 2,633 2,634 5,635 2,636 1,638 41,639 1,641 7,643 2,644 1,646 3,651 5.5,653 2,654 2,655 20.833,656 13.267,657 8.972,658 4.308,659 3.985,660 1.456,661 0.986,662 9.877,663 12.73,664 4.078,665 4.61,666 5.104,667 5.608,668 6.12,669 6.287,670 6.682,671 7.049,672 7.348,673 7.724,674 0.929,675 62,676 15.175,677 6.432,678 7.736,679 29.068,680 23.765,681 2.236,682 91.667,683 353.133,684 262.473,685 42.27,687 72.29,688 77.412,689 185.061,690 425.423,691 42.27,692 8.396,693 53.677,694 123.191,695 61.25,696 53.107,698 385.353,699 45.192,700 353.133,701 227.331,702 72.29,703 77.412,704 329.591,705 95.832,706 59.926,707 156.379,708 11.027,709 77.412,710 353.133,711 114.56,712 262.473,713 353.133,714 85.693,715 140.961,717 150.379,718 353.133,719 114.56,720 262.473,721 0.583,722 0.333,723 0.171,724 0.094,725 28,726 13,727 0.13,728 10,729 5.344,730 384.998,731 29,732 203.66,733 1,734 1,735 29.453,736 13.749,737 7.829,738 114.56,739 21.484,741 3.976,742 32.897,743 730.166,744 58,745 24.457,746 5.539,747 1.822,748 0.395,749 73.24,750 81.484,751 0.266,752 0.586,753 0.724,754 0.814,755 0.861,756 0.874,757 5.321,758 2.11,759 6.184,760 6.539,761 4.828,762 5.298,763 3.896,764 6.956,765 4.718,766 6.501,767 1.967,768 7.721,769 5.76,770 4.369,771 4.997,772 3.09,773 7.776,774 4.186,775 7.787,776 1.804,777 9.353,778 5.695,779 6.392,780 7.366,781 6.573,782 10.846,783 6.176,784 9.102,785 1.455,786 11.042,787 5.205,788 6.735,789 7.833,790 6.479,791 12.532,792 6.441,793 10.448,794 1.288,795 12.769,796 3.925,797 8.221,798 9.701,799 9.502,800 15.136,801 7.898,802 11.813,803 1.234,804 14.524,805 2.998,806 8.949,807 10.531,808 9.746,809 17.228,810 8.544,811 13.196,812 1,813 16.301,814 2.933,815 10.215,816 12.172,817 12.451,818 19.69,819 9.773,820 3.233,821 1,822 18.098,823 2.275,824 11.143,825 13.201,826 12.932,827 21.972,828 10.614,829 2.811,830 11.323,831 19.912,832 2.275,833 12.319,834 14.719,835 15.408,836 24.399,837 11.741,838 2.687,839 8.268,840 21.741,841 3.903,842 13.351,843 15.866,844 16.07,845 26.763,846 12.686,847 2.621,848 8.033,849 23.582,850 3.78,851 14.496,852 17.312,853 18.371,854 29.184,855 13.769,856 2.578,857 7.596,858 25.436,859 3.672,860 15.585,861 18.53,862 19.176,863 31.584,864 14.769,865 2.407,866 7.156,867 27.299,868 3.456,869 16.725,870 19.934,871 21.339,872 34.005,873 15.837,874 2.197,875 7.015,876 29.172,877 3.082,878 17.844,879 21.198,880 22.261,881 36.42,882 16.867,883 33634,884 55334,885 30.224,886 50.796,887 67.626,888 72.596,889 68.677,890 66.865,891 66.698,892 84.111,893 21.101,894 187.65,895 63.042,896 5.481,897 6.912,898 6.544,899 5.287,900 5.233,901 6.903,902 8.641,903 18.496,904 4.982,905 20.964,906 1.503,907 1.613,908 1.526,909 1.486,910 1.482,911 1.869,912 0.469,913 4.17,914 1.401,915 4.015,916 4.036,917 4.223,918 3.95,919 7.438,920 3.938,921 3.927,922 3.948,923 3.913,924 3.848,925 7.427,926 3.847,927 3.868,928 3.926,929 3.824,930 3.805,931 4.956,932 3.801,933 3.844,934 3.881,935 3.784,936 3.656,937 4.878,938 3.661,939 3.649,940 3.663,941 3.723,942 3.618,943 4.86,944 3.56,945 3.529,946 3.588,947 3.404,948 3.361,949 4.723,950 3.352,951 3.349,952 3.39,953 3.382,954 3.122,955 4.632,956 3.139,957 3.197,958 3.291,959 3.275,960 3.041,961 4.412,962 3.003,963 0.1,964 0.109,965 0.152,966 0.092,967 0.072,968 4.481,969 0.087,970 4.912,971 0.1,972 6.859,973 0.252,974 4.152,975 0.066,976 3.233,977 3.903,978 4.506,979 11.323,980 2.982,981 1.935,982 1.919,983 2.028,984 2.036,985 1.336,986 2.037,987 1.888,988 1.865,989 2.02,990 2.029,991 1.134,992 2.028,993 1.862,994 1.84,995 1.98,996 1.988,997 1.117,998 1.987,999 1.797,1000 1.723,1001 1.963,1002 1.939,1003 1.062,1004 1.949,1005 1.54,1006 1.474,1007 1.81,1008 1.758,1009 1.054,1010 1.777,1011 1.431,1012 1.427,1013 1.539,1014 1.584,1015 0.825,1016 1.556,1017 1.237,1018 1.243,1019 1.513,1020 1.521,1021 0.659,1022 1.493,1023 1.197,1024 1.166,1025 1.484,1026 1.458,1027 0.626,1028 1.477,1029 4.511,1030 5.826,1031 2.398,1032 7.322,1033 4.844,1034 8.895,1035 7.002,1036 10.51,1037 2.163,1039 5.28,1041 7.122,1043 11.768,1044 1.278,1046 6.384,1049 47.694,1050 120.277,1051 264.881,1052 327.354,1053 367.593,1054 389.102,1055 395.102,1056 80.628,1057 8.746,1058 90.03,1059 150.36,1060 29,1061 12.804,1062 4.524,1063 3.807,1064 67.017,1065 275,1066 299,1067 0.114,1068 298.534,1069 532.22,1070 720.183,1071 105767,1073 28.769,1074 0.702,1075 0.597,1076 29.623,1077 24.457,1078 19.851,1079 0.441,1080 0.326,1081 13.369,1082 18.491,1083 12.961,1084 10.702,1085 20.548,1086 14.676,1087 17.984,1088 0.29,1089 0.187,1090 19.159,1091 11.593,1092 14.832,1093 0.188,1094 0.104,1095 15.943,1096 8.226,1097 11.925,1098 0.12,1099 0.059,1100 13.313,1101 5.837,1102 9.668,1103 0.079,1104 0.033,1105 10.855,1106 4.054,1107 0.19,1108 131.055,1109 0.182,1110 38.215,1111 0.284,1112 214,1113 630.911,1114 279.243,1115 648.598,1116 876.61,1117 606,1118 248,1119 610.058,1120 300.745,1121 640.013,1122 937.08,1123 601,1124 5.699}
{0 CHEMBL2070414,1 1.63,2 20.929,3 5.908,4 34.908,5 173.749,6 7.932,7 0.391,8 4.42,9 4.529,10 4.07,11 4,12 5.507,13 3.956,14 4.962,15 5.126,16 4.488,17 4.392,18 6.034,19 4.322,20 5.219,21 5.413,22 4.486,23 4.531,24 6.246,25 4.431,26 5.277,27 5.505,28 4.422,29 4.53,30 6.274,31 4.385,32 5.233,33 5.478,34 4.359,35 4.495,36 6.185,37 4.327,38 5.078,39 5.289,40 4.251,41 4.375,42 6.094,43 4.226,44 5.026,45 5.255,46 4.208,47 4.236,48 6.005,49 4.12,50 4.893,51 5.103,52 4.153,53 4.215,54 5.921,55 4.1,56 0.028,57 1.078,58 15.092,59 7.207,60 10.188,61 8.871,62 0.35,63 1.815,64 34.044,65 12.299,66 36.675,67 14.959,68 0.471,69 2.171,70 43.837,71 16.732,72 52.934,73 20.389,74 0.478,75 2.244,76 49.333,77 18.824,78 77.884,79 23.474,80 0.548,81 2.193,82 54.555,83 19.511,84 70.226,85 23.872,86 0.447,87 1.875,88 43.518,89 16.457,90 64.231,91 19.89,92 0.554,93 1.721,94 41.615,95 14.424,96 60.503,97 17.772,98 0.462,99 1.566,100 33.122,101 12.624,102 45.741,103 15.827,104 27,105 63,106 0.249,107 0.553,108 0.693,109 0.782,110 0.825,111 0.837,112 3.764,113 0.99,114 -3.9,115 -3.85,116 -3.66,117 42.1,119 2,121 1,122 6,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 12,136 1,137 12,138 1,139 1,140 1,141 13,142 1,143 1,144 15,145 2,146 9,147 2,149 8,152 2,153 10,154 2,155 2,156 8,160 18,162 1,163 5,164 1,165 1,169 14,171 1,172 5,174 12,176 3,177 6,180 2,181 11,182 2,184 4,185 2,186 8,187 2,188 4648,189 28.377,190 28.377,191 28.377,192 28.377,193 28.377,194 25.682,195 34.554,196 16.831,197 29.201,198 22.695,199 22.695,200 22.695,201 22.695,202 22.695,203 18.512,204 41.315,205 8.051,206 24.071,207 4.618,208 2.634,209 1.717,210 1.135,211 0.852,212 0.773,213 4.468,217 1,218 1901,219 4,220 142.908,221 683.628,222 3.833,223 38.946,226 0.75,227 0.67,228 0.67,229 0.9,230 0.5,231 0.5,232 0.64,233 90,234 879,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.903,241 4.506,242 11.323,243 2.982,244 4.185,245 3.688,246 5.932,247 3.798,248 2.811,249 3.78,250 1.192,251 8.268,252 2.788,253 4.082,254 3.501,255 5.806,256 3.666,257 2.687,258 3.672,259 0.98,260 8.033,261 2.622,262 3.956,263 3.361,264 5.582,265 3.542,266 2.619,267 3.456,268 0.86,269 7.596,270 2.447,271 3.742,272 3.063,273 5.412,274 3.529,275 2.58,276 3.082,277 0.86,278 7.154,279 2.41,280 3.619,281 2.945,282 5.37,283 3.358,284 2.407,285 2.882,286 0.8,287 7.017,288 2.274,289 3.568,290 2.889,291 5.246,292 3.147,293 2.196,294 2.619,295 0.8,296 6.54,297 2.073,298 3.34,299 2.531,300 4.952,301 3.031,302 2.116,303 2.605,304 0.553,305 5.759,306 1.939,307 3.256,308 2.488,309 4.907,310 2.934,311 1.969,312 2.4,313 5.696,314 1.894,315 3.118,316 2.464,317 4.889,318 2.675,319 1.806,320 2.119,321 5.205,322 1.558,323 2.804,324 2.211,325 4.446,326 2.544,327 1.591,328 1.786,329 3.928,330 1.473,331 2.746,332 1.859,333 3.779,334 2.274,335 1.319,336 1.73,337 3.291,338 1.253,339 2.609,340 1.778,341 3.709,342 2.225,343 1.237,344 1.602,345 2.934,346 1.175,347 2.5,348 1.686,349 3.414,350 2,351 1,352 1.5,353 2.275,354 1,355 2.5,356 1.258,357 3.414,358 2,359 1,360 1.5,361 2.275,362 1,363 20.6,364 0.49,365 0.993,366 0.024,367 52,368 1.238,369 25,370 0.595,371 27,372 0.643,373 39.944,374 0.951,375 44.8,376 0.589,377 43.296,378 1.031,379 10.223,380 0.243,381 10.129,382 0.241,383 0.117,384 0.301,385 0.798,386 1.244,387 0.697,388 0.94,389 0.631,390 0.925,391 0.973,392 1.034,393 0.735,394 0.845,395 0.521,396 0.883,397 1.21,398 0.936,399 0.892,400 0.907,401 0.848,402 0.967,403 1.013,404 0.92,405 0.843,406 0.884,407 0.844,408 0.961,409 0.782,410 0.803,411 1.041,412 0.937,413 0.867,414 0.863,415 0.821,416 1.021,417 1.106,418 1.117,419 0.867,420 1.058,421 1.011,422 0.888,423 0.831,424 0.902,425 0.727,426 0.863,427 0.784,428 0.859,429 0.846,430 0.851,431 0.617,432 0.878,433 8.5,434 0.312,435 4.222,436 2.667,437 2.104,438 1.16,439 0.903,440 0.637,441 0.387,442 0.304,443 38947,444 101426,445 2.088,446 44.7,448 28,449 2,450 4,452 1.804,453 1.969,454 4.276,455 0.125,459 123.869,460 1.63,461 3.614,462 4.531,463 5.113,464 5.396,465 5.475,466 3.802,467 4.898,468 5.353,469 4.517,470 3889.29,471 9.425,472 79498,476 474.842,477 1.351,478 5.33,479 0.185,480 0.007,481 0.067,482 0.042,483 0.038,484 0.022,485 0.019,486 0.014,487 0.008,488 0.007,489 0.41,490 0.33,491 0.5,492 0.622,493 250.692,494 -0.032,495 -0.136,496 0.051,497 -0.025,498 -0.049,499 0.004,500 0.009,501 0.058,502 0.13,503 0.076,504 0.116,505 0.043,506 -0.11,507 0.059,508 -0.004,509 0.023,510 0.015,511 -0.011,512 -0.058,513 0.022,514 0.087,515 0.075,516 0.062,517 0.037,518 0.043,519 0.169,520 0.089,521 0.145,522 0.039,523 0.175,524 0.08,525 -0.047,526 -0.037,527 -0.054,528 0.051,529 -0.039,530 0.077,531 0.057,532 0.15,533 0.07,534 0.065,535 0.13,536 0.145,537 0.127,538 0.086,539 0.115,540 0.106,541 0.109,542 2.152,543 6.235,544 0.69,545 83.667,546 1.002,547 1.117,548 2.666,549 7.107,550 0.692,551 3.85,552 4.159,553 4.394,554 4.615,555 4.82,556 4.828,557 4.97,558 5.081,559 5.153,560 5.283,561 11.756,562 0.648,563 602.84,564 3.85,565 5.389,566 6.225,567 7.086,568 7.936,569 8.801,570 9.66,571 10.529,572 11.393,573 12.265,574 5.3,576 2,578 2,581 12,583 18,585 1,587 1,589 2,591 76,592 22,593 3,594 46,595 80,596 32,597 18,598 6,599 12,600 4,601 5,602 5,607 2,609 23,610 9,612 4,613 2,614 1,615 1,616 4,619 34,620 8,621 2,622 10,623 2,624 4,625 1,626 4,629 1,630 4,631 2,633 2,634 5,635 2,636 1,638 42,639 1,641 8,643 2,644 1,646 3,651 5.3,653 2,654 2,655 21.333,656 13.767,657 9.222,658 4.558,659 3.986,660 1.454,661 0.983,662 10.447,663 12.77,664 4.094,665 4.62,666 5.11,667 5.612,668 6.122,669 6.289,670 6.681,671 7.047,672 7.345,673 7.716,674 1,675 63,676 15.554,677 6.575,678 7.718,679 29.885,680 24.431,681 2.218,682 93.167,683 376.675,684 265.007,685 42.27,687 72.29,688 77.412,689 187.596,690 448.965,691 42.27,692 8.396,693 56.211,694 123.191,695 61.25,696 53.107,698 408.895,699 45.192,700 376.675,701 229.866,702 72.29,703 77.412,704 329.591,705 119.374,706 62.46,707 156.379,708 11.027,709 77.412,710 376.675,711 114.56,712 265.007,713 376.675,714 88.228,715 140.961,717 150.379,718 376.675,719 114.56,720 265.007,721 0.581,722 0.331,723 0.17,724 0.093,725 28,726 13,727 0.138,728 11,729 5.456,730 394.193,731 29,732 210.477,733 1,734 1,735 30.42,736 14.424,737 8.294,738 114.56,739 21.509,741 3.986,742 32.897,743 756.242,744 59,745 24.474,746 5.544,747 1.824,748 0.4,749 76.123,750 84.899,751 0.261,752 0.578,753 0.725,754 0.818,755 0.864,756 0.876,757 5.335,758 2.116,759 6.196,760 6.54,761 4.844,762 5.308,763 3.896,764 6.963,765 4.736,766 6.511,767 1.969,768 7.73,769 5.759,770 4.369,771 4.997,772 3.09,773 7.776,774 4.186,775 7.795,776 1.806,777 9.359,778 5.696,779 6.402,780 7.37,781 6.573,782 10.848,783 6.188,784 9.108,785 1.591,786 11.046,787 5.205,788 6.735,789 7.833,790 6.479,791 12.532,792 6.441,793 10.452,794 1.319,795 12.771,796 3.928,797 8.227,798 9.702,799 9.502,800 15.136,801 7.906,802 11.816,803 1.237,804 14.525,805 3.291,806 8.949,807 10.531,808 9.746,809 17.228,810 8.544,811 13.198,812 1,813 16.303,814 2.934,815 10.218,816 12.172,817 12.451,818 19.69,819 9.777,820 3.233,821 1,822 18.099,823 2.275,824 11.143,825 13.201,826 12.932,827 21.972,828 10.614,829 2.811,830 11.323,831 19.913,832 2.275,833 12.32,834 14.719,835 15.408,836 24.399,837 11.743,838 2.687,839 8.268,840 21.741,841 3.903,842 13.351,843 15.866,844 16.07,845 26.763,846 12.686,847 2.619,848 8.033,849 23.582,850 3.78,851 14.497,852 17.312,853 18.371,854 29.184,855 13.77,856 2.58,857 7.596,858 25.436,859 3.672,860 15.585,861 18.53,862 19.176,863 31.584,864 14.769,865 2.407,866 7.154,867 27.299,868 3.456,869 16.725,870 19.934,871 21.339,872 34.005,873 15.837,874 2.196,875 7.017,876 29.172,877 3.082,878 17.844,879 21.198,880 22.261,881 36.42,882 16.867,883 36520,884 59469,885 30.917,886 52.557,887 68.856,888 73.783,889 69.936,890 68.085,891 67.915,892 85.319,893 21.101,894 190.056,895 64.263,896 5.481,897 6.912,898 6.629,899 5.287,900 5.233,901 6.903,902 8.641,903 18.496,904 4.982,905 21.359,906 1.497,907 1.604,908 1.52,909 1.48,910 1.476,911 1.855,912 0.459,913 4.132,914 1.397,915 4.016,916 4.037,917 4.223,918 3.95,919 7.438,920 3.938,921 3.927,922 3.948,923 3.914,924 3.848,925 7.427,926 3.847,927 3.87,928 3.931,929 3.824,930 3.805,931 4.957,932 3.801,933 3.849,934 3.882,935 3.784,936 3.666,937 4.878,938 3.67,939 3.661,940 3.698,941 3.73,942 3.62,943 4.86,944 3.562,945 3.586,946 3.619,947 3.446,948 3.446,949 4.723,950 3.433,951 3.349,952 3.391,953 3.403,954 3.123,955 4.632,956 3.14,957 3.27,958 3.359,959 3.275,960 3.043,961 4.411,962 3.035,963 0.097,964 0.107,965 0.149,966 0.09,967 0.07,968 4.481,969 0.085,970 4.912,971 0.098,972 6.859,973 0.246,974 4.152,975 0.065,976 3.233,977 3.903,978 4.506,979 11.323,980 2.982,981 1.935,982 1.919,983 2.03,984 2.037,985 1.354,986 2.04,987 1.888,988 1.866,989 2.027,990 2.03,991 1.206,992 2.029,993 1.862,994 1.84,995 1.983,996 1.992,997 1.118,998 1.99,999 1.805,1000 1.732,1001 1.963,1002 1.939,1003 1.07,1004 1.949,1005 1.615,1006 1.548,1007 1.876,1008 1.812,1009 1.056,1010 1.838,1011 1.432,1012 1.43,1013 1.573,1014 1.591,1015 0.825,1016 1.566,1017 1.262,1018 1.253,1019 1.513,1020 1.531,1021 0.766,1022 1.533,1023 1.205,1024 1.166,1025 1.485,1026 1.504,1027 0.626,1028 1.481,1029 4.533,1030 5.844,1031 2.398,1032 7.335,1033 4.844,1034 8.905,1035 7.002,1036 10.517,1037 2.174,1039 5.283,1041 8.474,1043 11.775,1044 1.279,1046 6.443,1049 49.221,1050 123.869,1051 274.642,1052 344.339,1053 388.578,1054 410.088,1055 416.088,1056 84.19,1057 8.784,1058 90.03,1059 150.36,1060 29,1061 12.809,1062 4.524,1063 3.807,1064 69.577,1065 291,1066 322,1067 0.111,1068 308.126,1069 549.52,1070 743.588,1071 113128,1073 29.476,1074 0.702,1075 0.599,1076 30.33,1077 25.164,1078 20.351,1079 0.442,1080 0.33,1081 13.869,1082 18.991,1083 13.451,1084 11.119,1085 21.048,1086 15.176,1087 18.337,1088 0.291,1089 0.19,1090 19.512,1091 11.947,1092 15.082,1093 0.189,1094 0.106,1095 16.193,1096 8.476,1097 12.102,1098 0.121,1099 0.06,1100 13.49,1101 5.987,1102 9.788,1103 0.08,1104 0.034,1105 10.976,1106 4.185,1107 0.185,1108 134.055,1109 0.18,1110 39.078,1111 0.275,1112 218,1113 634.911,1114 283.243,1115 652.76,1116 882.37,1117 610,1118 252,1119 614.058,1120 304.745,1121 644.175,1122 942.84,1123 605,1124 5.398}
{0 CHEMBL2070416,1 1.634,2 18.795,3 5.832,4 34.012,5 160.596,6 8.232,7 0.419,8 4.317,9 4.416,10 4.001,11 3.928,12 5.427,13 3.885,14 4.847,15 4.99,16 4.429,17 4.322,18 5.959,19 4.251,20 5.103,21 5.295,22 4.397,23 4.415,24 6.161,25 4.318,26 5.083,27 5.29,28 4.358,29 4.39,30 6.164,31 4.265,32 5.03,33 5.234,34 4.307,35 4.391,36 6.074,37 4.236,38 4.984,39 5.191,40 4.192,41 4.262,42 6.046,43 4.125,44 4.812,45 5.013,46 4.143,47 4.108,48 5.876,49 4.015,50 4.686,51 4.85,52 4.098,53 4.15,54 5.797,55 4.041,56 0.038,57 0.928,58 12.512,59 6.404,60 10.603,61 7.611,62 0.285,63 1.578,64 28.66,65 11.332,66 33.97,67 13.186,68 0.439,69 1.909,70 38.98,71 15.233,72 52.571,73 17.856,74 0.513,75 1.869,76 39.923,77 15.485,78 71.893,79 18.321,80 0.333,81 1.824,82 43.02,83 16.684,84 58.123,85 19.356,86 0.531,87 1.693,88 40.979,89 15.138,90 69.542,91 17.385,92 0.519,93 1.431,94 33.116,95 11.689,96 53.139,97 13.514,98 0.262,99 1.309,100 23.771,101 10.43,102 32.215,103 12.699,104 18,105 59,106 0.255,107 0.567,108 0.688,109 0.773,110 0.817,111 0.83,112 3.692,113 0.983,114 -4.27,115 -4.2,116 -3.97,117 44.1,119 3,122 4,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 12,136 1,137 14,138 1,139 1,140 1,141 13,142 1,144 13,145 2,146 9,147 2,148 1,149 8,152 2,153 12,154 2,155 1,156 7,160 16,162 1,163 8,164 1,165 1,169 12,171 1,172 5,174 12,176 2,177 3,180 2,181 15,182 2,183 1,184 4,185 2,186 12,187 2,188 3653,189 26.515,190 26.515,191 26.515,192 26.515,193 26.515,194 23.82,195 32.126,196 15.745,197 27.221,198 21.229,199 21.229,200 21.229,201 21.229,202 21.229,203 17.045,204 37.806,205 7.515,206 22.435,207 4.454,208 2.451,209 1.681,210 1.133,211 0.853,212 0.765,213 4.397,217 1,218 1597,219 3.808,220 272.336,221 456.539,222 3.482,223 37.463,226 0.75,227 0.67,228 0.67,229 0.7,230 0.67,231 1,232 0.71,233 83.5,234 733,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.903,241 4.506,242 11.323,243 2.982,244 4.185,245 3.688,246 5.932,247 3.798,248 2.811,249 3.78,250 1.192,251 8.268,252 2.788,253 4.082,254 3.501,255 5.806,256 3.666,257 2.687,258 3.672,259 0.98,260 8.033,261 2.622,262 3.956,263 3.361,264 5.582,265 3.534,266 2.585,267 3.456,268 0.86,269 7.596,270 2.447,271 3.742,272 3.063,273 5.373,274 3.469,275 2.538,276 3.082,277 0.86,278 7.029,279 2.359,280 3.571,281 2.901,282 5.35,283 3.356,284 2.406,285 2.882,286 0.8,287 6.986,288 2.274,289 3.538,290 2.836,291 5.245,292 3.145,293 2.193,294 2.607,295 0.553,296 6.539,297 2.07,298 3.339,299 2.531,300 4.952,301 2.934,302 1.969,303 2.54,305 5.759,306 1.897,307 3.256,308 2.466,309 4.907,310 2.672,311 1.805,312 2.4,313 5.205,314 1.544,315 2.803,316 2.211,317 4.446,318 2.518,319 1.557,320 1.785,321 3.926,322 1.466,323 2.745,324 1.859,325 3.779,326 2.276,327 1.325,328 1.727,329 3.213,330 1.253,331 2.572,332 1.745,333 3.688,334 2.23,335 1.238,336 1.566,337 2.934,338 1.181,339 2.5,340 1.685,341 3.414,342 2.065,343 1.109,344 1.5,345 2.418,346 1.052,347 2.5,348 1.349,349 3.414,350 2,351 1,352 1.5,353 2.275,354 1,355 2.5,356 1.108,357 3.414,358 2,359 1,360 1.5,361 2.275,362 1,363 19.2,364 0.492,365 0.886,366 0.023,367 49.75,368 1.276,369 25,370 0.641,371 24.75,372 0.635,373 35.149,374 0.901,375 40.8,376 0.6,377 40.177,378 1.03,379 9.612,380 0.246,381 9.346,382 0.24,383 0.099,384 0.302,385 0.777,386 1.124,387 0.672,388 0.875,389 0.624,390 0.871,391 0.874,392 1.09,393 0.71,394 0.899,395 0.513,396 0.932,397 1.225,398 0.939,399 0.864,400 0.883,401 0.853,402 0.931,403 1.116,404 0.826,405 0.849,406 0.811,407 0.931,408 0.885,409 0.766,410 1,411 1.152,412 1.131,413 0.95,414 1.014,415 1.043,416 0.953,417 1.113,418 1.032,419 0.93,420 0.963,421 1.085,422 0.848,423 0.869,424 0.871,425 0.793,426 0.814,427 0.548,428 1.036,429 0.916,430 1.025,431 0.605,432 1.052,433 7.5,434 0.267,435 3.778,436 2.639,437 1.887,438 1.039,439 0.939,440 0.584,441 0.305,442 0.314,443 31131,444 83064,445 2.11,446 42.6,448 21,449 2,450 4,451 2,452 1.787,453 2,454 4.131,455 0.136,459 111.104,460 1.634,461 3.636,462 4.407,463 4.955,464 5.235,465 5.323,466 3.65,467 4.702,468 5.246,469 4.378,470 3244.33,471 9.215,472 61217.3,476 413.947,477 1.309,478 5.228,479 0.174,480 0.007,481 0.064,482 0.046,483 0.036,484 0.021,485 0.021,486 0.014,487 0.007,488 0.008,489 0.398,490 0.17,491 0.75,492 0.608,493 226.359,494 -0.038,495 -0.069,496 0.045,497 0.002,498 -0.052,499 0.021,500 0.052,501 -0.042,502 0.128,503 0.013,504 0.118,505 -0.017,506 -0.113,507 0.034,508 0.033,509 0.044,510 0.019,511 0.027,512 -0.064,513 0.139,514 0.104,515 0.152,516 0.041,517 0.099,518 0.03,519 -0.018,520 0.002,521 -0.013,522 0.004,523 0.025,524 0.038,525 0.014,526 -0.008,527 0.029,528 0.025,529 0.049,530 0.044,531 0.139,532 0.129,533 0.111,534 0.036,535 0.163,536 0.153,537 -0.031,538 -0.029,539 -0.059,540 0.087,541 -0.081,542 2.152,543 6.182,544 0.718,545 70.889,546 1.004,547 1.111,548 3.036,549 9.219,550 0.706,551 3.784,552 4.094,553 4.344,554 4.575,555 4.727,556 4.771,557 4.942,558 5.056,559 5.13,560 5.273,561 10.728,562 0.664,563 559.76,564 3.784,565 5.323,566 6.163,567 7.027,568 7.881,569 8.749,570 9.611,571 10.482,572 11.349,573 12.224,574 4.4,576 1,578 2,581 12,583 18,585 1,587 1,589 2,591 68,592 22,593 3,594 43,595 72,596 30,597 18,598 6,599 12,600 4,601 5,602 5,605 2,607 3,609 23,610 7,612 4,613 2,614 1,615 1,616 4,619 29,620 7,621 2,622 9,623 2,624 3,625 1,626 4,628 1,629 2,630 3,631 2,633 1,634 5,635 2,638 39,639 1,641 7,643 2,644 1,646 2,651 5.9,653 2,654 2,655 19.5,656 12.067,657 8.556,658 4.158,659 3.971,660 1.463,661 0.994,662 9.118,663 12.552,664 4.043,665 4.58,666 5.086,667 5.597,668 6.097,669 6.275,670 6.677,671 7.046,672 7.346,673 7.72,674 0.923,675 57,676 14.44,677 6.163,678 7.748,679 27.654,680 22.777,681 2.248,682 87.667,683 317.82,684 254.934,685 39.146,687 72.29,688 77.412,689 177.523,690 390.109,691 39.146,693 54.535,694 123.191,695 61.25,696 49.982,698 350.039,699 45.192,700 317.82,701 216.668,702 72.29,703 77.412,704 247.193,705 142.916,706 57.659,707 147.982,708 11.027,709 77.412,710 317.82,711 111.435,712 254.934,713 317.82,714 86.551,715 129.44,717 150.379,718 317.82,719 111.435,720 254.934,721 0.58,722 0.335,723 0.175,724 0.088,725 27,726 12,727 0.139,728 10,729 5.2,730 362.01,731 28,732 190.131,733 1,734 1,735 27.563,736 12.902,737 7.152,738 111.435,739 21.484,741 3.993,742 32.897,743 684.189,744 56,745 24.402,746 5.525,747 1.822,748 0.406,749 68.254,750 75.57,751 0.268,752 0.597,753 0.724,754 0.814,755 0.86,756 0.874,757 5.281,758 1.969,759 6.133,760 6.539,761 4.779,762 5.268,763 3.876,764 6.907,765 4.677,766 6.461,767 1.805,768 7.669,769 5.759,770 4.29,771 4.956,772 3.072,773 7.73,774 4.117,775 7.748,776 1.557,777 9.302,778 5.205,779 6.34,780 7.347,781 6.572,782 10.812,783 6.138,784 9.067,785 1.325,786 10.994,787 3.926,788 6.686,789 7.817,790 6.478,791 12.513,792 6.405,793 10.416,794 1.238,795 12.726,796 3.213,797 8.175,798 9.69,799 9.502,800 15.118,801 7.867,802 11.786,803 1.109,804 14.486,805 2.934,806 8.914,807 10.524,808 9.746,809 17.219,810 8.52,811 13.172,812 1,813 16.269,814 2.418,815 10.178,816 12.167,817 12.451,818 19.683,819 9.749,820 3.233,821 1,822 18.071,823 2.275,824 11.115,825 13.198,826 12.932,827 21.968,828 10.597,829 2.811,830 11.323,831 19.889,832 2.275,833 12.29,834 14.716,835 15.408,836 24.396,837 11.724,838 2.687,839 8.268,840 21.722,841 3.903,842 13.33,843 15.864,844 16.07,845 26.762,846 12.673,847 2.585,848 8.033,849 23.567,850 3.78,851 14.475,852 17.311,853 18.371,854 29.183,855 13.757,856 2.538,857 7.596,858 25.423,859 3.672,860 15.568,861 18.53,862 19.176,863 31.583,864 14.759,865 2.406,866 7.029,867 27.289,868 3.456,869 16.709,870 19.934,871 21.339,872 34.005,873 15.828,874 2.193,875 6.986,876 29.164,877 3.082,878 17.831,879 21.197,880 22.261,881 36.42,882 16.859,883 29012,884 47790,885 29.126,886 48.029,887 64.17,888 69.232,889 64.926,890 63.842,891 63.69,892 81.095,893 19.501,894 178.573,895 60.483,896 5.449,897 6.912,898 6.574,899 5.287,900 5.233,901 6.903,902 8.641,903 18.496,904 4.982,905 17.845,906 1.492,907 1.61,908 1.51,909 1.485,910 1.481,911 1.886,912 0.454,913 4.153,914 1.407,915 4.014,916 4.034,917 4.223,918 3.95,919 7.438,920 3.938,921 3.927,922 3.949,923 3.913,924 3.848,925 7.427,926 3.847,927 3.87,928 3.924,929 3.824,930 3.805,931 4.956,932 3.801,933 3.846,934 3.881,935 3.784,936 3.692,937 4.878,938 3.688,939 3.647,940 3.654,941 3.717,942 3.62,943 4.86,944 3.56,945 3.501,946 3.56,947 3.403,948 3.354,949 4.723,950 3.338,951 3.348,952 3.389,953 3.344,954 3.121,955 4.632,956 3.139,957 3.104,958 3.137,959 3.274,960 3.041,961 4.369,962 2.999,963 0.104,964 0.114,965 0.16,966 0.097,967 0.075,968 4.481,969 0.091,970 4.912,971 0.105,972 6.859,973 0.263,974 4.152,975 0.069,976 3.233,977 3.903,978 4.506,979 11.323,980 2.982,981 1.935,982 1.919,983 2.028,984 2.03,985 1.237,986 2.029,987 1.887,988 1.865,989 1.99,990 1.999,991 1.211,992 1.997,993 1.861,994 1.84,995 1.964,996 1.94,997 1.118,998 1.949,999 1.657,1000 1.588,1001 1.893,1002 1.87,1003 1.071,1004 1.881,1005 1.577,1006 1.507,1007 1.86,1008 1.751,1009 1.056,1010 1.793,1011 1.433,1012 1.431,1013 1.612,1014 1.609,1015 0.907,1016 1.599,1017 1.325,1018 1.276,1019 1.484,1020 1.552,1021 0.626,1022 1.545,1023 1.219,1024 1.201,1025 1.375,1026 1.511,1027 0.434,1028 1.48,1029 4.466,1030 5.778,1031 3.045,1032 7.266,1033 5.352,1034 8.833,1035 7.391,1036 10.444,1039 5.275,1041 7.733,1043 11.719,1044 1.279,1046 4.029,1049 45.146,1050 111.104,1051 247.255,1052 299.644,1053 336.928,1054 355.947,1055 361.947,1056 74.897,1057 8.581,1058 86.79,1059 147.12,1060 28,1061 12.766,1062 4.524,1063 3.807,1064 62.052,1065 247,1066 250,1067 0.117,1068 282.147,1069 503.92,1070 680.199,1071 84368,1073 27.192,1074 0.697,1075 0.59,1076 28.045,1077 23.01,1078 18.958,1079 0.441,1080 0.328,1081 12.826,1082 17.709,1083 12.483,1084 10.297,1085 19.654,1086 14.096,1087 17.008,1088 0.288,1089 0.186,1090 18.183,1091 10.997,1092 14.171,1093 0.186,1094 0.103,1095 15.283,1096 7.829,1097 11.607,1098 0.121,1099 0.06,1100 12.994,1101 5.772,1102 8.771,1103 0.078,1104 0.032,1105 9.959,1106 3.587,1107 0.195,1108 124.995,1109 0.185,1110 36.64,1111 0.295,1112 204,1113 601.265,1114 267.495,1115 620.811,1116 841.05,1117 580,1118 237,1119 587.297,1120 287.525,1121 615.4,1122 903.27,1123 580,1124 5.301}
{0 CHEMBL2070418,1 1.616,2 18.9,3 6.288,4 39.541,5 165.197,6 8.082,7 0.409,8 4.354,9 4.457,10 4.022,11 3.962,12 5.45,13 3.916,14 4.89,15 5.039,16 4.445,17 4.356,18 5.983,19 4.281,20 5.165,21 5.363,22 4.439,23 4.471,24 6.195,25 4.371,26 5.168,27 5.385,28 4.396,29 4.452,30 6.207,31 4.321,32 5.111,33 5.322,34 4.363,35 4.443,36 6.174,37 4.288,38 5.054,39 5.266,40 4.22,41 4.327,42 6.068,43 4.189,44 4.908,45 5.116,46 4.209,47 4.185,48 5.985,49 4.088,50 4.804,51 4.984,52 4.113,53 4.194,54 5.909,55 4.08,56 0.029,57 0.969,58 13.547,59 6.775,60 10.08,61 8.185,62 0.275,63 1.648,64 30.604,65 11.978,66 34.606,67 14.223,68 0.427,69 2.032,70 41.964,71 16.221,72 53.615,73 19.437,74 0.506,75 2.035,76 43.877,77 16.784,78 71.267,79 20.343,80 0.484,81 1.953,82 46.884,83 17.935,84 71.721,85 21.233,86 0.428,87 1.814,88 43.647,89 16.036,90 63.443,91 18.535,92 0.481,93 1.574,94 36.058,95 12.834,96 56.824,97 15.321,98 0.363,99 1.452,100 28.333,101 11.555,102 48.531,103 14.044,104 18,105 60,106 0.25,107 0.558,108 0.7,109 0.817,110 0.852,111 0.852,112 3.717,113 0.995,114 -4.46,115 -4.39,116 -4.13,117 43.7,119 4,122 4,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 13,136 1,137 14,138 1,139 1,140 1,141 14,142 1,144 14,145 2,146 9,147 2,148 1,149 7,152 1,153 12,154 1,155 2,156 8,157 1,158 1,159 1,160 17,161 1,163 8,169 12,171 1,172 8,173 2,174 12,175 2,176 2,177 3,180 2,181 15,182 2,183 1,184 3,185 1,186 14,187 1,188 3854,189 27.223,190 27.223,191 27.223,192 27.223,193 27.223,194 24.527,195 32.126,196 16.286,197 27.928,198 21.746,199 21.746,200 21.746,201 21.746,202 21.746,203 17.551,204 37.806,205 7.792,206 22.949,207 4.534,208 2.544,209 1.629,210 0.871,211 0.648,212 0.648,213 4.422,217 1,218 1643,219 3.808,220 131.728,221 634.691,222 3.55,223 38.169,226 0.75,227 0.67,228 0.67,229 0.7,230 0.67,231 1,232 0.71,233 85.5,234 756,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.904,241 4.506,242 11.323,243 2.982,244 4.214,245 3.688,246 5.983,247 3.829,248 2.844,249 3.811,250 1.192,251 8.531,252 2.81,253 4.08,254 3.506,255 5.805,256 3.66,257 2.681,258 3.673,259 0.98,260 8.027,261 2.619,262 3.951,263 3.361,264 5.555,265 3.526,266 2.576,267 3.453,268 0.86,269 7.472,270 2.443,271 3.708,272 3.06,273 5.368,274 3.448,275 2.518,276 3.022,277 0.86,278 7.003,279 2.34,280 3.547,281 2.899,282 5.338,283 3.324,284 2.377,285 2.847,286 0.8,287 6.955,288 2.238,289 3.517,290 2.821,291 5.231,292 3.128,293 2.174,294 2.602,295 0.553,296 6.483,297 2.058,298 3.335,299 2.534,300 4.944,301 2.925,302 1.957,303 2.52,305 5.68,306 1.891,307 3.255,308 2.466,309 4.898,310 2.675,311 1.805,312 2.4,313 5.203,314 1.591,315 2.829,316 2.212,317 4.446,318 2.585,319 1.613,320 1.908,321 3.926,322 1.498,323 2.769,324 1.789,325 3.764,326 2.335,327 1.376,328 1.747,329 3.326,330 1.318,331 2.624,332 1.754,333 3.724,334 2.288,335 1.323,336 1.619,337 3.011,338 1.246,339 2.53,340 1.682,341 3.471,342 2.191,343 1.238,344 1.5,345 2.754,346 1.154,347 2.5,348 1.511,349 3.436,350 2.016,351 1,352 1.5,353 2.323,354 1.01,355 2.5,356 1.184,357 3.414,358 2,359 1,360 1.475,361 2.275,362 1,363 19.7,364 0.493,365 0.886,366 0.022,367 50.25,368 1.256,369 25,370 0.625,371 25.25,372 0.631,373 37.389,374 0.935,375 42.1,376 0.593,377 40.885,378 1.022,379 9.612,380 0.24,381 9.846,382 0.246,383 0.096,384 0.294,385 0.775,386 1.134,387 0.683,388 0.89,389 0.621,390 0.888,391 0.866,392 1.101,393 0.721,394 0.914,395 0.508,396 0.949,397 1.196,398 0.945,399 0.845,400 0.874,401 0.833,402 0.917,403 1.077,404 0.843,405 0.839,406 0.823,407 0.886,408 0.897,409 0.69,410 0.96,411 1.091,412 1.081,413 0.823,414 0.973,415 1.221,416 0.959,417 1.123,418 1.011,419 1.092,420 0.955,421 0.997,422 0.926,423 0.833,424 0.915,425 0.792,426 0.852,427 0.833,428 0.979,429 0.957,430 0.966,431 0.914,432 1.027,433 7.5,434 0.246,435 3.556,436 2.729,437 1.913,438 1.049,439 1.025,440 0.559,441 0.305,442 0.311,443 33057,444 85628,445 2.107,446 43.7,447 2,448 21,449 2,450 4,451 2,452 1.793,453 2,454 4.142,455 0.124,459 114.717,460 1.616,461 3.606,462 4.521,463 5.278,464 5.502,465 5.502,466 3.65,467 4.822,468 5.284,469 4.389,470 3423.41,471 9.291,472 65847.5,476 436.632,477 1.295,478 5.266,479 0.17,480 0.006,481 0.059,482 0.045,483 0.035,484 0.02,485 0.022,486 0.012,487 0.007,488 0.008,489 0.386,490 0.17,491 0.75,492 0.598,493 233.786,494 -0.033,495 -0.068,496 0.047,497 0.002,498 -0.045,499 0.021,500 0.059,501 -0.049,502 0.124,503 0.006,504 0.124,505 -0.023,506 -0.097,507 0.032,508 0.049,509 0.051,510 0.025,511 0.042,512 -0.047,513 0.126,514 0.104,515 0.13,516 0.052,517 0.086,518 0.159,519 0.017,520 0.05,521 0.024,522 0.121,523 0.062,524 -0.125,525 0.012,526 -0.036,527 0.037,528 -0.079,529 0.048,530 0.088,531 0.059,532 0.145,533 0.055,534 0.093,535 0.126,536 0.062,537 0.026,538 -0.054,539 -0.011,540 -0.006,541 -0.062,542 2.18,543 6.213,544 0.725,545 72.603,546 1.002,547 1.112,548 3.227,549 10.41,550 0.701,551 3.807,552 4.111,553 4.357,554 4.595,555 4.787,556 4.779,557 4.963,558 5.056,559 5.153,560 5.293,561 10.857,562 0.657,563 573.79,564 3.807,565 5.342,566 6.18,567 7.043,568 7.895,569 8.763,570 9.624,571 10.495,572 11.362,573 12.236,574 4.2,576 1,578 2,581 12,583 18,585 1,587 1,589 2,591 71,592 22,593 3,594 44,595 75,596 31,597 18,598 6,599 12,600 4,601 5,602 5,605 3,607 4,609 23,610 8,612 4,613 2,614 1,615 1,616 4,619 31,620 7,621 2,622 9,623 2,624 3,625 1,626 4,629 1,630 4,631 2,633 1,634 5,635 2,638 40,639 1,641 8,643 2,644 1,646 2,651 5.6,653 2,654 2,655 20,656 12.567,657 8.806,658 4.408,659 4.008,660 1.462,661 0.991,662 9.68,663 12.675,664 4.06,665 4.59,666 5.092,667 5.609,668 6.116,669 6.263,670 6.692,671 7.034,672 7.357,673 7.735,674 0.923,675 60,676 14.825,677 6.315,678 7.729,679 28.47,680 23.443,681 2.229,682 89.167,683 341.362,684 257.469,685 39.146,687 72.29,688 77.412,689 180.057,690 413.652,691 39.146,693 57.069,694 123.191,695 61.25,696 49.982,698 373.581,699 45.192,700 341.362,701 219.203,702 72.29,703 77.412,704 270.735,705 142.916,706 60.193,707 147.982,708 11.027,709 77.412,710 341.362,711 111.435,712 257.469,713 341.362,714 89.085,715 129.44,717 150.379,718 341.362,719 111.435,720 257.469,721 0.577,722 0.332,723 0.177,724 0.095,725 27,726 12,727 0.133,728 10,729 5.257,730 374.741,731 29,732 200.877,733 1,734 1,735 28.526,736 13.573,737 7.606,738 111.435,739 21.515,741 3.827,742 32.897,743 710.266,744 57,745 24.612,746 5.534,747 1.816,748 0.362,749 71.138,750 78.985,751 0.263,752 0.586,753 0.735,754 0.858,755 0.895,756 0.895,757 5.296,758 1.957,759 6.146,760 6.483,761 4.796,762 5.278,763 3.876,764 6.917,765 4.696,766 6.472,767 1.805,768 7.678,769 5.68,770 4.29,771 4.956,772 3.072,773 7.73,774 4.117,775 7.756,776 1.613,777 9.309,778 5.203,779 6.351,780 7.351,781 6.572,782 10.823,783 6.15,784 9.072,785 1.376,786 10.999,787 3.926,788 6.673,789 7.813,790 6.478,791 12.517,792 6.391,793 10.419,794 1.323,795 12.73,796 3.326,797 8.182,798 9.693,799 9.502,800 15.131,801 7.877,802 11.787,803 1.238,804 14.49,805 3.011,806 8.906,807 10.528,808 9.746,809 17.229,810 8.512,811 13.173,812 1,813 16.273,814 2.754,815 10.184,816 12.174,817 12.451,818 19.696,819 9.759,820 3.233,821 1,822 18.076,823 2.323,824 11.115,825 13.21,826 12.932,827 21.979,828 10.598,829 2.844,830 11.323,831 19.895,832 2.275,833 12.298,834 14.73,835 15.408,836 24.406,837 11.736,838 2.681,839 8.531,840 21.728,841 3.904,842 13.335,843 15.884,844 16.07,845 26.771,846 12.682,847 2.576,848 8.027,849 23.573,850 3.811,851 14.485,852 17.332,853 18.371,854 29.191,855 13.773,856 2.518,857 7.472,858 25.43,859 3.673,860 15.577,861 18.557,862 19.176,863 31.59,864 14.775,865 2.377,866 7.003,867 27.297,868 3.453,869 16.72,870 19.962,871 21.339,872 34.011,873 15.848,874 2.174,875 6.955,876 29.171,877 3.022,878 17.842,879 21.231,880 22.261,881 36.425,882 16.881,883 30867,884 50164,885 29.819,886 49.79,887 65.797,888 70.988,889 66.572,890 65.209,891 65.068,892 82.473,893 19.501,894 181.334,895 61.86,896 5.481,897 6.912,898 6.661,899 5.287,900 5.233,901 6.904,902 8.641,903 18.496,904 4.982,905 18.027,906 1.495,907 1.613,908 1.513,909 1.482,910 1.479,911 1.874,912 0.443,913 4.121,914 1.406,915 4.015,916 4.035,917 4.223,918 3.95,919 7.438,920 3.938,921 3.927,922 3.948,923 3.915,924 3.848,925 7.427,926 3.847,927 3.869,928 3.923,929 3.824,930 3.804,931 4.957,932 3.8,933 3.846,934 3.88,935 3.783,936 3.7,937 4.877,938 3.694,939 3.648,940 3.659,941 3.714,942 3.621,943 4.858,944 3.561,945 3.523,946 3.579,947 3.4,948 3.38,949 4.723,950 3.363,951 3.344,952 3.39,953 3.367,954 3.111,955 4.634,956 3.129,957 3.135,958 3.206,959 3.268,960 3.057,961 4.363,962 3.017,963 0.102,964 0.112,965 0.156,966 0.094,967 0.073,968 4.481,969 0.089,970 4.912,971 0.102,972 6.859,973 0.257,974 4.152,975 0.068,976 3.233,977 3.904,978 4.506,979 11.323,980 2.982,981 1.935,982 1.919,983 2.065,984 2.035,985 1.418,986 2.047,987 1.889,988 1.865,989 2.028,990 2.029,991 1.168,992 2.029,993 1.861,994 1.84,995 1.985,996 1.987,997 1.118,998 1.988,999 1.833,1000 1.768,1001 1.963,1002 1.938,1003 1.065,1004 1.948,1005 1.551,1006 1.489,1007 1.823,1008 1.748,1009 1.055,1010 1.775,1011 1.43,1012 1.427,1013 1.513,1014 1.578,1015 0.825,1016 1.551,1017 1.233,1018 1.242,1019 1.484,1020 1.525,1021 0.642,1022 1.49,1023 1.206,1024 1.169,1025 1.393,1026 1.376,1027 0.625,1028 1.429,1029 4.489,1030 5.796,1031 2.398,1032 7.288,1033 4.844,1034 8.861,1035 7.002,1036 10.475,1039 5.342,1041 9.07,1043 11.755,1044 1.275,1046 4.058,1049 46.673,1050 114.717,1051 255.997,1052 320.983,1053 374.758,1054 390.632,1055 390.632,1056 78.948,1057 8.667,1058 86.79,1059 147.12,1060 29,1061 12.778,1062 4.524,1063 3.807,1064 64.476,1065 258,1066 273,1067 0.117,1068 291.74,1069 521.22,1070 703.605,1071 95300,1073 27.899,1074 0.697,1075 0.593,1076 28.752,1077 23.717,1078 19.458,1079 0.442,1080 0.332,1081 13.326,1082 18.209,1083 12.973,1084 10.715,1085 20.154,1086 14.596,1087 17.374,1088 0.29,1089 0.189,1090 18.549,1091 11.354,1092 14.353,1093 0.186,1094 0.105,1095 15.465,1096 8.059,1097 11.845,1098 0.121,1099 0.061,1100 13.233,1101 5.974,1102 9.523,1103 0.08,1104 0.034,1105 10.711,1106 4.075,1107 0.194,1108 127.995,1109 0.183,1110 37.34,1111 0.294,1112 208,1113 605.265,1114 271.495,1115 625.038,1116 846.83,1117 584,1118 241,1119 591.297,1120 291.525,1121 619.698,1122 909.31,1123 584,1124 4.523}
{0 CHEMBL2070419,1 1.616,2 19.45,3 6.288,4 39.541,5 165.197,6 8.082,7 0.409,8 4.354,9 4.457,10 4.022,11 3.962,12 5.45,13 3.916,14 4.89,15 5.039,16 4.445,17 4.356,18 5.983,19 4.281,20 5.165,21 5.363,22 4.439,23 4.471,24 6.198,25 4.371,26 5.168,27 5.385,28 4.382,29 4.451,30 6.21,31 4.317,32 5.105,33 5.323,34 4.326,35 4.435,36 6.111,37 4.273,38 5.04,39 5.254,40 4.212,41 4.305,42 6.075,43 4.162,44 4.879,45 5.089,46 4.17,47 4.15,48 5.917,49 4.051,50 4.749,51 4.923,52 4.118,53 4.179,54 5.837,55 4.07,56 0.029,57 0.969,58 13.547,59 6.775,60 10.08,61 8.185,62 0.275,63 1.648,64 30.604,65 11.978,66 34.526,67 14.223,68 0.427,69 2.032,70 41.964,71 16.221,72 53.821,73 19.437,74 0.522,75 2.035,76 43.896,77 16.782,78 74.036,79 20.326,80 0.34,81 1.951,82 46.87,83 17.967,84 60.915,85 21.321,86 0.523,87 1.782,88 43.354,89 15.969,90 70.586,91 18.711,92 0.519,93 1.518,94 35.687,95 12.512,96 54.603,97 14.773,98 0.305,99 1.38,100 26.504,101 11.15,102 36.465,103 13.632,104 18,105 60,106 0.25,107 0.558,108 0.684,109 0.78,110 0.821,111 0.834,112 3.717,113 0.995,114 -4.46,115 -4.39,116 -4.13,117 43.7,119 4,122 4,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 13,136 1,137 14,138 1,139 1,140 1,141 14,142 1,144 14,145 2,146 9,147 2,148 1,149 8,152 2,153 12,154 2,155 1,156 7,160 17,162 1,163 8,164 1,165 1,169 12,171 1,172 6,174 12,176 2,177 3,180 2,181 15,182 2,183 1,184 4,185 2,186 14,187 2,188 3920,189 27.223,190 27.223,191 27.223,192 27.223,193 27.223,194 24.527,195 32.126,196 16.245,197 27.928,198 21.729,199 21.729,200 21.729,201 21.729,202 21.729,203 17.545,204 37.806,205 7.765,206 22.935,207 4.534,208 2.544,209 1.729,210 1.113,211 0.845,212 0.761,213 4.422,217 1,218 1691,219 3.808,220 133.594,221 640.645,222 3.623,223 37.687,226 0.75,227 0.67,228 0.67,229 0.7,230 0.67,231 1,232 0.71,233 85.5,234 778,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.903,241 4.506,242 11.323,243 2.982,244 4.185,245 3.688,246 5.932,247 3.798,248 2.811,249 3.78,250 1.192,251 8.268,252 2.788,253 4.082,254 3.501,255 5.806,256 3.666,257 2.687,258 3.672,259 0.98,260 8.033,261 2.622,262 3.956,263 3.361,264 5.582,265 3.533,266 2.584,267 3.456,268 0.86,269 7.596,270 2.447,271 3.742,272 3.063,273 5.372,274 3.449,275 2.519,276 3.082,277 0.86,278 7.023,279 2.34,280 3.57,281 2.899,282 5.338,283 3.356,284 2.406,285 2.882,286 0.8,287 6.959,288 2.273,289 3.519,290 2.821,291 5.245,292 3.145,293 2.193,294 2.606,295 0.553,296 6.539,297 2.07,298 3.339,299 2.531,300 4.952,301 2.934,302 1.969,303 2.52,305 5.759,306 1.897,307 3.256,308 2.466,309 4.907,310 2.675,311 1.805,312 2.4,313 5.205,314 1.591,315 2.803,316 2.211,317 4.446,318 2.585,319 1.613,320 1.785,321 3.926,322 1.498,323 2.745,324 1.859,325 3.779,326 2.302,327 1.372,328 1.728,329 3.326,330 1.259,331 2.624,332 1.755,333 3.724,334 2.257,335 1.256,336 1.619,337 2.934,338 1.239,339 2.5,340 1.686,341 3.471,342 2.19,343 1.227,344 1.5,345 2.754,346 1.153,347 2.5,348 1.511,349 3.414,350 2,351 1,352 1.5,353 2.275,354 1,355 2.5,356 1.137,357 3.414,358 2,359 1,360 1.5,361 2.275,362 1,363 19.7,364 0.493,365 0.886,366 0.022,367 50.25,368 1.256,369 25,370 0.625,371 25.25,372 0.631,373 37.239,374 0.931,375 42.1,376 0.593,377 40.664,378 1.017,379 9.612,380 0.24,381 9.846,382 0.246,383 0.096,384 0.294,385 0.775,386 1.134,387 0.683,388 0.89,389 0.621,390 0.888,391 0.866,392 1.101,393 0.721,394 0.914,395 0.508,396 0.949,397 1.196,398 0.945,399 0.845,400 0.874,401 0.828,402 0.917,403 1.092,404 0.843,405 0.858,406 0.826,407 0.888,408 0.912,409 0.733,410 0.97,411 1.102,412 1.09,413 0.906,414 0.981,415 1.018,416 0.949,417 1.09,418 1.021,419 0.906,420 0.956,421 1.094,422 0.862,423 0.855,424 0.877,425 0.777,426 0.821,427 0.678,428 0.98,429 0.907,430 0.968,431 0.63,432 0.996,433 7.5,434 0.278,435 3.778,436 2.604,437 1.913,438 1.049,439 0.944,440 0.606,441 0.297,442 0.316,443 33477,444 87196,445 2.107,446 43.7,447 2,448 21,449 2,450 4,451 2,452 1.793,453 2,454 4.178,455 0.124,459 114.717,460 1.616,461 3.606,462 4.42,463 5.037,464 5.305,465 5.389,466 3.731,467 4.772,468 5.283,469 4.42,470 3447.22,471 9.288,472 66686.2,476 436.632,477 1.295,478 5.266,479 0.17,480 0.007,481 0.063,482 0.043,483 0.036,484 0.021,485 0.021,486 0.014,487 0.007,488 0.008,489 0.389,490 0.17,491 0.75,492 0.598,493 234.269,494 -0.033,495 -0.068,496 0.047,497 0.002,498 -0.045,499 0.021,500 0.059,501 -0.049,502 0.124,503 0.006,504 0.123,505 -0.023,506 -0.097,507 0.032,508 0.049,509 0.051,510 0.03,511 0.042,512 -0.062,513 0.126,514 0.085,515 0.128,516 0.051,517 0.071,518 0.046,519 0.005,520 0.039,521 0.018,522 0.024,523 0.062,524 0.048,525 0.017,526 0.005,527 0.034,528 0.037,529 0.054,530 0.057,531 0.118,532 0.141,533 0.101,534 0.048,535 0.156,536 0.123,537 0.022,538 -0.005,539 0.001,540 0.081,541 -0.021,542 2.152,543 6.206,544 0.725,545 74.5,546 1.002,547 1.112,548 3.227,549 10.41,550 0.701,551 3.807,552 4.111,553 4.357,554 4.585,555 4.779,556 4.787,557 4.956,558 5.069,559 5.142,560 5.283,561 11.021,562 0.657,563 573.79,564 3.807,565 5.342,566 6.18,567 7.041,568 7.893,569 8.759,570 9.619,571 10.489,572 11.355,573 12.229,574 4.2,576 1,578 2,581 12,583 18,585 1,587 1,589 2,591 71,592 22,593 3,594 44,595 75,596 31,597 18,598 6,599 12,600 4,601 5,602 5,605 3,607 4,609 23,610 8,612 4,613 2,614 1,615 1,616 4,619 31,620 7,621 2,622 9,623 2,624 3,625 1,626 4,629 1,630 4,631 2,633 1,634 5,635 2,638 40,639 1,641 8,643 2,644 1,646 2,651 5.6,653 2,654 2,655 20,656 12.567,657 8.806,658 4.408,659 3.979,660 1.459,661 0.991,662 9.68,663 12.645,664 4.06,665 4.59,666 5.092,667 5.601,668 6.111,669 6.279,670 6.68,671 7.048,672 7.347,673 7.721,674 1,675 60,676 14.819,677 6.307,678 7.729,679 28.47,680 23.443,681 2.229,682 89.167,683 341.362,684 257.469,685 39.146,687 72.29,688 77.412,689 180.057,690 413.652,691 39.146,693 57.069,694 123.191,695 61.25,696 49.982,698 373.581,699 45.192,700 341.362,701 219.203,702 72.29,703 77.412,704 270.735,705 142.916,706 60.193,707 147.982,708 11.027,709 77.412,710 341.362,711 111.435,712 257.469,713 341.362,714 89.085,715 129.44,717 150.379,718 341.362,719 111.435,720 257.469,721 0.578,722 0.333,723 0.174,724 0.093,725 27,726 12,727 0.133,728 10,729 5.283,730 372.982,731 29,732 196.877,733 1,734 1,735 28.526,736 13.573,737 7.606,738 111.435,739 21.511,741 3.998,742 32.897,743 710.266,744 57,745 24.434,746 5.535,747 1.824,748 0.408,749 71.138,750 78.985,751 0.263,752 0.586,753 0.719,754 0.819,755 0.863,756 0.876,757 5.296,758 1.969,759 6.146,760 6.539,761 4.796,762 5.278,763 3.876,764 6.915,765 4.696,766 6.472,767 1.805,768 7.678,769 5.759,770 4.29,771 4.956,772 3.072,773 7.73,774 4.117,775 7.756,776 1.613,777 9.308,778 5.205,779 6.351,780 7.351,781 6.572,782 10.814,783 6.15,784 9.072,785 1.372,786 10.998,787 3.926,788 6.673,789 7.813,790 6.478,791 12.51,792 6.391,793 10.418,794 1.256,795 12.728,796 3.326,797 8.181,798 9.691,799 9.502,800 15.118,801 7.875,802 11.787,803 1.227,804 14.487,805 2.934,806 8.903,807 10.522,808 9.746,809 17.218,810 8.508,811 13.172,812 1,813 16.269,814 2.754,815 10.179,816 12.167,817 12.451,818 19.683,819 9.753,820 3.233,821 1,822 18.071,823 2.275,824 11.107,825 13.197,826 12.932,827 21.968,828 10.588,829 2.811,830 11.323,831 19.889,832 2.275,833 12.289,834 14.716,835 15.408,836 24.395,837 11.725,838 2.687,839 8.268,840 21.721,841 3.903,842 13.324,843 15.864,844 16.07,845 26.761,846 12.667,847 2.584,848 8.033,849 23.566,850 3.78,851 14.473,852 17.311,853 18.371,854 29.183,855 13.756,856 2.519,857 7.596,858 25.422,859 3.672,860 15.564,861 18.529,862 19.176,863 31.583,864 14.755,865 2.406,866 7.023,867 27.289,868 3.456,869 16.706,870 19.934,871 21.339,872 34.005,873 15.826,874 2.193,875 6.959,876 29.163,877 3.082,878 17.828,879 21.197,880 22.261,881 36.42,882 16.857,883 31263,884 50934,885 29.819,886 49.79,887 65.788,888 70.881,889 66.579,890 65.207,891 65.061,892 82.469,893 19.501,894 181.324,895 61.851,896 5.481,897 6.912,898 6.661,899 5.287,900 5.233,901 6.903,902 8.641,903 18.496,904 4.982,905 18.173,906 1.495,907 1.611,908 1.513,909 1.482,910 1.479,911 1.874,912 0.443,913 4.121,914 1.406,915 4.015,916 4.035,917 4.223,918 3.95,919 7.438,920 3.938,921 3.927,922 3.948,923 3.913,924 3.848,925 7.427,926 3.847,927 3.87,928 3.923,929 3.824,930 3.805,931 4.956,932 3.801,933 3.846,934 3.881,935 3.784,936 3.7,937 4.878,938 3.694,939 3.649,940 3.659,941 3.714,942 3.621,943 4.86,944 3.561,945 3.523,946 3.579,947 3.403,948 3.38,949 4.723,950 3.363,951 3.348,952 3.39,953 3.367,954 3.122,955 4.632,956 3.139,957 3.126,958 3.206,959 3.274,960 3.041,961 4.363,962 3.001,963 0.102,964 0.112,965 0.156,966 0.094,967 0.073,968 4.481,969 0.089,970 4.912,971 0.102,972 6.859,973 0.257,974 4.152,975 0.068,976 3.233,977 3.903,978 4.506,979 11.323,980 2.982,981 1.935,982 1.919,983 2.065,984 2.035,985 1.418,986 2.047,987 1.889,988 1.866,989 2.028,990 2.029,991 1.168,992 2.029,993 1.862,994 1.841,995 1.985,996 1.987,997 1.118,998 1.988,999 1.833,1000 1.768,1001 1.963,1002 1.939,1003 1.065,1004 1.949,1005 1.551,1006 1.489,1007 1.823,1008 1.748,1009 1.055,1010 1.775,1011 1.431,1012 1.428,1013 1.513,1014 1.582,1015 0.825,1016 1.554,1017 1.234,1018 1.242,1019 1.485,1020 1.52,1021 0.642,1022 1.482,1023 1.196,1024 1.166,1025 1.381,1026 1.376,1027 0.625,1028 1.429,1029 4.489,1030 5.796,1031 2.398,1032 7.288,1033 4.844,1034 8.86,1035 7.002,1036 10.472,1039 5.278,1041 9.079,1043 11.755,1044 1.28,1046 4.063,1049 46.673,1050 114.717,1051 255.997,1052 313.838,1053 357.612,1054 376.632,1055 382.632,1056 78.351,1057 8.667,1058 86.79,1059 147.12,1060 29,1061 12.771,1062 4.524,1063 3.807,1064 64.506,1065 261,1066 273,1067 0.115,1068 291.74,1069 521.22,1070 703.605,1071 95300,1073 27.899,1074 0.697,1075 0.593,1076 28.752,1077 23.717,1078 19.458,1079 0.442,1080 0.332,1081 13.326,1082 18.209,1083 12.974,1084 10.713,1085 20.154,1086 14.596,1087 17.362,1088 0.289,1089 0.189,1090 18.537,1091 11.351,1092 14.421,1093 0.187,1094 0.105,1095 15.533,1096 8.079,1097 11.783,1098 0.121,1099 0.061,1100 13.171,1101 5.949,1102 9.383,1103 0.08,1104 0.034,1105 10.571,1106 4.062,1107 0.192,1108 127.995,1109 0.183,1110 37.433,1111 0.289,1112 208,1113 605.265,1114 271.495,1115 624.973,1116 846.81,1117 584,1118 241,1119 591.297,1120 291.525,1121 619.562,1122 909.03,1123 584,1124 4.523}
{0 CHEMBL2070423,1 1.64,2 17.5,3 6.006,4 36.074,5 157.686,6 8.175,7 0.439,8 4.289,9 4.392,10 3.963,11 3.888,12 5.427,13 3.843,14 4.798,15 4.95,16 4.387,17 4.255,18 5.937,19 4.187,20 5.03,21 5.21,22 4.399,23 4.372,24 6.134,25 4.292,26 5.059,27 5.245,28 4.382,29 4.406,30 6.17,31 4.286,32 5.138,33 5.363,34 4.34,35 4.409,36 6.21,37 4.253,38 4.994,39 5.209,40 4.184,41 4.269,42 6.032,43 4.138,44 4.774,45 4.947,46 4.183,47 4.16,48 5.926,49 4.066,50 4.81,51 4.999,52 4.053,53 4.181,54 5.918,55 4.044,56 0.038,57 0.913,58 12.511,59 6.305,60 11.285,61 7.521,62 0.296,63 1.51,64 28.549,65 10.862,66 34.957,67 12.669,68 0.49,69 1.789,70 36.177,71 13.814,72 49.847,73 15.991,74 0.348,75 1.834,76 36.75,77 15.147,78 63.941,79 17.875,80 0.616,81 1.978,82 49.904,83 18.264,84 82.935,85 21.44,86 0.514,87 1.715,88 42.317,89 14.956,90 67.29,91 16.99,92 0.357,93 1.417,94 29.182,95 11.247,96 45.083,97 13.318,98 0.344,99 1.461,100 28.242,101 11.993,102 49.066,103 14.83,104 50,105 56,106 0.257,107 0.568,108 0.707,109 0.811,110 0.836,111 0.836,112 3.667,113 0.989,114 -4.07,115 -4.02,116 -3.81,117 43.3,118 2,122 4,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 11,136 1,137 12,138 1,139 1,140 1,141 13,142 1,143 1,144 13,145 2,146 9,147 2,149 7,152 1,153 9,154 1,155 2,156 12,157 1,158 1,159 1,160 14,161 1,163 6,169 12,171 1,172 4,173 2,174 16,175 2,176 3,177 3,180 2,181 15,182 2,184 2,185 1,186 7,187 1,188 3290,189 25.687,190 25.687,191 25.687,192 25.687,193 25.687,194 22.992,195 30.357,196 15.095,197 26.467,198 20.084,199 20.084,200 20.084,201 20.084,202 20.084,203 15.889,204 35.127,205 7.003,206 21.316,207 4.426,208 2.447,209 1.558,210 0.894,211 0.739,212 0.739,213 4.36,217 1,218 1406,219 4.243,220 125.981,221 442.978,222 3.263,223 37.915,226 0.75,227 0.67,228 0.67,229 0.7,230 0.5,231 0.5,232 0.61,233 81.5,234 665,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.904,241 4.506,242 11.323,243 2.982,244 4.214,245 3.688,246 5.983,247 3.829,248 2.844,249 3.811,250 1.192,251 8.531,252 2.81,253 4.08,254 3.506,255 5.805,256 3.66,257 2.682,258 3.673,259 0.98,260 8.027,261 2.619,262 3.951,263 3.361,264 5.555,265 3.528,266 2.579,267 3.454,268 0.86,269 7.472,270 2.444,271 3.708,272 3.06,273 5.372,274 3.366,275 2.444,276 3.022,277 0.86,278 7.004,279 2.251,280 3.547,281 2.918,282 5.269,283 3.311,284 2.366,285 2.848,286 0.8,287 6.637,288 2.22,289 3.439,290 2.753,291 5.226,292 3.121,293 2.168,294 2.603,295 0.553,296 6.471,297 2.051,298 3.329,299 2.534,300 4.943,301 2.923,302 1.954,303 2.439,305 5.68,306 1.888,307 3.254,308 2.457,309 4.898,310 2.664,311 1.802,312 2.395,313 5.202,314 1.508,315 2.828,316 2.212,317 4.446,318 2.334,319 1.371,320 1.908,321 3.919,322 1.318,323 2.765,324 1.789,325 3.764,326 2.262,327 1.317,328 1.738,329 3.011,330 1.199,331 2.53,332 1.687,333 3.447,334 2.083,335 1.144,336 1.5,337 2.489,338 1.061,339 2.5,340 1.599,341 3.436,342 2.016,343 1,344 1.5,345 2.323,346 1.01,347 2.5,348 1.184,349 3.414,350 2,351 1,352 1.475,353 2.275,354 1,355 2.257,356 1.104,357 3.414,358 2,359 1,360 1.237,361 2.275,362 1,363 18.7,364 0.492,365 0.886,366 0.023,367 48.75,368 1.283,369 25,370 0.658,371 23.75,372 0.625,373 34.504,374 0.908,375 40.1,376 0.599,377 40.518,378 1.066,379 9.65,380 0.254,381 8.722,382 0.23,383 0.155,384 0.31,385 0.788,386 1.156,387 0.684,388 0.897,389 0.659,390 0.894,391 0.895,392 1.059,393 0.678,394 0.856,395 0.534,396 0.87,397 1.294,398 0.854,399 0.855,400 0.814,401 0.915,402 0.85,403 1.063,404 1.018,405 0.884,406 0.971,407 0.941,408 1.036,409 0.833,410 0.889,411 1.053,412 0.991,413 0.825,414 0.899,415 1.294,416 0.832,417 1.113,418 0.896,419 1.117,420 0.841,421 0.761,422 1.068,423 0.899,424 1.079,425 0.787,426 1.02,427 0.601,428 1.035,429 0.955,430 1.063,431 0.846,432 1.154,433 8,434 0.275,435 3.778,436 2.917,437 1.842,438 1.181,439 1.047,440 0.531,441 0.37,442 0.32,443 26202,444 73275,445 2.038,446 43.3,448 21,449 2,450 6,452 1.781,453 1.9,454 4.04,455 0.149,459 109.91,460 1.64,461 3.619,462 4.508,463 5.172,464 5.327,465 5.327,466 3.537,467 4.827,468 5.211,469 4.287,470 3013.95,471 9.149,472 54855.9,476 406.428,477 1.433,478 5.174,479 0.195,480 0.008,481 0.067,482 0.05,483 0.035,484 0.023,485 0.023,486 0.012,487 0.009,488 0.009,489 0.431,490 0.33,491 0.75,492 1.4,493 217.704,494 -0.039,495 -0.087,496 0.043,497 -0.009,498 -0.083,499 0.009,500 0.063,501 -0.001,502 0.182,503 0.066,504 0.118,505 0.052,506 -0.11,507 0.146,508 0.045,509 0.112,510 -0.006,511 0.089,512 -0.075,513 -0.051,514 0.032,515 -0.011,516 0.014,517 -0.062,518 0.118,519 0.071,520 0.086,521 0.097,522 0.102,523 0.138,524 -0.17,525 0.148,526 -0.011,527 0.154,528 -0.096,529 0.16,530 0.116,531 -0.057,532 0.037,533 -0.102,534 0.077,535 -0.051,536 0.136,537 -0.056,538 -0.075,539 -0.111,540 -0.005,541 -0.168,542 2.182,543 6.164,544 0.605,545 64.017,546 1.004,547 1.113,548 2.844,549 8.086,550 0.702,551 3.738,552 4.043,553 4.29,554 4.511,555 4.691,556 4.727,557 4.92,558 5.004,559 5.106,560 5.252,561 10.16,562 0.659,563 547.75,564 3.738,565 5.273,566 6.111,567 6.976,568 7.831,569 8.701,570 9.565,571 10.439,572 11.309,573 12.187,574 4.5,576 1,578 2,581 12,583 18,585 1,587 1,589 2,591 67,592 22,593 3,594 41,595 70,596 29,597 18,598 6,599 12,600 4,601 4,602 4,604 2,609 23,610 6,612 4,613 2,614 1,615 1,616 4,619 29,620 7,621 2,622 9,623 2,624 3,625 1,626 4,629 1,630 3,631 2,633 1,634 4,635 2,636 2,638 38,639 1,641 4,643 2,644 1,646 2,651 6,653 2,654 2,655 20,656 12.567,657 8.556,658 4.158,659 3.972,660 1.477,661 0.972,662 9.719,663 12.302,664 4.007,665 4.549,666 5.061,667 5.579,668 6.091,669 6.254,670 6.688,671 7.03,672 7.355,673 7.734,674 0.917,675 58,676 14.042,677 5.879,678 7.794,679 26.619,680 21.265,681 2.294,682 87.167,683 317.82,684 264.981,685 39.146,687 72.29,688 77.412,689 187.569,690 390.109,691 39.146,692 17.65,693 46.931,694 123.191,695 61.25,696 49.982,698 350.039,699 45.192,700 317.82,701 226.715,702 72.29,703 77.412,704 247.193,705 142.916,706 67.706,707 147.982,708 11.027,709 77.412,710 317.82,711 111.435,712 264.981,713 317.82,714 78.947,715 147.09,717 150.379,718 317.82,719 111.435,720 264.981,721 0.576,722 0.339,723 0.173,724 0.089,725 24,726 12,727 0.157,728 11,729 4.933,730 346.992,731 23,732 187.421,733 1,734 1,735 28.019,736 13.181,737 7.319,738 111.435,739 21.377,741 3.768,742 32.897,743 694.236,744 54,745 24.546,746 5.511,747 1.807,748 0.333,749 67.254,750 74.57,751 0.27,752 0.597,753 0.743,754 0.853,755 0.878,756 0.878,757 5.239,758 1.954,759 6.089,760 6.471,761 4.727,762 5.236,763 3.876,764 6.872,765 4.62,766 6.429,767 1.802,768 7.635,769 5.68,770 4.29,771 4.956,772 3.072,773 7.73,774 4.117,775 7.722,776 1.371,777 9.277,778 5.202,779 6.301,780 7.333,781 6.572,782 10.801,783 6.091,784 9.046,785 1.317,786 10.976,787 3.919,788 6.673,789 7.813,790 6.478,791 12.511,792 6.391,793 10.398,794 1.144,795 12.713,796 3.011,797 8.146,798 9.685,799 9.502,800 15.12,801 7.832,802 11.771,803 1,804 14.477,805 2.489,806 8.901,807 10.527,808 9.746,809 17.224,810 8.506,811 13.16,812 1,813 16.263,814 2.323,815 10.158,816 12.17,817 12.451,818 19.69,819 9.727,820 3.233,821 1,822 18.067,823 2.275,824 11.106,825 13.209,826 12.932,827 21.976,828 10.589,829 2.844,830 11.323,831 19.888,832 2.275,833 12.279,834 14.728,835 15.408,836 24.404,837 11.714,838 2.682,839 8.531,840 21.722,841 3.904,842 13.325,843 15.883,844 16.07,845 26.769,846 12.672,847 2.579,848 8.027,849 23.568,850 3.811,851 14.472,852 17.331,853 18.371,854 29.189,855 13.757,856 2.444,857 7.472,858 25.426,859 3.673,860 15.569,861 18.557,862 19.176,863 31.589,864 14.766,865 2.366,866 7.004,867 27.293,868 3.454,869 16.711,870 19.962,871 21.339,872 34.01,873 15.837,874 2.168,875 6.637,876 29.168,877 3.022,878 17.836,879 21.231,880 22.261,881 36.424,882 16.874,883 25327,884 42738,885 27.046,886 47.029,887 60.883,888 65.911,889 62.89,890 60.299,891 60.173,892 77.58,893 19.501,894 169.503,895 56.965,896 5.392,897 6.912,898 6.477,899 5.287,900 5.233,901 6.904,902 8.641,903 18.496,904 4.982,905 21.742,906 1.485,907 1.608,908 1.534,909 1.471,910 1.468,911 1.892,912 0.476,913 4.134,914 1.389,915 4.012,916 4.03,917 4.223,918 3.949,919 7.438,920 3.937,921 3.927,922 3.946,923 3.914,924 3.848,925 7.427,926 3.847,927 3.861,928 3.885,929 3.822,930 3.804,931 4.957,932 3.799,933 3.741,934 3.815,935 3.781,936 3.624,937 4.877,938 3.57,939 3.632,940 3.636,941 3.59,942 3.53,943 4.858,944 3.525,945 3.347,946 3.407,947 3.4,948 3.135,949 4.724,950 3.136,951 3.324,952 3.399,953 3.269,954 3.123,955 4.634,956 3.114,957 3.306,958 3.386,959 3.166,960 3.103,961 4.365,962 3.089,963 0.109,964 0.12,965 0.167,966 0.101,967 0.079,968 4.481,969 0.095,970 4.912,971 0.11,972 6.859,973 0.276,974 4.152,975 0.073,976 3.233,977 3.904,978 4.506,979 11.323,980 2.982,981 1.935,982 1.919,983 2.028,984 2.031,985 1.207,986 2.029,987 1.887,988 1.865,989 1.992,990 2.002,991 1.118,992 2,993 1.861,994 1.84,995 1.964,996 1.94,997 1.074,998 1.95,999 1.697,1000 1.619,1001 1.942,1002 1.918,1003 1.056,1004 1.931,1005 1.434,1006 1.431,1007 1.725,1008 1.614,1009 0.885,1010 1.638,1011 1.351,1012 1.293,1013 1.652,1014 1.584,1015 0.869,1016 1.613,1017 1.337,1018 1.256,1019 1.482,1020 1.547,1021 0.626,1022 1.54,1023 1.212,1024 1.195,1025 1.393,1026 1.515,1027 0.326,1028 1.489,1029 4.419,1030 5.727,1031 2.398,1032 7.22,1033 4.844,1034 8.794,1035 7.002,1036 10.41,1037 4.265,1039 5.333,1041 3.454,1043 11.672,1044 1.266,1046 3.834,1049 44.146,1050 109.91,1051 242.49,1052 302.024,1053 346.554,1054 356.918,1055 356.918,1056 81.891,1057 8.331,1058 86.79,1059 147.12,1060 23,1061 12.726,1062 4.524,1063 3.807,1064 68.151,1065 229,1066 233,1067 0.141,1068 279.948,1069 498.98,1070 674.834,1071 58733,1073 27.07,1074 0.712,1075 0.602,1076 27.924,1077 22.888,1078 18.372,1079 0.448,1080 0.33,1081 12.24,1082 17.109,1083 11.819,1084 9.823,1085 19.069,1086 13.51,1087 16.199,1088 0.289,1089 0.181,1090 17.374,1091 10.125,1092 13.533,1093 0.188,1094 0.101,1095 14.645,1096 7.294,1097 10.895,1098 0.121,1099 0.057,1100 12.283,1101 5.146,1102 8.429,1103 0.078,1104 0.029,1105 9.617,1106 3.166,1107 0.233,1108 121.48,1109 0.192,1110 35.579,1111 0.358,1112 194,1113 591.265,1114 257.495,1115 610.856,1116 825.61,1117 570,1118 225,1119 575.297,1120 275.247,1121 603.069,1122 884.31,1123 568,1124 5.155}
{0 CHEMBL2070424,1 1.64,2 18.105,3 6.006,4 36.074,5 157.686,6 8.175,7 0.439,8 4.289,9 4.392,10 3.963,11 3.888,12 5.427,13 3.843,14 4.798,15 4.95,16 4.387,17 4.255,18 5.937,19 4.187,20 5.03,21 5.21,22 4.399,23 4.372,24 6.136,25 4.292,26 5.059,27 5.245,28 4.368,29 4.405,30 6.174,31 4.282,32 5.132,33 5.364,34 4.301,35 4.401,36 6.15,37 4.238,38 4.978,39 5.196,40 4.176,41 4.245,42 6.038,43 4.109,44 4.742,45 4.916,46 4.143,47 4.125,48 5.853,49 4.029,50 4.756,51 4.939,52 4.059,53 4.166,54 5.846,55 4.034,56 0.038,57 0.913,58 12.511,59 6.305,60 11.285,61 7.521,62 0.296,63 1.51,64 28.549,65 10.862,66 34.917,67 12.669,68 0.49,69 1.789,70 36.177,71 13.814,72 49.96,73 15.991,74 0.363,75 1.834,76 36.765,77 15.145,78 66.069,79 17.856,80 0.476,81 1.976,82 49.915,83 18.296,84 73.402,85 21.529,86 0.605,87 1.682,88 42.04,89 14.89,90 73.355,91 17.172,92 0.395,93 1.362,94 28.834,95 10.926,96 43.882,97 12.77,98 0.284,99 1.389,100 26.416,101 11.587,102 36.765,103 14.419,104 50,105 56,106 0.257,107 0.568,108 0.69,109 0.771,110 0.803,111 0.817,112 3.667,113 0.989,114 -4.07,115 -4.02,116 -3.81,117 43.3,118 2,122 4,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 11,136 1,137 12,138 1,139 1,140 1,141 13,142 1,143 1,144 13,145 2,146 9,147 2,149 8,152 2,153 9,154 2,155 1,156 11,160 14,162 1,163 6,164 1,165 1,169 12,171 1,172 2,174 16,176 3,177 3,180 2,181 15,182 2,184 3,185 2,186 7,187 2,188 3350,189 25.687,190 25.687,191 25.687,192 25.687,193 25.687,194 22.992,195 30.357,196 15.054,197 26.467,198 20.067,199 20.067,200 20.067,201 20.067,202 20.067,203 15.883,204 35.127,205 6.976,206 21.302,207 4.426,208 2.447,209 1.665,210 1.15,211 0.948,212 0.858,213 4.36,217 1,218 1454,219 4.243,220 127.847,221 447.716,222 3.274,223 37.441,226 0.75,227 0.67,228 0.67,229 0.7,230 0.5,231 0.5,232 0.61,233 81.5,234 688,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.903,241 4.506,242 11.323,243 2.982,244 4.185,245 3.688,246 5.932,247 3.798,248 2.811,249 3.78,250 1.192,251 8.268,252 2.788,253 4.082,254 3.501,255 5.806,256 3.666,257 2.687,258 3.672,259 0.98,260 8.033,261 2.622,262 3.956,263 3.361,264 5.582,265 3.535,266 2.587,267 3.457,268 0.86,269 7.596,270 2.448,271 3.742,272 3.063,273 5.376,274 3.377,275 2.45,276 3.082,277 0.86,278 7.028,279 2.278,280 3.571,281 2.918,282 5.272,283 3.333,284 2.39,285 2.883,286 0.8,287 6.647,288 2.229,289 3.44,290 2.753,291 5.237,292 3.137,293 2.187,294 2.608,295 0.553,296 6.519,297 2.063,298 3.333,299 2.53,300 4.952,301 2.931,302 1.966,303 2.439,305 5.759,306 1.893,307 3.254,308 2.457,309 4.907,310 2.663,311 1.803,312 2.395,313 5.204,314 1.508,315 2.8,316 2.211,317 4.446,318 2.287,319 1.363,320 1.783,321 3.919,322 1.254,323 2.743,324 1.859,325 3.779,326 2.242,327 1.241,328 1.722,329 2.934,330 1.195,331 2.5,332 1.691,333 3.446,334 2.083,335 1.144,336 1.5,337 2.489,338 1.061,339 2.5,340 1.599,341 3.414,342 2,343 1,344 1.5,345 2.275,346 1,347 2.5,348 1.104,349 3.414,350 2,351 1,352 1.5,353 2.275,354 1,355 2.257,356 1,357 3.414,358 2,359 1,360 1.237,361 2.275,362 1,363 18.7,364 0.492,365 0.886,366 0.023,367 48.75,368 1.283,369 25,370 0.658,371 23.75,372 0.625,373 34.355,374 0.904,375 40.1,376 0.599,377 40.298,378 1.06,379 9.65,380 0.254,381 8.722,382 0.23,383 0.155,384 0.31,385 0.788,386 1.156,387 0.684,388 0.897,389 0.659,390 0.894,391 0.895,392 1.059,393 0.678,394 0.856,395 0.535,396 0.87,397 1.294,398 0.854,399 0.855,400 0.814,401 0.909,402 0.85,403 1.079,404 1.018,405 0.905,406 0.974,407 0.943,408 1.052,409 0.873,410 0.899,411 1.063,412 0.999,413 0.903,414 0.907,415 1.089,416 0.82,417 1.078,418 0.905,419 0.929,420 0.841,421 0.86,422 1,423 0.926,424 1.042,425 0.771,426 0.991,427 0.446,428 1.04,429 0.908,430 1.07,431 0.579,432 1.129,433 8,434 0.308,435 4,436 2.792,437 1.842,438 1.181,439 0.965,440 0.578,441 0.362,442 0.324,443 26586,444 74759,445 2.038,446 43.3,448 21,449 2,450 6,452 1.781,453 1.9,454 4.08,455 0.149,459 109.91,460 1.64,461 3.619,462 4.401,463 4.917,464 5.118,465 5.208,466 3.622,467 4.774,468 5.209,469 4.322,470 3038.02,471 9.144,472 55624.9,476 406.428,477 1.433,478 5.174,479 0.195,480 0.009,481 0.071,482 0.048,483 0.035,484 0.024,485 0.021,486 0.013,487 0.009,488 0.009,489 0.435,490 0.33,491 0.75,492 1.4,493 218.212,494 -0.039,495 -0.087,496 0.043,497 -0.009,498 -0.083,499 0.009,500 0.063,501 -0.001,502 0.182,503 0.066,504 0.117,505 0.052,506 -0.11,507 0.146,508 0.045,509 0.112,511 0.089,512 -0.091,513 -0.05,514 0.011,515 -0.014,516 0.012,517 -0.079,518 0.014,519 0.059,520 0.077,521 0.091,522 0.012,523 0.138,524 0.007,525 0.155,526 0.033,527 0.152,528 0.023,529 0.169,530 0.082,531 0.007,532 0.028,533 -0.055,534 0.028,535 -0.022,536 0.198,537 -0.063,538 -0.03,539 -0.104,540 0.08,541 -0.133,542 2.154,543 6.157,544 0.605,545 65.928,546 1.004,547 1.113,548 2.844,549 8.086,550 0.702,551 3.738,552 4.043,553 4.29,554 4.5,555 4.682,556 4.736,557 4.913,558 5.017,559 5.094,560 5.242,561 10.333,562 0.659,563 547.75,564 3.738,565 5.273,566 6.111,567 6.974,568 7.828,569 8.697,570 9.56,571 10.433,572 11.302,573 12.179,574 4.5,576 1,578 2,581 12,583 18,585 1,587 1,589 2,591 67,592 22,593 3,594 41,595 70,596 29,597 18,598 6,599 12,600 4,601 4,602 4,604 2,609 23,610 6,612 4,613 2,614 1,615 1,616 4,619 29,620 7,621 2,622 9,623 2,624 3,625 1,626 4,629 1,630 3,631 2,633 1,634 4,635 2,636 2,638 38,639 1,641 4,643 2,644 1,646 2,651 6,653 2,654 2,655 20,656 12.567,657 8.556,658 4.158,659 3.942,660 1.473,661 0.972,662 9.719,663 12.273,664 4.007,665 4.549,666 5.061,667 5.571,668 6.086,669 6.27,670 6.675,671 7.043,672 7.346,673 7.721,674 1,675 58,676 14.036,677 5.871,678 7.794,679 26.619,680 21.265,681 2.294,682 87.167,683 317.82,684 264.981,685 39.146,687 72.29,688 77.412,689 187.569,690 390.109,691 39.146,692 17.65,693 46.931,694 123.191,695 61.25,696 49.982,698 350.039,699 45.192,700 317.82,701 226.715,702 72.29,703 77.412,704 247.193,705 142.916,706 67.706,707 147.982,708 11.027,709 77.412,710 317.82,711 111.435,712 264.981,713 317.82,714 78.947,715 147.09,717 150.379,718 317.82,719 111.435,720 264.981,721 0.577,722 0.339,723 0.171,724 0.086,725 24,726 12,727 0.157,728 11,729 4.96,730 345.256,731 23,732 183.421,733 1,734 1,735 28.019,736 13.181,737 7.319,738 111.435,739 21.374,741 3.94,742 32.897,743 694.236,744 54,745 24.369,746 5.511,747 1.815,748 0.38,749 67.254,750 74.57,751 0.27,752 0.597,753 0.726,754 0.81,755 0.844,756 0.858,757 5.239,758 1.966,759 6.089,760 6.519,761 4.727,762 5.236,763 3.876,764 6.87,765 4.62,766 6.429,767 1.803,768 7.635,769 5.759,770 4.29,771 4.956,772 3.072,773 7.73,774 4.117,775 7.722,776 1.363,777 9.277,778 5.204,779 6.301,780 7.333,781 6.572,782 10.793,783 6.091,784 9.046,785 1.241,786 10.975,787 3.919,788 6.673,789 7.813,790 6.478,791 12.504,792 6.391,793 10.398,794 1.144,795 12.711,796 2.934,797 8.144,798 9.684,799 9.502,800 15.107,801 7.83,802 11.77,803 1,804 14.474,805 2.489,806 8.897,807 10.521,808 9.746,809 17.212,810 8.502,811 13.159,812 1,813 16.259,814 2.275,815 10.153,816 12.163,817 12.451,818 19.677,819 9.721,820 3.233,821 1,822 18.063,823 2.275,824 11.098,825 13.196,826 12.932,827 21.964,828 10.579,829 2.811,830 11.323,831 19.882,832 2.275,833 12.27,834 14.715,835 15.408,836 24.393,837 11.702,838 2.687,839 8.268,840 21.715,841 3.903,842 13.314,843 15.863,844 16.07,845 26.76,846 12.657,847 2.587,848 8.033,849 23.561,850 3.78,851 14.46,852 17.31,853 18.371,854 29.181,855 13.74,856 2.45,857 7.596,858 25.418,859 3.672,860 15.556,861 18.529,862 19.176,863 31.582,864 14.746,865 2.39,866 7.028,867 27.285,868 3.457,869 16.697,870 19.933,871 21.339,872 34.004,873 15.815,874 2.187,875 6.647,876 29.16,877 3.082,878 17.822,879 21.197,880 22.261,881 36.42,882 16.849,883 25693,884 43462,885 27.046,886 47.029,887 60.871,888 65.801,889 62.899,890 60.268,891 60.134,892 77.535,893 19.501,894 169.418,895 56.927,896 5.392,897 6.912,898 6.477,899 5.287,900 5.233,901 6.903,902 8.641,903 18.496,904 4.982,905 21.865,906 1.485,907 1.605,908 1.534,909 1.47,910 1.467,911 1.891,912 0.476,913 4.132,914 1.388,915 4.012,916 4.029,917 4.223,918 3.949,919 7.438,920 3.937,921 3.926,922 3.946,923 3.912,924 3.848,925 7.427,926 3.847,927 3.862,928 3.886,929 3.822,930 3.804,931 4.956,932 3.8,933 3.741,934 3.815,935 3.783,936 3.624,937 4.878,938 3.57,939 3.633,940 3.637,941 3.59,942 3.53,943 4.86,944 3.525,945 3.352,946 3.407,947 3.403,948 3.138,949 4.724,950 3.145,951 3.322,952 3.4,953 3.275,954 3.123,955 4.632,956 3.113,957 3.306,958 3.384,959 3.166,960 3.11,961 4.365,962 3.089,963 0.109,964 0.12,965 0.167,966 0.101,967 0.079,968 4.481,969 0.095,970 4.912,971 0.11,972 6.859,973 0.276,974 4.152,975 0.073,976 3.233,977 3.903,978 4.506,979 11.323,980 2.982,981 1.935,982 1.919,983 2.028,984 2.03,985 1.207,986 2.029,987 1.887,988 1.865,989 1.992,990 2.002,991 1.118,992 2,993 1.861,994 1.84,995 1.964,996 1.941,997 1.074,998 1.951,999 1.697,1000 1.619,1001 1.942,1002 1.918,1003 1.056,1004 1.931,1005 1.435,1006 1.432,1007 1.725,1008 1.615,1009 0.885,1010 1.638,1011 1.351,1012 1.293,1013 1.652,1014 1.584,1015 0.869,1016 1.613,1017 1.337,1018 1.256,1019 1.483,1020 1.55,1021 0.626,1022 1.543,1023 1.212,1024 1.195,1025 1.375,1026 1.508,1027 0.326,1028 1.48,1029 4.419,1030 5.727,1031 2.398,1032 7.22,1033 4.844,1034 8.793,1035 7.002,1036 10.407,1037 4.267,1039 5.27,1041 3.46,1043 11.672,1044 1.271,1046 3.839,1049 44.146,1050 109.91,1051 242.49,1052 294.879,1053 329.408,1054 342.918,1055 348.918,1056 81.228,1057 8.331,1058 86.79,1059 147.12,1060 23,1061 12.719,1062 4.524,1063 3.807,1064 68.193,1065 232,1066 233,1067 0.139,1068 279.948,1069 498.98,1070 674.834,1071 58733,1073 27.07,1074 0.712,1075 0.602,1076 27.924,1077 22.888,1078 18.372,1079 0.448,1080 0.33,1081 12.24,1082 17.109,1083 11.819,1084 9.821,1085 19.069,1086 13.51,1087 16.187,1088 0.289,1089 0.181,1090 17.362,1091 10.122,1092 13.601,1093 0.189,1094 0.102,1095 14.713,1096 7.314,1097 10.834,1098 0.122,1099 0.058,1100 12.221,1101 5.12,1102 8.289,1103 0.077,1104 0.029,1105 9.477,1106 3.153,1107 0.23,1108 121.48,1109 0.192,1110 35.683,1111 0.352,1112 194,1113 591.265,1114 257.495,1115 610.792,1116 825.59,1117 570,1118 225,1119 575.297,1120 275.247,1121 602.933,1122 884.03,1123 568,1124 5.097}
{0 CHEMBL2070426,1 1.634,2 18.205,3 5.832,4 34.012,5 160.596,6 8.232,7 0.419,8 4.317,9 4.416,10 4.001,11 3.928,12 5.427,13 3.885,14 4.847,15 4.99,16 4.429,17 4.322,18 5.96,19 4.251,20 5.103,21 5.295,22 4.397,23 4.415,24 6.159,25 4.318,26 5.083,27 5.29,28 4.372,29 4.39,30 6.161,31 4.269,32 5.037,33 5.233,34 4.345,35 4.399,36 6.139,37 4.252,38 5,39 5.204,40 4.2,41 4.285,42 6.04,43 4.153,44 4.842,45 5.042,46 4.184,47 4.145,48 5.946,49 4.053,50 4.744,51 4.915,52 4.092,53 4.165,54 5.872,55 4.051,56 0.038,57 0.928,58 12.512,59 6.404,60 10.603,61 7.611,62 0.285,63 1.578,64 28.66,65 11.332,66 34.026,67 13.186,68 0.439,69 1.909,70 38.98,71 15.233,72 52.421,73 17.856,74 0.497,75 1.869,76 39.91,77 15.487,78 69.483,79 18.343,80 0.474,81 1.826,82 42.994,83 16.648,84 68.213,85 19.261,86 0.439,87 1.726,88 41.247,89 15.203,90 63.008,91 17.183,92 0.482,93 1.486,94 33.45,95 12.006,96 54.78,97 14.06,98 0.322,99 1.382,100 25.596,101 10.848,102 44.42,103 13.106,104 18,105 59,106 0.255,107 0.567,108 0.704,109 0.812,110 0.849,111 0.849,112 3.692,113 0.983,114 -4.27,115 -4.2,116 -3.97,117 44.1,119 3,122 4,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 12,136 1,137 14,138 1,139 1,140 1,141 13,142 1,144 13,145 2,146 9,147 2,148 1,149 7,152 1,153 12,154 1,155 2,156 8,157 1,158 1,159 1,160 16,161 1,163 8,169 12,171 1,172 7,173 2,174 12,175 2,176 2,177 3,180 2,181 15,182 2,183 1,184 3,185 1,186 12,187 1,188 3590,189 26.515,190 26.515,191 26.515,192 26.515,193 26.515,194 23.82,195 32.126,196 15.786,197 27.221,198 21.246,199 21.246,200 21.246,201 21.246,202 21.246,203 17.051,204 37.806,205 7.542,206 22.449,207 4.454,208 2.451,209 1.576,210 0.881,211 0.647,212 0.647,213 4.397,217 1,218 1547,219 3.808,220 269.426,221 451.801,222 3.452,223 37.943,226 0.75,227 0.67,228 0.67,229 0.7,230 0.67,231 1,232 0.71,233 83.5,234 710,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.904,241 4.506,242 11.323,243 2.982,244 4.214,245 3.688,246 5.983,247 3.829,248 2.844,249 3.811,250 1.192,251 8.531,252 2.81,253 4.08,254 3.506,255 5.805,256 3.66,257 2.681,258 3.673,259 0.98,260 8.027,261 2.619,262 3.951,263 3.361,264 5.555,265 3.527,266 2.577,267 3.453,268 0.86,269 7.472,270 2.443,271 3.708,272 3.06,273 5.369,274 3.468,275 2.536,276 3.022,277 0.86,278 7.014,279 2.359,280 3.551,281 2.901,282 5.349,283 3.324,284 2.377,285 2.847,286 0.8,287 6.975,288 2.238,289 3.533,290 2.836,291 5.231,292 3.128,293 2.174,294 2.602,295 0.553,296 6.483,297 2.058,298 3.336,299 2.534,300 4.944,301 2.925,302 1.957,303 2.54,305 5.68,306 1.891,307 3.256,308 2.466,309 4.898,310 2.672,311 1.805,312 2.4,313 5.203,314 1.545,315 2.829,316 2.212,317 4.446,318 2.518,319 1.557,320 1.908,321 3.926,322 1.466,323 2.768,324 1.789,325 3.764,326 2.332,327 1.346,328 1.746,329 3.213,330 1.318,331 2.572,332 1.744,333 3.688,334 2.24,335 1.301,336 1.566,337 3.01,338 1.183,339 2.53,340 1.681,341 3.436,342 2.065,343 1.109,344 1.5,345 2.418,346 1.052,347 2.5,348 1.349,349 3.414,350 2.016,351 1,352 1.5,353 2.323,354 1.01,355 2.5,356 1.184,357 3.414,358 2,359 1,360 1.475,361 2.275,362 1,363 19.2,364 0.492,365 0.886,366 0.023,367 49.75,368 1.276,369 25,370 0.641,371 24.75,372 0.635,373 35.297,374 0.905,375 40.8,376 0.6,377 40.397,378 1.036,379 9.612,380 0.246,381 9.346,382 0.24,383 0.099,384 0.302,385 0.777,386 1.124,387 0.672,388 0.875,389 0.624,390 0.871,391 0.874,392 1.09,393 0.71,394 0.899,395 0.513,396 0.932,397 1.225,398 0.939,399 0.864,400 0.883,401 0.859,402 0.931,403 1.1,404 0.826,405 0.829,406 0.809,407 0.93,408 0.869,409 0.721,410 0.989,411 1.14,412 1.122,413 0.862,414 1.006,415 1.251,416 0.963,417 1.148,418 1.021,419 1.12,420 0.962,421 0.983,422 0.916,423 0.845,424 0.911,425 0.807,426 0.847,427 0.713,428 1.031,429 0.967,430 1.02,431 0.897,432 1.083,433 7.5,434 0.234,435 3.556,436 2.764,437 1.887,438 1.039,439 1.02,440 0.537,441 0.313,442 0.309,443 30723,444 81524,445 2.11,446 42.6,448 21,449 2,450 4,451 2,452 1.787,453 2,454 4.092,455 0.136,459 111.104,460 1.634,461 3.636,462 4.512,463 5.207,464 5.44,465 5.44,466 3.609,467 4.753,468 5.247,469 4.346,470 3220.73,471 9.219,472 60413.2,476 413.947,477 1.309,478 5.228,479 0.174,480 0.006,481 0.06,482 0.048,483 0.036,484 0.02,485 0.022,486 0.012,487 0.007,488 0.008,489 0.395,490 0.17,491 0.75,492 0.608,493 225.866,494 -0.038,495 -0.069,496 0.045,497 0.002,498 -0.052,499 0.021,500 0.052,501 -0.042,502 0.128,503 0.013,504 0.119,505 -0.017,506 -0.113,507 0.034,508 0.033,509 0.044,510 0.013,511 0.027,512 -0.048,513 0.139,514 0.124,515 0.154,516 0.042,517 0.116,518 0.147,519 -0.005,520 0.012,521 -0.006,522 0.106,523 0.024,524 -0.141,525 0.01,526 -0.053,527 0.032,528 -0.095,529 0.041,530 0.078,531 0.074,532 0.134,533 0.062,534 0.082,535 0.129,536 0.087,537 -0.023,538 -0.079,539 -0.068,540 -0.004,541 -0.12,542 2.18,543 6.188,544 0.718,545 68.984,546 1.004,547 1.111,548 3.036,549 9.219,550 0.706,551 3.784,552 4.094,553 4.344,554 4.585,555 4.736,556 4.762,557 4.949,558 5.043,559 5.142,560 5.283,561 10.56,562 0.664,563 559.76,564 3.784,565 5.323,566 6.163,567 7.029,568 7.883,569 8.753,570 9.615,571 10.488,572 11.356,573 12.231,574 4.4,576 1,578 2,581 12,583 18,585 1,587 1,589 2,591 68,592 22,593 3,594 43,595 72,596 30,597 18,598 6,599 12,600 4,601 5,602 5,605 2,607 3,609 23,610 7,612 4,613 2,614 1,615 1,616 4,619 29,620 7,621 2,622 9,623 2,624 3,625 1,626 4,628 1,629 2,630 3,631 2,633 1,634 5,635 2,638 39,639 1,641 7,643 2,644 1,646 2,651 5.9,653 2,654 2,655 19.5,656 12.067,657 8.556,658 4.158,659 4.001,660 1.466,661 0.994,662 9.118,663 12.582,664 4.043,665 4.58,666 5.086,667 5.605,668 6.102,669 6.259,670 6.69,671 7.032,672 7.356,673 7.734,674 1,675 57,676 14.446,677 6.171,678 7.748,679 27.654,680 22.777,681 2.248,682 87.667,683 317.82,684 254.934,685 39.146,687 72.29,688 77.412,689 177.523,690 390.109,691 39.146,693 54.535,694 123.191,695 61.25,696 49.982,698 350.039,699 45.192,700 317.82,701 216.668,702 72.29,703 77.412,704 247.193,705 142.916,706 57.659,707 147.982,708 11.027,709 77.412,710 317.82,711 111.435,712 254.934,713 317.82,714 86.551,715 129.44,717 150.379,718 317.82,719 111.435,720 254.934,721 0.579,722 0.334,723 0.178,724 0.09,725 27,726 12,727 0.139,728 10,729 5.174,730 363.76,731 28,732 194.131,733 1,734 1,735 27.563,736 12.902,737 7.152,738 111.435,739 21.487,741 3.822,742 32.897,743 684.189,744 56,745 24.579,746 5.525,747 1.814,748 0.36,749 68.254,750 75.57,751 0.268,752 0.597,753 0.741,754 0.855,755 0.894,756 0.894,757 5.281,758 1.957,759 6.133,760 6.483,761 4.779,762 5.268,763 3.876,764 6.909,765 4.677,766 6.461,767 1.805,768 7.669,769 5.68,770 4.29,771 4.956,772 3.072,773 7.73,774 4.117,775 7.748,776 1.557,777 9.302,778 5.203,779 6.34,780 7.347,781 6.572,782 10.821,783 6.138,784 9.067,785 1.346,786 10.995,787 3.926,788 6.686,789 7.817,790 6.478,791 12.52,792 6.405,793 10.416,794 1.301,795 12.727,796 3.213,797 8.177,798 9.692,799 9.502,800 15.131,801 7.869,802 11.786,803 1.109,804 14.489,805 3.01,806 8.918,807 10.53,808 9.746,809 17.231,810 8.524,811 13.173,812 1,813 16.273,814 2.418,815 10.183,816 12.173,817 12.451,818 19.696,819 9.755,820 3.233,821 1,822 18.076,823 2.323,824 11.123,825 13.211,826 12.932,827 21.98,828 10.607,829 2.844,830 11.323,831 19.895,832 2.275,833 12.299,834 14.73,835 15.408,836 24.407,837 11.736,838 2.681,839 8.531,840 21.728,841 3.904,842 13.34,843 15.884,844 16.07,845 26.771,846 12.688,847 2.577,848 8.027,849 23.574,850 3.811,851 14.487,852 17.332,853 18.371,854 29.191,855 13.774,856 2.536,857 7.472,858 25.431,859 3.673,860 15.581,861 18.557,862 19.176,863 31.59,864 14.779,865 2.377,866 7.014,867 27.297,868 3.453,869 16.722,870 19.963,871 21.339,872 34.011,873 15.849,874 2.174,875 6.975,876 29.172,877 3.022,878 17.845,879 21.231,880 22.261,881 36.425,882 16.883,883 28628,884 47040,885 29.126,886 48.029,887 64.179,888 69.339,889 64.92,890 63.841,891 63.694,892 81.094,893 19.501,894 178.573,895 60.488,896 5.449,897 6.912,898 6.574,899 5.287,900 5.233,901 6.904,902 8.641,903 18.496,904 4.982,905 17.7,906 1.493,907 1.613,908 1.51,909 1.485,910 1.481,911 1.886,912 0.454,913 4.153,914 1.407,915 4.015,916 4.035,917 4.223,918 3.95,919 7.438,920 3.938,921 3.927,922 3.949,923 3.914,924 3.849,925 7.427,926 3.847,927 3.869,928 3.924,929 3.824,930 3.804,931 4.957,932 3.8,933 3.846,934 3.88,935 3.783,936 3.692,937 4.877,938 3.688,939 3.646,940 3.654,941 3.717,942 3.62,943 4.858,944 3.56,945 3.501,946 3.559,947 3.4,948 3.354,949 4.723,950 3.338,951 3.344,952 3.39,953 3.344,954 3.111,955 4.634,956 3.129,957 3.118,958 3.147,959 3.268,960 3.057,961 4.37,962 3.015,963 0.104,964 0.114,965 0.16,966 0.097,967 0.075,968 4.481,969 0.091,970 4.912,971 0.105,972 6.859,973 0.263,974 4.152,975 0.069,976 3.233,977 3.904,978 4.506,979 11.323,980 2.982,981 1.935,982 1.919,983 2.028,984 2.031,985 1.237,986 2.029,987 1.887,988 1.865,989 1.99,990 1.999,991 1.211,992 1.997,993 1.861,994 1.84,995 1.964,996 1.939,997 1.118,998 1.949,999 1.657,1000 1.588,1001 1.893,1002 1.87,1003 1.071,1004 1.881,1005 1.577,1006 1.507,1007 1.86,1008 1.751,1009 1.056,1010 1.793,1011 1.432,1012 1.43,1013 1.612,1014 1.607,1015 0.907,1016 1.598,1017 1.325,1018 1.276,1019 1.483,1020 1.549,1021 0.626,1022 1.542,1023 1.218,1024 1.201,1025 1.393,1026 1.518,1027 0.434,1028 1.489,1029 4.466,1030 5.778,1031 3.045,1032 7.266,1033 5.352,1034 8.834,1035 7.391,1036 10.447,1039 5.338,1041 7.724,1043 11.719,1044 1.274,1046 4.024,1049 45.146,1050 111.104,1051 247.255,1052 306.789,1053 354.073,1054 369.947,1055 369.947,1056 75.484,1057 8.581,1058 86.79,1059 147.12,1060 28,1061 12.772,1062 4.524,1063 3.807,1064 62.02,1065 244,1066 250,1067 0.119,1068 282.147,1069 503.92,1070 680.199,1071 84368,1073 27.192,1074 0.697,1075 0.59,1076 28.045,1077 23.01,1078 18.958,1079 0.441,1080 0.328,1081 12.826,1082 17.709,1083 12.483,1084 10.298,1085 19.654,1086 14.096,1087 17.02,1088 0.288,1089 0.186,1090 18.195,1091 11.001,1092 14.103,1093 0.186,1094 0.103,1095 15.215,1096 7.809,1097 11.668,1098 0.12,1099 0.06,1100 13.056,1101 5.798,1102 8.911,1103 0.079,1104 0.032,1105 10.099,1106 3.601,1107 0.197,1108 124.995,1109 0.185,1110 36.545,1111 0.3,1112 204,1113 601.265,1114 267.495,1115 620.876,1116 841.07,1117 580,1118 237,1119 587.297,1120 287.525,1121 615.537,1122 903.55,1123 580,1124 5.155}
{0 CHEMBL2070430,1 1.643,2 17.919,3 7.731,4 59.765,5 158.776,6 8.382,7 0.45,8 4.268,9 4.366,10 3.971,11 3.897,12 5.349,13 3.838,14 4.793,15 4.947,16 4.399,17 4.267,18 5.849,19 4.182,20 5.03,21 5.221,22 4.401,23 4.376,24 6.057,25 4.273,26 5.035,27 5.231,28 4.338,29 4.394,30 6.064,31 4.25,32 5.079,33 5.306,34 4.308,35 4.409,36 6.052,37 4.232,38 5.018,39 5.247,40 4.172,41 4.277,42 5.997,43 4.119,44 4.824,45 5.037,46 4.166,47 4.108,48 5.867,49 3.997,50 4.649,51 4.815,52 4.085,53 4.126,54 5.717,55 3.992,56 0.002,57 0.851,58 11.935,59 6.266,60 6.914,61 7.696,62 0.218,63 1.468,64 28.7,65 11.015,66 24.218,67 12.935,68 0.401,69 1.755,70 39.566,71 14.439,72 42.371,73 16.825,74 0.413,75 1.757,76 39.096,77 15.26,78 55.079,79 18.134,80 0.363,81 1.891,82 47.637,83 18.154,84 55.299,85 21.658,86 0.363,87 1.75,88 44.153,89 16.21,90 57.388,91 18.852,92 0.505,93 1.429,94 35.277,95 12.252,96 53.759,97 14.174,98 0.273,99 1.212,100 26.218,101 10.42,102 32.171,103 12.753,104 35,105 54,106 0.259,107 0.555,108 0.701,109 0.788,110 0.816,111 0.816,112 3.641,113 1.038,114 -5.46,115 -5.34,116 -4.99,117 43.9,118 2,119 1,122 4,123 1,124 1,125 12,126 1,127 5,130 1,131 1,135 9,136 1,137 13,141 13,144 11,146 11,148 1,149 5,153 13,155 1,156 8,160 16,163 8,169 10,171 1,172 5,174 12,176 2,177 1,181 16,183 1,184 2,186 12,188 3130,189 25.187,190 25.187,191 25.187,192 25.187,193 25.187,194 22.583,195 30.903,196 14.919,197 26.121,198 19.599,199 19.599,200 19.599,201 19.599,202 19.599,203 15.62,204 36.096,205 6.964,206 21.144,207 4.402,208 2.525,209 1.599,210 1.046,211 0.871,212 0.871,213 4.336,214 1,218 1407,219 4,220 123.406,221 434.917,222 3.322,223 30.486,226 0.5,227 0.67,228 0.67,229 0.7,230 0.67,231 0.5,232 0.6,233 78.333,234 663,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.902,241 4.506,242 11.323,243 2.982,244 4.124,245 3.688,246 5.806,247 3.701,248 2.75,249 3.721,250 1.192,251 8.053,252 2.631,253 4.018,254 3.361,255 5.615,256 3.574,257 2.623,258 3.599,259 0.86,260 7.731,261 2.473,262 3.917,263 3.098,264 5.381,265 3.471,266 2.519,267 3.44,268 0.86,269 7.05,270 2.388,271 3.654,272 2.896,273 5.284,274 3.363,275 2.442,276 2.969,277 0.8,278 6.674,279 2.245,280 3.457,281 2.868,282 5.268,283 3.224,284 2.302,285 2.729,286 0.553,287 6.634,288 2.113,289 3.435,290 2.775,291 5.067,292 3.041,293 2.115,294 2.535,296 6.134,297 1.944,298 3.288,299 2.485,300 4.927,301 2.808,302 1.893,303 2.444,305 5.402,306 1.655,307 3.23,308 2.459,309 4.783,310 2.665,311 1.795,312 2.392,313 5.188,314 1.517,315 2.786,316 2.112,317 4.445,318 2.411,319 1.473,320 1.749,321 3.923,322 1.366,323 2.5,324 1.72,325 3.6,326 2.225,327 1.286,328 1.5,329 2.98,330 1.171,331 2.5,332 1.684,333 3.414,334 2,335 1,336 1.5,337 2.275,338 1,339 2.5,340 1.161,341 3.414,342 2,343 1,344 1.5,345 2.275,346 1,347 2.484,348 1,349 3.414,350 2,351 1,352 1.476,353 2.275,354 1,355 1.757,356 1,357 3.19,358 1.591,359 0.618,360 0.632,361 1.235,362 0.6,363 18.681,364 0.505,365 0.797,366 0.022,367 46.5,368 1.257,369 23.5,370 0.635,371 23,372 0.622,373 35.021,374 0.947,375 38.919,376 0.59,377 36.16,378 0.977,379 8.963,380 0.242,381 8.998,382 0.243,383 0.154,384 0.284,385 0.746,386 1.194,387 0.624,388 0.888,389 0.605,390 0.901,391 0.973,392 1.094,393 0.651,394 0.835,395 0.611,396 0.87,397 1.364,398 0.855,399 0.865,400 0.806,401 0.932,402 0.836,403 1.119,404 0.899,405 0.876,406 0.887,407 0.959,408 0.977,409 0.553,410 0.968,411 0.887,412 1.047,413 0.861,414 0.945,415 1.088,416 0.945,417 0.898,418 0.94,419 1.229,420 0.885,421 1.154,422 0.835,423 0.771,424 0.807,425 0.993,426 0.768,427 0.658,428 0.998,429 1.028,430 1.014,431 0.723,432 1.054,433 7.5,434 0.246,435 3.556,436 2.542,437 1.842,438 0.889,439 0.965,440 0.563,441 0.292,442 0.324,443 25015,444 69067,445 2.054,446 43.9,448 21,450 6,451 2,452 1.775,453 1.93,454 4.065,455 -0.778,459 108.412,460 1.643,461 3.52,462 4.445,463 4.999,464 5.173,465 5.173,466 3.618,467 4.723,468 5.169,469 4.298,470 2862.14,471 9.067,472 51428.9,476 398.93,477 1.374,478 5.143,479 0.188,480 0.007,481 0.066,482 0.046,483 0.038,484 0.019,485 0.022,486 0.014,487 0.007,488 0.009,489 0.415,490 0.17,491 0.63,492 1.463,493 210.837,494 -0.001,495 -0.154,496 0.04,497 -0.038,498 -0.044,499 -0.013,500 0.025,501 -0.033,502 0.148,503 0.058,504 0.08,505 0.036,506 -0.136,507 0.152,508 0.035,509 0.112,510 0.023,511 0.101,512 -0.071,513 0.079,514 0.005,515 0.06,516 0.047,517 -0.013,518 0.162,519 0.013,520 0.089,521 0.026,522 0.126,523 0.091,524 -0.061,525 0.038,526 0.046,527 0.084,528 -0.034,529 0.118,530 0.064,531 0.167,532 0.15,533 0.154,534 0.083,535 0.195,536 0.135,537 0.006,538 -0.072,539 -0.053,540 0.068,541 -0.088,542 1.801,543 6.151,544 0.622,545 64.437,546 1,547 1.109,548 4.231,549 17.905,550 0.715,551 3.714,552 4.007,553 4.248,554 4.466,555 4.654,556 4.663,557 4.852,558 4.977,559 5.043,560 5.187,561 10.167,562 0.663,563 553.19,564 3.714,565 5.242,566 6.075,567 6.934,568 7.784,569 8.65,570 9.51,571 10.381,572 11.249,573 12.124,574 3,576 1,578 1,581 12,583 18,587 1,589 2,590 1,591 66,592 21,593 3,594 40,595 69,596 29,597 18,598 6,599 12,600 3,601 4,602 4,603 1,604 2,607 1,609 22,610 7,612 3,613 1,614 1,615 1,616 3,619 29,620 5,622 8,623 3,624 2,625 1,626 3,629 1,630 3,631 2,633 1,634 4,635 2,636 2,637 1,638 37,641 5,643 2,644 1,646 2,650 1,651 4.5,653 1,654 2,655 19.167,656 12.46,657 8.361,658 4.257,659 3.797,660 1.462,661 0.97,662 10.058,663 12.023,664 3.97,665 4.505,666 5.009,667 5.522,668 6.041,669 6.167,670 6.585,671 6.988,672 7.28,673 7.651,674 1,675 55,676 13.671,677 5.668,678 7.665,679 26.276,680 21.033,681 2.165,682 80.111,683 341.362,684 263.126,685 6.249,686 39.149,687 47.145,688 77.412,689 185.714,690 427.655,691 6.249,692 17.65,693 16.568,694 123.191,695 31.4,696 50.297,698 373.581,699 84.341,700 341.362,701 191.963,702 47.145,703 116.56,704 247.193,705 141.314,706 37.343,707 143.593,708 50.176,709 77.412,710 341.362,711 53.393,712 302.274,713 341.362,714 77.092,715 147.09,717 131.485,718 341.362,719 53.393,720 302.274,721 0.572,722 0.335,723 0.171,724 0.089,725 23,726 11,727 0.159,728 11,729 4.929,730 331.158,731 23,732 176.75,733 1,734 1,735 27.678,736 13.446,737 7.588,738 53.393,739 22.236,741 4.456,743 697.03,744 52,745 13.151,746 5.523,747 1.846,748 0.948,749 66.032,750 73.222,751 0.272,752 0.582,753 0.735,754 0.827,755 0.856,756 0.856,757 5.196,758 1.893,759 6.043,760 6.134,761 4.691,762 5.193,763 3.836,764 6.81,765 4.551,766 6.376,767 1.795,768 7.576,769 5.402,770 4.205,771 4.868,772 3.072,773 7.636,774 3.937,775 7.662,776 1.473,777 9.206,778 5.188,779 6.248,780 7.279,781 6.57,782 10.711,783 5.977,784 8.978,785 1.286,786 10.893,787 3.923,788 6.581,789 7.716,790 6.478,791 12.415,792 6.184,793 10.325,794 1,795 12.62,796 2.98,797 8.072,798 9.615,799 9.502,800 15.031,801 7.669,802 11.691,803 1,804 14.376,805 2.275,806 8.803,807 10.416,808 9.746,809 17.146,810 8.276,811 13.074,812 1,813 16.157,814 2.275,815 10.071,816 12.08,817 12.451,818 19.623,819 9.523,820 3.233,821 0.618,822 17.959,823 2.275,824 11.008,825 13.084,826 12.932,827 21.922,828 10.343,829 2.75,830 11.323,831 19.779,832 1.235,833 12.189,834 14.618,835 15.408,836 24.36,837 11.481,838 2.623,839 8.053,840 21.615,841 3.902,842 13.233,843 15.745,844 16.07,845 26.735,846 12.417,847 2.519,848 7.731,849 23.465,850 3.721,851 14.385,852 17.202,853 18.371,854 29.163,855 13.51,856 2.442,857 7.05,858 25.327,859 3.599,860 15.485,861 18.405,862 19.176,863 31.568,864 14.509,865 2.302,866 6.674,867 27.2,868 3.44,869 16.633,870 19.815,871 21.339,872 33.994,873 15.585,874 2.115,875 6.634,876 29.082,877 2.969,878 17.762,879 21.066,880 22.261,881 36.412,882 16.62,883 24074,884 40481,885 26.641,886 47.188,887 58.82,888 63.619,889 60.789,890 58.564,891 58.235,892 74.571,893 17.542,894 162.229,895 54.089,896 5.404,897 6.912,898 6.558,899 5.287,900 5.233,901 6.902,902 8.641,903 18.496,904 4.982,905 19.527,906 1.47,907 1.59,908 1.52,909 1.464,910 1.456,911 1.864,912 0.439,913 4.056,914 1.352,915 4.007,916 4.024,917 4.223,918 3.947,919 7.428,920 3.933,921 3.917,922 3.936,923 3.998,924 3.841,925 5.006,926 3.838,927 3.842,928 3.867,929 3.834,930 3.795,931 4.876,932 3.785,933 3.761,934 3.833,935 3.807,936 3.625,937 4.805,938 3.582,939 3.636,940 3.642,941 3.613,942 3.564,943 4.716,944 3.545,945 3.446,946 3.515,947 3.418,948 3.274,949 4.452,950 3.259,951 3.306,952 3.407,953 3.309,954 3.123,955 4.355,956 3.089,957 3.128,958 3.147,959 3.275,960 3.092,961 4.247,962 3.031,963 0.112,964 0.123,965 0.171,966 0.104,967 0.081,968 4.481,969 0.098,970 4.912,971 0.113,972 6.859,973 0.283,974 4.152,975 0.075,976 3.233,977 3.902,978 4.506,979 11.323,980 2.982,981 1.928,982 1.912,983 2.02,984 2.019,985 1.263,986 2.02,987 1.886,988 1.864,989 1.997,990 1.999,991 1.115,992 2.001,993 1.839,994 1.819,995 1.958,996 1.938,997 1.078,998 1.95,999 1.724,1000 1.65,1001 1.932,1002 1.905,1003 1.028,1004 1.923,1005 1.471,1006 1.432,1007 1.771,1008 1.69,1009 1.012,1010 1.716,1011 1.425,1012 1.392,1013 1.725,1014 1.584,1015 0.869,1016 1.638,1017 1.351,1018 1.256,1019 1.481,1020 1.563,1021 0.626,1022 1.544,1023 1.226,1024 1.236,1025 1.286,1026 1.31,1027 0.481,1028 1.337,1029 4.394,1030 5.694,1031 2.398,1032 7.179,1033 4.844,1034 8.744,1035 7.002,1036 10.353,1037 4.335,1038 5.924,1041 4.743,1043 11.713,1044 1.297,1046 3.937,1049 43.764,1050 108.412,1051 232.295,1052 293.381,1053 329.91,1054 341.42,1055 341.42,1056 71.924,1057 8.226,1058 43.7,1059 104.03,1060 23,1061 12.666,1062 4.459,1063 3.7,1064 65.402,1065 222,1066 229,1067 0.139,1068 280.418,1069 497.04,1070 675.98,1071 51936,1072 1.5,1073 26.2,1074 0.708,1075 0.628,1076 27.554,1077 23.244,1078 17.961,1079 0.449,1080 0.346,1081 12.24,1082 16.498,1083 11.779,1084 9.781,1085 18.947,1086 13.834,1087 15.641,1088 0.29,1089 0.194,1090 17.224,1091 10.477,1092 13.152,1093 0.191,1094 0.108,1095 14.552,1096 7.452,1097 10.479,1098 0.122,1099 0.061,1100 12.033,1101 5.247,1102 8.262,1103 0.079,1104 0.032,1105 9.685,1106 3.359,1107 0.23,1108 121.325,1109 0.194,1110 34.98,1111 0.352,1112 188,1113 548.421,1114 263.773,1115 600.831,1116 808.59,1117 562,1118 217,1119 543.679,1120 274.457,1121 580.984,1122 852.67,1123 548,1124 4.886}
{0 CHEMBL2070432,1 1.622,2 18.205,3 6.069,4 36.828,5 162.551,6 8.025,7 0.429,8 4.328,9 4.433,10 3.985,11 3.923,12 5.45,13 3.875,14 4.844,15 5,16 4.403,17 4.292,18 5.961,19 4.218,20 5.083,21 5.272,22 4.415,23 4.408,24 6.158,25 4.322,26 5.115,27 5.31,28 4.396,29 4.443,30 6.202,31 4.319,32 5.169,33 5.395,34 4.355,35 4.462,36 6.211,37 4.296,38 5.086,39 5.315,40 4.203,41 4.321,42 6.09,43 4.175,44 4.888,45 5.097,46 4.188,47 4.159,48 5.979,49 4.065,50 4.761,51 4.933,52 4.095,53 4.176,54 5.892,55 4.06,56 0.029,57 0.953,58 13.536,59 6.67,60 11.017,61 8.088,62 0.285,63 1.578,64 30.407,65 11.486,66 35.802,67 13.673,68 0.43,69 1.88,70 38.852,71 14.681,72 51.427,73 17.362,74 0.445,75 1.934,76 40.1,77 15.896,78 67.372,79 19.056,80 0.513,81 2.05,82 50.334,83 19.002,84 77.821,85 22.894,86 0.46,87 1.853,88 46.257,89 16.602,90 69.824,91 19.551,92 0.52,93 1.534,94 35.915,95 12.486,96 59.138,97 14.857,98 0.31,99 1.409,100 26.624,101 11.129,102 44.492,103 13.646,104 51,105 57,106 0.252,107 0.566,108 0.717,109 0.816,110 0.839,111 0.839,112 3.692,113 1.001,114 -4.27,115 -4.2,116 -3.97,117 42.9,118 2,119 1,122 4,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 11,136 1,137 14,138 1,139 1,140 1,141 13,142 1,144 13,145 2,146 9,147 2,148 1,149 7,152 1,153 13,154 1,155 2,156 8,157 1,158 1,159 1,160 16,161 1,163 8,169 12,171 1,172 7,173 2,174 12,175 2,176 2,177 3,180 2,181 15,182 2,183 1,184 3,185 1,186 12,187 1,188 3600,189 26.394,190 26.394,191 26.394,192 26.394,193 26.394,194 23.699,195 32.126,196 15.595,197 27.171,198 20.584,199 20.584,200 20.584,201 20.584,202 20.584,203 16.389,204 37.806,205 7.25,206 21.816,207 4.508,208 2.495,209 1.52,210 0.884,211 0.736,212 0.736,213 4.385,217 1,218 1499,219 4.359,220 130.523,221 458.717,222 3.452,223 38.29,226 0.75,227 0.67,228 0.67,229 0.9,230 0.5,231 0.5,232 0.64,233 83.5,234 710,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.904,241 4.506,242 11.323,243 2.982,244 4.214,245 3.688,246 5.983,247 3.829,248 2.844,249 3.811,250 1.192,251 8.531,252 2.81,253 4.08,254 3.506,255 5.805,256 3.66,257 2.681,258 3.673,259 0.98,260 8.027,261 2.619,262 3.951,263 3.361,264 5.555,265 3.525,266 2.574,267 3.453,268 0.86,269 7.472,270 2.443,271 3.708,272 3.06,273 5.367,274 3.366,275 2.445,276 3.022,277 0.86,278 6.994,279 2.251,280 3.544,281 2.896,282 5.27,283 3.321,284 2.375,285 2.847,286 0.8,287 6.643,288 2.232,289 3.444,290 2.775,291 5.231,292 3.127,293 2.173,294 2.602,295 0.553,296 6.482,297 2.056,298 3.334,299 2.534,300 4.944,301 2.925,302 1.957,303 2.444,305 5.68,306 1.89,307 3.255,308 2.466,309 4.898,310 2.669,311 1.804,312 2.399,313 5.203,314 1.519,315 2.829,316 2.212,317 4.446,318 2.412,319 1.474,320 1.908,321 3.924,322 1.366,323 2.767,324 1.789,325 3.764,326 2.329,327 1.336,328 1.743,329 3.012,330 1.317,331 2.53,332 1.718,333 3.599,334 2.219,335 1.277,336 1.5,337 2.978,338 1.168,339 2.5,340 1.678,341 3.436,342 2.016,343 1,344 1.5,345 2.323,346 1.01,347 2.5,348 1.184,349 3.414,350 2,351 1,352 1.476,353 2.275,354 1,355 2.484,356 1.161,357 3.414,358 2,359 1,360 1.475,361 2.275,362 1,363 19.2,364 0.492,365 0.886,366 0.023,367 49.25,368 1.263,369 25,370 0.641,371 24.25,372 0.622,373 36.409,374 0.934,375 41.4,376 0.591,377 40.862,378 1.048,379 9.656,380 0.248,381 9.216,382 0.236,383 0.151,384 0.302,385 0.785,386 1.165,387 0.695,388 0.912,389 0.655,390 0.911,391 0.886,392 1.071,393 0.69,394 0.874,395 0.528,396 0.892,397 1.302,398 0.887,399 0.846,400 0.826,401 0.898,402 0.854,403 1.099,404 0.934,405 0.89,406 0.909,407 0.939,408 0.991,409 0.642,410 0.939,411 1.04,412 1.048,413 0.78,414 0.959,415 1.156,416 0.902,417 1.056,418 0.949,419 1.033,420 0.893,421 1.081,422 0.881,423 0.84,424 0.872,425 0.821,426 0.816,427 0.716,428 1.051,429 0.971,430 1.034,431 0.896,432 1.094,433 8,434 0.254,435 3.778,436 2.917,437 1.922,438 1.07,439 1.047,440 0.578,441 0.35,442 0.34,443 28573,444 77716,445 2.037,446 44.3,448 21,449 2,450 6,451 2,452 1.787,453 1.902,454 4.093,455 0.136,459 113.508,460 1.622,461 3.634,462 4.609,463 5.245,464 5.393,465 5.393,466 3.609,467 4.753,468 5.247,469 4.346,470 3220.39,471 9.221,472 60470.3,476 429.05,477 1.42,478 5.213,479 0.19,480 0.007,481 0.066,482 0.049,483 0.036,484 0.021,485 0.023,486 0.013,487 0.008,488 0.009,489 0.422,490 0.17,491 0.75,492 1.513,493 225.886,494 -0.034,495 -0.086,496 0.044,497 -0.009,498 -0.074,499 0.009,500 0.07,501 -0.012,502 0.176,503 0.055,504 0.124,505 0.041,506 -0.13,507 0.111,508 0.058,509 0.102,510 0.004,511 0.092,512 -0.066,513 0.044,514 0.033,515 0.049,516 0.016,517 -0.019,518 0.166,519 0.024,520 0.076,521 0.04,522 0.117,523 0.082,524 -0.096,525 0.055,526 0.025,527 0.09,528 -0.052,529 0.118,530 0.055,531 0.104,532 0.142,533 0.097,534 0.077,535 0.156,536 0.088,537 -0.03,538 -0.081,539 -0.073,540 0.001,541 -0.125,542 2.182,543 6.183,544 0.59,545 69.286,546 1.002,547 1.114,548 3.036,549 9.219,550 0.697,551 3.761,552 4.06,553 4.304,554 4.522,555 4.7,556 4.727,557 4.92,558 5.017,559 5.106,560 5.242,561 10.562,562 0.652,563 561.78,564 3.761,565 5.293,566 6.129,567 6.991,568 7.843,569 8.711,570 9.573,571 10.445,572 11.314,573 12.191,574 4.3,576 1,578 2,581 12,583 18,585 1,587 1,589 2,591 70,592 22,593 3,594 42,595 73,596 30,597 18,598 6,599 12,600 4,601 4,602 4,604 2,607 1,609 23,610 7,612 4,613 2,614 1,615 1,616 4,619 31,620 7,621 2,622 9,623 2,624 3,625 1,626 4,629 1,630 3,631 2,633 1,634 4,635 2,636 2,638 39,639 1,641 5,643 2,644 1,646 2,651 5.7,653 2,654 2,655 20.5,656 13.067,657 8.806,658 4.408,659 3.978,660 1.474,661 0.969,662 10.315,663 12.365,664 4.025,665 4.559,666 5.067,667 5.583,668 6.093,669 6.252,670 6.685,671 7.029,672 7.35,673 7.727,674 1,675 59,676 14.421,677 6.023,678 7.774,679 27.435,680 21.931,681 2.274,682 88.667,683 341.362,684 267.515,685 39.146,687 72.29,688 77.412,689 190.104,690 413.652,691 39.146,692 17.65,693 49.466,694 123.191,695 61.25,696 49.982,698 373.581,699 45.192,700 341.362,701 229.25,702 72.29,703 77.412,704 247.193,705 166.458,706 70.24,707 147.982,708 11.027,709 77.412,710 341.362,711 111.435,712 267.515,713 341.362,714 81.482,715 147.09,717 150.379,718 341.362,719 111.435,720 267.515,721 0.574,722 0.337,723 0.173,724 0.088,725 24,726 12,727 0.164,728 12,729 5.045,730 356.311,731 23,732 194.131,733 1,734 1,735 28.994,736 13.875,737 7.779,738 111.435,739 21.421,741 3.787,742 32.897,743 720.313,744 55,745 24.573,746 5.52,747 1.81,748 0.341,749 70.138,750 77.985,751 0.265,752 0.593,753 0.752,754 0.856,755 0.88,756 0.88,757 5.255,758 1.957,759 6.103,760 6.482,761 4.745,762 5.247,763 3.876,764 6.88,765 4.639,766 6.441,767 1.804,768 7.644,769 5.68,770 4.29,771 4.956,772 3.072,773 7.73,774 4.117,775 7.73,776 1.474,777 9.283,778 5.203,779 6.312,780 7.337,781 6.572,782 10.803,783 6.104,784 9.052,785 1.336,786 10.98,787 3.924,788 6.673,789 7.813,790 6.478,791 12.511,792 6.391,793 10.403,794 1.277,795 12.715,796 3.012,797 8.152,798 9.687,799 9.502,800 15.12,801 7.84,802 11.774,803 1,804 14.479,805 2.978,806 8.901,807 10.527,808 9.746,809 17.224,810 8.507,811 13.162,812 1,813 16.264,814 2.323,815 10.161,816 12.17,817 12.451,818 19.69,819 9.731,820 3.233,821 1,822 18.068,823 2.275,824 11.106,825 13.209,826 12.932,827 21.976,828 10.589,829 2.844,830 11.323,831 19.888,832 2.275,833 12.28,834 14.729,835 15.408,836 24.404,837 11.716,838 2.681,839 8.531,840 21.722,841 3.904,842 13.325,843 15.883,844 16.07,845 26.769,846 12.673,847 2.574,848 8.027,849 23.568,850 3.811,851 14.472,852 17.331,853 18.371,854 29.189,855 13.759,856 2.445,857 7.472,858 25.426,859 3.673,860 15.569,861 18.557,862 19.176,863 31.589,864 14.767,865 2.375,866 6.994,867 27.293,868 3.453,869 16.711,870 19.962,871 21.339,872 34.01,873 15.838,874 2.173,875 6.643,876 29.168,877 3.022,878 17.836,879 21.231,880 22.261,881 36.424,882 16.874,883 27644,884 46056,885 27.739,886 48.79,887 62.196,888 67.406,889 64.226,890 61.624,891 61.486,892 78.899,893 19.501,894 172.153,895 58.275,896 5.404,897 6.912,898 6.558,899 5.287,900 5.233,901 6.904,902 8.641,903 18.496,904 4.982,905 22.2,906 1.481,907 1.605,908 1.529,909 1.467,910 1.464,911 1.879,912 0.464,913 4.099,914 1.388,915 4.013,916 4.031,917 4.223,918 3.949,919 7.438,920 3.937,921 3.927,922 3.946,923 3.914,924 3.848,925 7.427,926 3.847,927 3.861,928 3.886,929 3.822,930 3.804,931 4.957,932 3.8,933 3.761,934 3.835,935 3.781,936 3.626,937 4.877,938 3.582,939 3.638,940 3.644,941 3.613,942 3.564,943 4.858,944 3.546,945 3.447,946 3.515,947 3.4,948 3.274,949 4.723,950 3.259,951 3.344,952 3.407,953 3.279,954 3.123,955 4.634,956 3.129,957 3.306,958 3.39,959 3.266,960 3.111,961 4.356,962 3.089,963 0.107,964 0.117,965 0.163,966 0.099,967 0.077,968 4.481,969 0.093,970 4.912,971 0.107,972 6.859,973 0.27,974 4.152,975 0.071,976 3.233,977 3.904,978 4.506,979 11.323,980 2.982,981 1.935,982 1.919,983 2.028,984 2.031,985 1.263,986 2.029,987 1.888,988 1.865,989 1.998,990 2.003,991 1.118,992 2.002,993 1.861,994 1.84,995 1.966,996 1.944,997 1.079,998 1.954,999 1.724,1000 1.65,1001 1.956,1002 1.932,1003 1.056,1004 1.944,1005 1.471,1006 1.434,1007 1.771,1008 1.69,1009 1.012,1010 1.716,1011 1.426,1012 1.392,1013 1.725,1014 1.584,1015 0.869,1016 1.638,1017 1.351,1018 1.256,1019 1.483,1020 1.573,1021 0.626,1022 1.55,1023 1.228,1024 1.236,1025 1.393,1026 1.524,1027 0.481,1028 1.49,1029 4.443,1030 5.746,1031 2.398,1032 7.235,1033 4.844,1034 8.805,1035 7.002,1036 10.418,1037 4.321,1039 5.337,1041 4.686,1043 11.696,1044 1.269,1046 3.906,1049 45.673,1050 113.508,1051 254.415,1052 322.646,1053 367.176,1054 377.54,1055 377.54,1056 85.993,1057 8.387,1058 86.79,1059 147.12,1060 23,1061 12.731,1062 4.524,1063 3.807,1064 71.004,1065 244,1066 254,1067 0.138,1068 289.541,1069 516.28,1070 698.239,1071 63952,1073 27.777,1074 0.712,1075 0.605,1076 28.631,1077 23.595,1078 18.872,1079 0.449,1080 0.334,1081 12.74,1082 17.607,1083 12.309,1084 10.238,1085 19.569,1086 14.01,1087 16.552,1088 0.29,1089 0.184,1090 17.727,1091 10.479,1092 13.783,1093 0.189,1094 0.103,1095 14.895,1096 7.505,1097 11.066,1098 0.122,1099 0.059,1100 12.454,1101 5.331,1102 8.587,1103 0.079,1104 0.031,1105 9.775,1106 3.35,1107 0.228,1108 124.48,1109 0.19,1110 36.455,1111 0.347,1112 198,1113 595.265,1114 261.495,1115 615.018,1116 831.37,1117 574,1118 229,1119 579.297,1120 279.192,1121 607.226,1122 889.95,1123 572,1124 5}
{0 CHEMBL2070433,1 1.622,2 18.795,3 6.069,4 36.828,5 162.551,6 8.025,7 0.429,8 4.328,9 4.433,10 3.985,11 3.923,12 5.45,13 3.875,14 4.844,15 5,16 4.403,17 4.292,18 5.961,19 4.218,20 5.083,21 5.272,22 4.415,23 4.408,24 6.16,25 4.322,26 5.115,27 5.31,28 4.382,29 4.443,30 6.205,31 4.314,32 5.163,33 5.396,34 4.318,35 4.455,36 6.15,37 4.282,38 5.072,39 5.304,40 4.196,41 4.299,42 6.096,43 4.148,44 4.86,45 5.07,46 4.147,47 4.124,48 5.911,49 4.027,50 4.703,51 4.868,52 4.1,53 4.161,54 5.819,55 4.051,56 0.029,57 0.953,58 13.536,59 6.67,60 11.017,61 8.088,62 0.285,63 1.578,64 30.407,65 11.486,66 35.741,67 13.673,68 0.43,69 1.88,70 38.852,71 14.681,72 51.591,73 17.362,74 0.46,75 1.934,76 40.12,77 15.895,78 69.878,79 19.042,80 0.37,81 2.047,82 50.305,83 19.03,84 67.541,85 22.977,86 0.556,87 1.82,88 45.955,89 16.535,90 76.519,91 19.707,92 0.558,93 1.478,94 35.53,95 12.161,96 57.345,97 14.306,98 0.251,99 1.339,100 24.795,101 10.735,102 32.321,103 13.231,104 51,105 57,106 0.252,107 0.566,108 0.701,109 0.778,110 0.808,111 0.821,112 3.692,113 1.001,114 -4.27,115 -4.2,116 -3.97,117 42.9,118 2,119 1,122 4,123 1,124 1,125 12,126 2,127 4,130 2,131 1,132 1,133 1,134 1,135 11,136 1,137 14,138 1,139 1,140 1,141 13,142 1,144 13,145 2,146 9,147 2,148 1,149 8,152 2,153 13,154 2,155 1,156 7,160 16,162 1,163 8,164 1,165 1,169 12,171 1,172 5,174 12,176 2,177 3,180 2,181 15,182 2,183 1,184 4,185 2,186 12,187 2,188 3663,189 26.394,190 26.394,191 26.394,192 26.394,193 26.394,194 23.699,195 32.126,196 15.554,197 27.171,198 20.567,199 20.567,200 20.567,201 20.567,202 20.567,203 16.383,204 37.806,205 7.223,206 21.802,207 4.508,208 2.495,209 1.622,210 1.129,211 0.936,212 0.85,213 4.385,217 1,218 1547,219 4.359,220 132.39,221 463.455,222 3.482,223 37.813,226 0.75,227 0.67,228 0.67,229 0.9,230 0.5,231 0.5,232 0.64,233 83.5,234 733,235 4.481,236 4.912,237 6.859,238 4.152,239 3.233,240 3.903,241 4.506,242 11.323,243 2.982,244 4.185,245 3.688,246 5.932,247 3.798,248 2.811,249 3.78,250 1.192,251 8.268,252 2.788,253 4.082,254 3.501,255 5.806,256 3.666,257 2.687,258 3.672,259 0.98,260 8.033,261 2.622,262 3.956,263 3.361,264 5.582,265 3.532,266 2.582,267 3.456,268 0.86,269 7.596,270 2.447,271 3.742,272 3.063,273 5.371,274 3.372,275 2.448,276 3.082,277 0.86,278 7.018,279 2.276,280 3.569,281 2.896,282 5.271,283 3.347,284 2.402,285 2.882,286 0.8,287 6.644,288 2.243,289 3.444,290 2.775,291 5.244,292 3.143,293 2.192,294 2.606,295 0.553,296 6.537,297 2.069,298 3.338,299 2.531,300 4.952,301 2.934,302 1.969,303 2.444,305 5.759,306 1.896,307 3.256,308 2.465,309 4.907,310 2.668,311 1.805,312 2.399,313 5.205,314 1.519,315 2.802,316 2.211,317 4.446,318 2.412,319 1.474,320 1.784,321 3.925,322 1.366,323 2.744,324 1.859,325 3.779,326 2.269,327 1.294,328 1.725,329 2.981,330 1.252,331 2.5,332 1.719,333 3.599,334 2.214,335 1.235,336 1.5,337 2.933,338 1.166,339 2.5,340 1.681,341 3.414,342 2,343 1,344 1.5,345 2.275,346 1,347 2.5,348 1.161,349 3.414,350 2,351 1,352 1.5,353 2.275,354 1,355 2.484,356 1,357 3.414,358 2,359 1,360 1.475,361 2.275,362 1,363 19.2,364 0.492,365 0.886,366 0.023,367 49.25,368 1.263,369 25,370 0.641,371 24.25,372 0.622,373 36.259,374 0.93,375 41.4,376 0.591,377 40.641,378 1.042,379 9.656,380 0.248,381 9.216,382 0.236,383 0.151,384 0.302,385 0.785,386 1.165,387 0.695,388 0.912,389 0.655,390 0.911,391 0.886,392 1.071,393 0.69,394 0.874,395 0.528,396 0.892,397 1.302,398 0.887,399 0.846,400 0.826,401 0.892,402 0.854,403 1.114,404 0.933,405 0.91,406 0.911,407 0.941,408 1.006,409 0.682,410 0.949,411 1.05,412 1.057,413 0.857,414 0.966,415 0.963,416 0.892,417 1.023,418 0.958,419 0.857,420 0.893,421 1.182,422 0.814,423 0.863,424 0.832,425 0.807,426 0.783,427 0.551,428 1.057,429 0.921,430 1.04,431 0.604,432 1.064,433 8,434 0.287,435 4,436 2.792,437 1.922,438 1.07,439 0.965,440 0.625,441 0.342,442 0.344,443 28969,444 79228,445 2.037,446 44.3,448 21,449 2,450 6,451 2,452 1.787,453 1.902,454 4.132,455 0.136,459 113.508,460 1.622,461 3.634,462 4.507,463 5,464 5.193,465 5.279,466 3.65,467 4.702,468 5.246,469 4.378,470 3244.03,471 9.217,472 61274.5,476 429.05,477 1.42,478 5.213,479 0.19,480 0.008,481 0.07,482 0.047,483 0.036,484 0.021,485 0.021,486 0.015,487 0.008,488 0.009,489 0.426,490 0.17,491 0.75,492 1.513,493 226.38,494 -0.034,495 -0.086,496 0.044,497 -0.009,498 -0.074,499 0.009,500 0.07,501 -0.012,502 0.176,503 0.055,504 0.123,505 0.041,506 -0.13,507 0.111,508 0.058,509 0.102,510 0.01,511 0.092,512 -0.081,513 0.044,514 0.013,515 0.046,516 0.015,517 -0.035,518 0.061,519 0.013,520 0.066,521 0.034,522 0.028,523 0.082,524 0.069,525 0.06,526 0.065,527 0.087,528 0.058,529 0.126,530 0.023,531 0.166,532 0.137,533 0.145,534 0.031,535 0.188,536 0.152,537 -0.036,538 -0.032,539 -0.062,540 0.092,541 -0.085,542 2.153,543 6.177,544 0.59,545 71.191,546 1.002,547 1.114,548 3.036,549 9.219,550 0.697,551 3.761,552 4.06,553 4.304,554 4.511,555 4.691,556 4.736,557 4.913,558 5.03,559 5.094,560 5.231,561 10.729,562 0.652,563 561.78,564 3.761,565 5.293,566 6.129,567 6.989,568 7.841,569 8.707,570 9.568,571 10.44,572 11.308,573 12.183,574 4.3,576 1,578 2,581 12,583 18,585 1,587 1,589 2,591 70,592 22,593 3,594 42,595 73,596 30,597 18,598 6,599 12,600 4,601 4,602 4,604 2,607 1,609 23,610 7,612 4,613 2,614 1,615 1,616 4,619 31,620 7,621 2,622 9,623 2,624 3,625 1,626 4,629 1,630 3,631 2,633 1,634 4,635 2,636 2,638 39,639 1,641 5,643 2,644 1,646 2,651 5.7,653 2,654 2,655 20.5,656 13.067,657 8.806,658 4.408,659 3.949,660 1.471,661 0.969,662 10.315,663 12.336,664 4.025,665 4.559,666 5.067,667 5.575,668 6.088,669 6.268,670 6.672,671 7.042,672 7.341,673 7.714,674 0.923,675 59,676 14.415,677 6.015,678 7.774,679 27.435,680 21.931,681 2.274,682 88.667,683 341.362,684 267.515,685 39.146,687 72.29,688 77.412,689 190.104,690 413.652,691 39.146,692 17.65,693 49.466,694 123.191,695 61.25,696 49.982,698 373.581,699 45.192,700 341.362,701 229.25,702 72.29,703 77.412,704 247.193,705 166.458,706 70.24,707 147.982,708 11.027,709 77.412,710 341.362,711 111.435,712 267.515,713 341.362,714 81.482,715 147.09,717 150.379,718 341.362,719 111.435,720 267.515,721 0.575,722 0.337,723 0.17,724 0.086,725 24,726 12,727 0.164,728 12,729 5.071,730 354.567,731 23,732 190.131,733 1,734 1,735 28.994,736 13.875,737 7.779,738 111.435,739 21.418,741 3.959,742 32.897,743 720.313,744 55,745 24.395,746 5.52,747 1.818,748 0.387,749 70.138,750 77.985,751 0.265,752 0.593,753 0.735,754 0.816,755 0.847,756 0.861,757 5.255,758 1.969,759 6.103,760 6.537,761 4.745,762 5.247,763 3.876,764 6.878,765 4.639,766 6.441,767 1.805,768 7.644,769 5.759,770 4.29,771 4.956,772 3.072,773 7.73,774 4.117,775 7.73,776 1.474,777 9.283,778 5.205,779 6.312,780 7.337,781 6.572,782 10.795,783 6.104,784 9.052,785 1.294,786 10.979,787 3.925,788 6.673,789 7.813,790 6.478,791 12.504,792 6.391,793 10.402,794 1.235,795 12.714,796 2.981,797 8.15,798 9.685,799 9.502,800 15.107,801 7.838,802 11.774,803 1,804 14.476,805 2.933,806 8.897,807 10.521,808 9.746,809 17.212,810 8.502,811 13.161,812 1,813 16.26,814 2.275,815 10.156,816 12.164,817 12.451,818 19.677,819 9.725,820 3.233,821 1,822 18.063,823 2.275,824 11.098,825 13.196,826 12.932,827 21.964,828 10.579,829 2.811,830 11.323,831 19.882,832 2.275,833 12.271,834 14.715,835 15.408,836 24.393,837 11.704,838 2.687,839 8.268,840 21.716,841 3.903,842 13.314,843 15.863,844 16.07,845 26.76,846 12.657,847 2.582,848 8.033,849 23.561,850 3.78,851 14.46,852 17.31,853 18.371,854 29.181,855 13.741,856 2.448,857 7.596,858 25.418,859 3.672,860 15.556,861 18.529,862 19.176,863 31.582,864 14.747,865 2.402,866 7.018,867 27.285,868 3.456,869 16.697,870 19.933,871 21.339,872 34.004,873 15.816,874 2.192,875 6.644,876 29.16,877 3.082,878 17.822,879 21.197,880 22.261,881 36.42,882 16.85,883 28022,884 46800,885 27.739,886 48.79,887 62.186,888 67.298,889 64.233,890 61.612,891 61.469,892 78.883,893 19.501,894 172.119,895 58.258,896 5.404,897 6.912,898 6.558,899 5.287,900 5.233,901 6.903,902 8.641,903 18.496,904 4.982,905 22.322,906 1.481,907 1.602,908 1.529,909 1.467,910 1.464,911 1.878,912 0.464,913 4.098,914 1.387,915 4.012,916 4.03,917 4.223,918 3.949,919 7.438,920 3.937,921 3.926,922 3.946,923 3.913,924 3.848,925 7.427,926 3.847,927 3.862,928 3.886,929 3.822,930 3.804,931 4.956,932 3.8,933 3.761,934 3.835,935 3.783,936 3.626,937 4.878,938 3.582,939 3.639,940 3.644,941 3.613,942 3.564,943 4.86,944 3.546,945 3.447,946 3.515,947 3.403,948 3.274,949 4.723,950 3.259,951 3.348,952 3.407,953 3.282,954 3.123,955 4.632,956 3.139,957 3.306,958 3.389,959 3.27,960 3.121,961 4.356,962 3.089,963 0.107,964 0.117,965 0.163,966 0.099,967 0.077,968 4.481,969 0.093,970 4.912,971 0.107,972 6.859,973 0.27,974 4.152,975 0.071,976 3.233,977 3.903,978 4.506,979 11.323,980 2.982,981 1.935,982 1.919,983 2.028,984 2.03,985 1.263,986 2.029,987 1.888,988 1.865,989 1.998,990 2.003,991 1.118,992 2.002,993 1.862,994 1.84,995 1.966,996 1.945,997 1.079,998 1.954,999 1.724,1000 1.65,1001 1.956,1002 1.932,1003 1.057,1004 1.944,1005 1.471,1006 1.435,1007 1.771,1008 1.69,1009 1.012,1010 1.716,1011 1.427,1012 1.392,1013 1.725,1014 1.584,1015 0.869,1016 1.638,1017 1.351,1018 1.256,1019 1.484,1020 1.577,1021 0.626,1022 1.552,1023 1.229,1024 1.236,1025 1.375,1026 1.518,1027 0.481,1028 1.481,1029 4.443,1030 5.746,1031 2.398,1032 7.235,1033 4.844,1034 8.803,1035 7.002,1036 10.415,1037 4.322,1039 5.273,1041 4.693,1043 11.696,1044 1.274,1046 3.911,1049 45.673,1050 113.508,1051 254.415,1052 315.501,1053 350.03,1054 363.54,1055 369.54,1056 85.3,1057 8.387,1058 86.79,1059 147.12,1060 23,1061 12.724,1062 4.524,1063 3.807,1064 71.04,1065 247,1066 254,1067 0.136,1068 289.541,1069 516.28,1070 698.239,1071 63952,1073 27.777,1074 0.712,1075 0.605,1076 28.631,1077 23.595,1078 18.872,1079 0.449,1080 0.334,1081 12.74,1082 17.607,1083 12.309,1084 10.236,1085 19.569,1086 14.01,1087 16.54,1088 0.29,1089 0.184,1090 17.715,1091 10.475,1092 13.851,1093 0.19,1094 0.103,1095 14.963,1096 7.525,1097 11.004,1098 0.122,1099 0.059,1100 12.392,1101 5.306,1102 8.447,1103 0.078,1104 0.031,1105 9.635,1106 3.337,1107 0.225,1108 124.48,1109 0.19,1110 36.553,1111 0.341,1112 198,1113 595.265,1114 261.495,1115 614.953,1116 831.35,1117 574,1118 229,1119 579.297,1120 279.192,1121 607.09,1122 889.67,1123 572,1124 5.097}
{0 CHEMBL360077,1 1.508,2 7.818,3 2.253,4 5.077,5 86.454,6 7.36,7 0.5,8 3.784,9 3.912,10 3.329,11 3.347,12 4.951,13 3.323,14 4.293,15 4.464,16 3.667,17 3.756,18 5.337,19 3.698,20 4.616,21 4.84,22 3.783,23 3.921,24 5.64,25 3.839,26 4.648,27 4.88,28 3.761,29 3.893,30 5.791,31 3.8,32 4.598,33 4.831,34 3.698,35 3.837,36 5.702,37 3.754,38 4.545,39 4.777,40 3.641,41 3.764,42 5.744,43 3.678,44 4.507,45 4.754,46 3.407,47 3.636,48 5.638,49 3.527,50 4.38,51 4.653,52 3.061,53 3.39,54 5.558,55 3.234,56 0.05,57 0.601,58 8.238,59 3.448,60 14.564,61 4.592,62 0.086,63 0.958,64 14.523,65 6.086,66 16.257,67 8.353,68 0.143,69 1.223,70 21.924,71 8.227,72 31.317,73 11.706,74 0.246,75 1.24,76 23.077,77 8.497,78 56.242,79 12.129,80 0.197,81 1.205,82 21.921,83 7.327,84 48.01,85 10.672,86 0.302,87 1.161,88 20.727,89 6.736,90 58.594,91 9.845,92 0.236,93 1.036,94 20.722,95 6.51,96 56.415,97 9.44,98 0.328,99 0.836,100 19.205,101 6.022,102 71.765,103 8.796,104 11,105 33,106 0.267,107 0.675,108 0.803,109 0.89,110 0.899,111 0.899,112 3.148,113 0.925,114 -3.47,115 -3.45,116 -3.3,117 42.5,119 2,120 1,122 2,125 5,126 3,127 1,128 1,129 1,130 1,132 1,133 1,134 1,135 9,137 4,138 1,139 1,140 5,141 10,142 1,144 3,145 5,146 7,147 1,148 1,149 5,150 1,151 2,152 7,153 7,154 3,156 3,159 3,160 6,161 2,163 3,165 2,166 2,167 6,168 2,169 7,170 3,172 1,173 3,174 5,175 1,177 2,178 1,179 1,180 3,181 3,184 1,185 1,186 1,188 588,189 15.06,190 15.06,191 15.06,192 15.06,193 15.06,194 13.475,195 14.871,196 8.959,197 15.246,198 11.781,199 11.781,200 11.781,201 11.781,202 11.781,203 9.34,204 12.916,205 4.143,206 12.1,207 3.814,208 1.513,209 0.79,210 0.3,211 0.25,212 0.25,213 3.828,215 1,216 1,217 1,218 366,219 2.121,221 204.334,222 1.124,223 23.164,224 1,225 1,226 1,227 1,228 1,229 0.8,230 1,231 1,232 0.9,233 47,234 172,235 4.54,236 4.088,237 6.712,238 4.163,239 3.18,240 4.244,241 2.035,242 10.895,243 3.128,244 4.23,245 3.25,246 6.399,247 3.861,248 2.878,249 3.817,250 0.4,251 9.747,252 2.826,253 3.63,254 3,255 5.663,256 3.402,257 2.432,258 2.814,260 7.389,261 2.359,262 3.496,263 2.57,264 5.07,265 2.962,266 1.995,267 2.752,269 5.771,270 1.925,271 3.164,272 2.106,273 4.556,274 2.697,275 1.742,276 2.032,278 4.478,279 1.662,280 2.901,281 1.942,282 4,283 2.392,284 1.414,285 2.015,287 3.218,288 1.377,289 2.86,290 1.521,291 3.639,292 2.24,293 1.281,294 1.768,296 2.927,297 1.226,298 2.579,299 1.394,300 3.571,301 2.116,302 1.127,303 1.414,305 2.75,306 1.114,307 2.245,308 1.16,309 3.254,310 1.956,311 1,312 1.038,313 2.136,314 0.953,315 2,316 1.127,317 3.247,318 1.646,319 0.69,320 1,321 1.376,322 0.657,323 1.38,324 0.622,325 2.682,326 0.81,327 -0.131,328 -0.18,329 -0.253,330 -0.122,331 1.035,332 0.094,333 2.531,334 0.594,335 -0.331,336 -0.459,337 -0.659,338 -0.305,339 0.892,340 -0.225,341 2.248,342 0.523,343 -0.435,344 -0.538,345 -1.112,346 -0.414,347 0.616,348 -0.591,349 2,350 0.203,351 -0.767,352 -0.955,353 -1.827,354 -0.739,355 0.257,356 -0.775,357 1.862,358 0.023,359 -0.953,360 -1,361 -2.299,362 -0.928,363 10.433,364 0.474,365 0.469,366 0.021,367 29.75,368 1.352,369 16,370 0.727,371 13.75,372 0.625,373 16.266,374 0.739,375 23.167,376 0.579,377 20.667,378 0.939,379 5.578,380 0.254,381 5.124,382 0.233,383 0.109,384 0.335,385 1.03,386 1.08,387 0.851,388 0.911,389 0.811,390 0.864,391 0.687,392 1.072,393 0.879,394 1.058,395 0.454,396 1.002,397 0.835,398 1.064,399 0.868,400 1.005,401 0.604,402 0.951,403 0.754,404 1.06,405 0.886,406 1.049,407 0.706,408 1.003,409 1.099,410 1.125,411 1.016,412 1.008,413 1.25,414 0.995,415 0.954,416 1.016,417 1.108,418 1.057,419 1.197,420 1.083,421 1.427,422 1.065,423 1.218,424 1.071,425 1.477,426 1.104,427 1.279,428 0.919,429 1.184,430 1.022,431 1.373,432 1.088,433 3.5,435 2.667,436 1.688,437 1.218,438 1.007,439 0.549,440 0.231,441 0.086,442 0.054,443 4386,444 11504,445 2.07,446 45,447 2,448 9,449 4,450 3,452 1.653,453 1.941,454 2.976,455 1.825,456 1,457 1,458 1,459 60.332,460 1.508,461 3.809,462 4.532,463 5.022,464 5.072,465 5.072,466 2.392,467 3.573,468 4.432,469 3.075,470 710.357,471 7.655,472 7639.77,473 1,474 1,475 1,476 212.877,477 1.395,478 4.392,479 0.146,481 0.081,482 0.047,483 0.036,484 0.031,485 0.019,486 0.01,487 0.006,488 0.009,489 0.385,490 0.5,491 1,492 0.797,493 98.754,494 -0.158,495 0.084,496 -0.001,497 0.127,498 -0.062,499 0.092,500 0.012,501 0.014,502 -0.006,503 -0.022,504 0.061,505 -0.017,506 -0.017,507 -0.073,508 0.071,509 0.003,510 0.069,511 0.043,512 0.153,513 -0.088,514 0.074,515 -0.055,516 0.165,517 -0.015,518 -0.129,519 -0.108,520 -0.052,521 -0.049,522 -0.179,523 -0.04,524 0.062,525 0.045,526 -0.141,527 -0.129,528 -0.064,529 -0.156,530 -0.23,531 -0.084,532 -0.217,533 -0.136,534 -0.208,535 -0.164,536 0.017,537 -0.025,538 -0.142,539 -0.08,540 0.016,541 -0.126,542 1.508,543 4.024,544 0.818,545 14.793,546 0.998,547 1.128,548 2.243,549 5.032,550 0.67,551 3.219,552 3.526,553 3.829,554 4.094,555 4.317,556 4.357,557 4.477,558 4.511,559 4.443,560 4.344,561 4.847,562 0.637,563 294.39,564 3.219,565 4.745,566 5.602,567 6.482,568 7.358,569 8.247,570 9.131,571 10.023,572 10.91,573 11.805,574 10,575 1,577 1,579 1,580 1,581 5,582 1,583 12,584 1,586 1,588 1,591 40,592 13,593 1,594 24,595 42,596 17,597 11,598 2,599 4,601 3,602 3,605 2,606 1,607 2,608 1,609 11,610 5,611 1,617 1,618 1,619 18,620 5,621 4,622 5,624 4,626 1,627 1,630 3,632 1,634 3,638 22,639 1,640 1,641 4,642 1,645 1,647 1,648 1,649 1,651 2.5,652 1,655 11.333,656 6.933,657 4.972,658 2.429,659 2.376,660 1.352,661 0.966,662 4.17,663 9.128,664 3.497,665 4.043,666 4.654,667 5.242,668 5.763,669 6.045,670 6.454,671 6.768,672 6.961,673 7.155,674 1,675 36,676 8.117,677 3.479,678 7.833,679 15.474,680 12.888,681 2.333,682 51.333,683 164.795,684 87.905,685 98.753,687 42.683,689 87.905,690 207.479,691 98.753,693 9.28,694 98.289,695 76.071,696 43.373,697 2.328,698 164.795,700 164.795,701 186.658,702 42.683,704 129.482,705 77.997,706 61.107,707 108.765,708 16.786,710 164.795,711 141.436,712 87.905,713 164.795,714 23.922,715 47.381,716 34.612,717 123.425,718 164.795,719 141.436,720 87.905,721 0.572,722 0.351,723 0.199,724 0.107,725 16,726 7,727 0.048,728 2,729 3.324,730 176.419,731 18,732 98.107,735 14.681,736 6.25,737 2.889,738 141.436,739 8.908,740 4.305,741 2.989,742 93.591,743 394.136,744 32,749 39.92,750 45.109,751 0.283,752 0.716,753 0.852,754 0.944,755 0.953,756 0.953,757 4.736,758 1.127,759 5.58,760 2.927,761 4.205,762 4.727,763 2.262,764 6.409,765 4.154,766 5.939,767 1,768 7.149,769 2.75,770 3.761,771 4.477,773 7.368,774 3.69,775 7.244,776 0.69,777 8.826,778 2.136,779 5.802,780 6.906,781 3.565,782 10.501,783 5.715,784 8.586,785 -0.131,786 10.567,787 1.376,788 6.217,789 7.521,791 12.3,792 6.114,793 9.964,794 -0.331,795 12.349,796 -0.253,797 7.711,798 9.403,799 4.962,800 14.94,801 7.593,802 11.366,803 -0.435,804 14.158,805 -0.659,806 8.52,807 10.426,809 17.067,810 8.388,811 12.788,812 -0.767,813 15.986,814 -1.112,815 9.793,816 12.07,817 6.378,818 19.536,819 9.646,820 3.18,821 -0.953,822 17.827,823 -1.827,824 10.782,825 13.293,827 21.799,828 10.62,829 2.878,830 10.895,831 19.678,832 -2.299,833 11.968,834 14.825,835 7.797,836 24.205,837 11.791,838 2.432,839 9.747,840 21.537,841 4.244,842 13.038,843 16.149,845 26.527,846 12.845,847 1.995,848 7.389,849 23.401,850 3.817,851 14.191,852 17.628,853 9.217,854 28.91,855 13.983,856 1.742,857 5.771,858 25.27,859 2.814,860 15.299,861 19.003,863 31.259,864 15.075,865 1.414,866 4.478,867 27.143,868 2.752,869 16.441,870 20.458,871 10.638,872 33.635,873 16.202,874 1.281,875 3.218,876 29.019,877 2.032,878 17.567,879 21.861,881 35.998,882 17.311,883 4327,884 7105,885 16.008,886 26.807,887 36.718,888 38.693,889 37.219,890 35.538,891 35.476,892 45.788,893 4.869,894 101.377,895 34.453,896 5.54,897 6.088,898 6.514,899 5.203,900 5.18,901 7.244,902 4.069,903 18.052,904 5.128,905 9.702,906 1.53,907 1.612,908 1.551,909 1.481,910 1.478,911 1.908,912 0.203,913 4.224,914 1.436,915 4.035,916 4.067,917 3.995,918 3.957,919 6.82,920 3.962,921 3.845,922 3.885,923 3.769,924 3.76,925 6.469,926 3.757,927 3.686,928 3.743,929 3.583,930 3.539,931 5.141,932 3.541,933 3.172,934 3.234,935 3.139,936 3.039,937 4.678,938 3.054,939 3.127,940 3.205,941 2.97,942 2.956,943 4.465,944 2.944,945 3.035,946 3.149,947 2.838,948 2.763,949 4.32,950 2.762,951 2.952,952 3.048,953 2.812,954 2.746,955 3.76,956 2.751,957 2.927,958 2.972,959 2.781,960 2.658,961 3.583,962 2.693,963 0.189,964 0.17,965 0.28,966 0.173,967 0.132,968 4.54,969 0.177,970 4.088,971 0.085,972 6.712,973 0.454,974 4.163,975 0.13,976 3.18,977 4.244,978 2.035,979 10.895,980 3.128,981 1.987,982 1.962,983 2.092,984 2.091,985 1.424,986 2.092,987 1.842,988 1.807,989 1.993,990 1.968,991 1.116,992 1.979,993 1.655,994 1.602,995 1.793,996 1.819,997 0.945,998 1.815,999 1.14,1000 1.079,1001 1.451,1002 1.374,1003 0.682,1004 1.404,1005 1.11,1006 1.052,1007 1.356,1008 1.323,1009 0.564,1010 1.344,1011 1.006,1012 0.897,1013 1.261,1014 1.267,1015 0.244,1016 1.265,1017 0.883,1018 0.84,1019 1.144,1020 1.2,1021 0.148,1022 1.184,1023 0.852,1024 0.749,1025 1.094,1026 1.144,1027 0.004,1028 1.131,1029 3.892,1030 5.198,1032 6.727,1034 8.355,1036 10.032,1039 5.991,1040 10.024,1041 3.929,1042 3.355,1045 0.248,1047 9.406,1048 2.177,1049 25.488,1050 60.332,1051 152.374,1052 181.267,1053 200.877,1054 202.877,1055 202.877,1056 39.66,1057 6.752,1058 94.96,1059 94.96,1060 18,1061 12.332,1062 3.807,1063 3.17,1064 34.129,1065 64,1066 58,1067 0.271,1068 159.414,1069 275.45,1070 380.731,1071 6422,1073 15.527,1074 0.706,1075 0.555,1076 15.527,1077 12.212,1078 10.703,1079 0.446,1080 0.308,1081 7.329,1082 10.418,1083 7.191,1084 5.959,1085 10.703,1086 7.4,1087 9.268,1088 0.281,1089 0.168,1090 9.268,1091 5.529,1092 8.04,1093 0.179,1094 0.091,1095 8.04,1096 4.106,1097 6.899,1098 0.117,1099 0.05,1100 6.899,1101 2.975,1102 5.411,1103 0.073,1104 0.028,1105 5.411,1106 2.089,1107 0.405,1108 66.344,1109 0.25,1110 21.149,1111 0.807,1112 114,1113 301.085,1114 121.321,1115 303.983,1116 414.3,1117 282,1118 135,1119 304.227,1120 142.322,1121 313.051,1122 454.89,1123 295,1124 5.745}