@RELATION AP400_Test_Blind @ATTRIBUTE class NUMERIC @ATTRIBUTE MWt NUMERIC @ATTRIBUTE MolVol NUMERIC @ATTRIBUTE VMcGowan NUMERIC @ATTRIBUTE N_Atoms NUMERIC @ATTRIBUTE N_Carbon NUMERIC @ATTRIBUTE N_Ntrgen NUMERIC @ATTRIBUTE N_Oxygen NUMERIC @ATTRIBUTE N_Sulfur NUMERIC @ATTRIBUTE N_Fluorn NUMERIC @ATTRIBUTE N_Chlorn NUMERIC @ATTRIBUTE N_Bromin NUMERIC @ATTRIBUTE N_Iodine NUMERIC @ATTRIBUTE N_Halogen NUMERIC @ATTRIBUTE N_Bonds NUMERIC @ATTRIBUTE N_FrRotB NUMERIC @ATTRIBUTE F_SgleB NUMERIC @ATTRIBUTE F_DbleB NUMERIC @ATTRIBUTE F_TpleB NUMERIC @ATTRIBUTE F_AromB NUMERIC @ATTRIBUTE F_AFRBWF NUMERIC @ATTRIBUTE N_Rings NUMERIC @ATTRIBUTE N_AromR NUMERIC @ATTRIBUTE N_AlipR NUMERIC @ATTRIBUTE N_Pisyms NUMERIC @ATTRIBUTE N_IsolLP NUMERIC @ATTRIBUTE Herndon NUMERIC @ATTRIBUTE X0 NUMERIC @ATTRIBUTE X1 NUMERIC @ATTRIBUTE X2 NUMERIC @ATTRIBUTE Kappa1 NUMERIC @ATTRIBUTE Kappa2 NUMERIC @ATTRIBUTE Kappa3 NUMERIC @ATTRIBUTE Wiener NUMERIC @ATTRIBUTE T_RDmtr NUMERIC @ATTRIBUTE Blbn_J NUMERIC @ATTRIBUTE Blbn_MSD NUMERIC @ATTRIBUTE SsCH3 NUMERIC @ATTRIBUTE SssCH2 NUMERIC @ATTRIBUTE SsssCH NUMERIC @ATTRIBUTE SssssC NUMERIC @ATTRIBUTE SdCH2 NUMERIC @ATTRIBUTE SdsCH NUMERIC @ATTRIBUTE SdssC NUMERIC @ATTRIBUTE SaaCH NUMERIC @ATTRIBUTE SaasC NUMERIC @ATTRIBUTE SaaaC NUMERIC @ATTRIBUTE StCH NUMERIC @ATTRIBUTE SddC NUMERIC @ATTRIBUTE StsC NUMERIC @ATTRIBUTE SsNH2 NUMERIC @ATTRIBUTE SssNH NUMERIC @ATTRIBUTE SsssN NUMERIC @ATTRIBUTE SdsN NUMERIC @ATTRIBUTE SaaN NUMERIC @ATTRIBUTE SddsN NUMERIC @ATTRIBUTE StN NUMERIC @ATTRIBUTE SsOH NUMERIC @ATTRIBUTE SssO NUMERIC @ATTRIBUTE SsO- NUMERIC @ATTRIBUTE SdO NUMERIC @ATTRIBUTE SddssS NUMERIC @ATTRIBUTE SsSH NUMERIC @ATTRIBUTE SssS NUMERIC @ATTRIBUTE SdssS NUMERIC @ATTRIBUTE SdS NUMERIC @ATTRIBUTE SaaS NUMERIC @ATTRIBUTE SsF NUMERIC @ATTRIBUTE SsCl NUMERIC @ATTRIBUTE SsBr NUMERIC @ATTRIBUTE SsI NUMERIC @ATTRIBUTE SHsOH NUMERIC @ATTRIBUTE SHsNH2 NUMERIC @ATTRIBUTE SHssNH NUMERIC @ATTRIBUTE SHsSH NUMERIC @ATTRIBUTE SHCH_321 NUMERIC @ATTRIBUTE SHdCH2 NUMERIC @ATTRIBUTE SHdsCH NUMERIC @ATTRIBUTE SHaaCH NUMERIC @ATTRIBUTE SHtCH NUMERIC @ATTRIBUTE AlHdrxl_-OH NUMERIC @ATTRIBUTE ArHdrxl_-OH NUMERIC @ATTRIBUTE Carbonyl_C=O NUMERIC @ATTRIBUTE Ether___-O- NUMERIC @ATTRIBUTE PriAmine_-NH2 NUMERIC @ATTRIBUTE PriAmAli_-NH2 NUMERIC @ATTRIBUTE PriAmAro_-NH2 NUMERIC @ATTRIBUTE SecAmine_>NH NUMERIC @ATTRIBUTE TerAmine_>N- NUMERIC @ATTRIBUTE ArNitrog_=N- NUMERIC @ATTRIBUTE Nitrile_C#N NUMERIC @ATTRIBUTE Thiol___-SH NUMERIC @ATTRIBUTE Sulfide_-S- NUMERIC @ATTRIBUTE Oxime___=N-O- NUMERIC @ATTRIBUTE Hdrzine_>N-N< NUMERIC @ATTRIBUTE Sulfoxde_>S=O NUMERIC @ATTRIBUTE Nitro___-NO2 NUMERIC @ATTRIBUTE Sulfone_>S(=O)=O NUMERIC @ATTRIBUTE Sulfite_-SO3< NUMERIC @ATTRIBUTE Sulfate_-OSO3 NUMERIC @ATTRIBUTE AlCbxyl_-COOH NUMERIC @ATTRIBUTE Ester___C(=O)OC NUMERIC @ATTRIBUTE Amide___C(=O)N< NUMERIC @ATTRIBUTE Thioamd_C(=S)N< NUMERIC @ATTRIBUTE Isothcnt_-N=C=S NUMERIC @ATTRIBUTE Carbmte_>NC(=O)O< NUMERIC @ATTRIBUTE M_CX NUMERIC @ATTRIBUTE M_NO NUMERIC @ATTRIBUTE M_PRX NUMERIC @ATTRIBUTE M_UB NUMERIC @ATTRIBUTE M_HB NUMERIC @ATTRIBUTE M_POL NUMERIC @ATTRIBUTE M_RNG NUMERIC @ATTRIBUTE M_NO2 NUMERIC @ATTRIBUTE M_NCS NUMERIC @ATTRIBUTE H_AlAlco NUMERIC @ATTRIBUTE H_AlAcid NUMERIC @ATTRIBUTE H_Phenol NUMERIC @ATTRIBUTE H_AlPyri NUMERIC @ATTRIBUTE H_Nitrle NUMERIC @ATTRIBUTE H_Nitro NUMERIC @ATTRIBUTE H_MultiN NUMERIC @ATTRIBUTE T_Rgrav NUMERIC @ATTRIBUTE T_Rgeom NUMERIC @ATTRIBUTE T_Radmax NUMERIC @ATTRIBUTE T_Dipole NUMERIC @ATTRIBUTE T_PSA NUMERIC @ATTRIBUTE T_Grav3 NUMERIC @ATTRIBUTE IHB NUMERIC @ATTRIBUTE PHB NUMERIC @ATTRIBUTE HBD NUMERIC @ATTRIBUTE HBA NUMERIC @ATTRIBUTE HBDo NUMERIC @ATTRIBUTE HBAo NUMERIC @ATTRIBUTE HBDn NUMERIC @ATTRIBUTE HBAn NUMERIC @ATTRIBUTE HBDch NUMERIC @ATTRIBUTE HBAch NUMERIC @ATTRIBUTE HBDoch NUMERIC @ATTRIBUTE HBAoch NUMERIC @ATTRIBUTE HBDnch NUMERIC @ATTRIBUTE HBAnch NUMERIC @ATTRIBUTE ABSQ NUMERIC @ATTRIBUTE ABSQon NUMERIC @ATTRIBUTE MaxQ NUMERIC @ATTRIBUTE MinQ NUMERIC @ATTRIBUTE NPA_ABSQ NUMERIC @ATTRIBUTE NPA_AQon NUMERIC @ATTRIBUTE NPA_AQh NUMERIC @ATTRIBUTE NPA_AQc NUMERIC @ATTRIBUTE NPA_MaxQ NUMERIC @ATTRIBUTE NPA_MinQ NUMERIC @ATTRIBUTE NPA_Q1 NUMERIC @ATTRIBUTE NPA_Q2 NUMERIC @ATTRIBUTE NPA_Q3 NUMERIC @ATTRIBUTE NPA_Q4 NUMERIC @ATTRIBUTE NPA_Q5 NUMERIC @ATTRIBUTE NPA_Q6 NUMERIC @ATTRIBUTE EEM_AFon NUMERIC @ATTRIBUTE EEM_AFc NUMERIC @ATTRIBUTE EEM_AFpl NUMERIC @ATTRIBUTE EEM_AFnp NUMERIC @ATTRIBUTE EEM_MaxF NUMERIC @ATTRIBUTE EEM_XFon NUMERIC @ATTRIBUTE EEM_NFon NUMERIC @ATTRIBUTE EEM_XFh NUMERIC @ATTRIBUTE EEM_XFc NUMERIC @ATTRIBUTE EEM_NFc NUMERIC @ATTRIBUTE EEM_XFpl NUMERIC @ATTRIBUTE EEM_NFpl NUMERIC @ATTRIBUTE EEM_XFnp NUMERIC @ATTRIBUTE EEM_NFnp NUMERIC @ATTRIBUTE EEM_F1 NUMERIC @ATTRIBUTE EEM_F2 NUMERIC @ATTRIBUTE EEM_F3 NUMERIC @ATTRIBUTE EEM_F4 NUMERIC @ATTRIBUTE EEM_F5 NUMERIC @ATTRIBUTE EEM_F6 NUMERIC @ATTRIBUTE Pi_ABSQ NUMERIC @ATTRIBUTE Pi_AQo NUMERIC @ATTRIBUTE Pi_AQn NUMERIC @ATTRIBUTE Pi_AQc NUMERIC @ATTRIBUTE Pi_MaxQ NUMERIC @ATTRIBUTE Pi_MinQ NUMERIC @ATTRIBUTE Pi_Q1 NUMERIC @ATTRIBUTE Pi_Q2 NUMERIC @ATTRIBUTE Pi_Q3 NUMERIC @ATTRIBUTE Pi_Q4 NUMERIC @ATTRIBUTE Pi_Q5 NUMERIC @ATTRIBUTE Pi_Q6 NUMERIC @ATTRIBUTE Pi_AFPlc NUMERIC @ATTRIBUTE Pi_AFMic NUMERIC @ATTRIBUTE Pi_MaxFPl NUMERIC @ATTRIBUTE Pi_MaxFMi NUMERIC @ATTRIBUTE Pi_FPl1 NUMERIC @ATTRIBUTE Pi_FPl2 NUMERIC @ATTRIBUTE Pi_FPl3 NUMERIC @ATTRIBUTE Pi_FPl4 NUMERIC @ATTRIBUTE Pi_FPl5 NUMERIC @ATTRIBUTE Pi_FPl6 NUMERIC @ATTRIBUTE Pi_FMi1 NUMERIC @ATTRIBUTE Pi_FMi2 NUMERIC @ATTRIBUTE Pi_FMi3 NUMERIC @ATTRIBUTE Pi_FMi4 NUMERIC @ATTRIBUTE Pi_FMi5 NUMERIC @ATTRIBUTE Pi_FMi6 NUMERIC @ATTRIBUTE EqualChi NUMERIC @ATTRIBUTE EqualEta NUMERIC @ATTRIBUTE Elephity NUMERIC @ATTRIBUTE N_Electr NUMERIC @ATTRIBUTE PolarizG NUMERIC @ATTRIBUTE PolarizM NUMERIC @ATTRIBUTE N_IoAcAt NUMERIC @ATTRIBUTE N_IoBaAt NUMERIC @ATTRIBUTE FAnion NUMERIC @ATTRIBUTE FCation NUMERIC @ATTRIBUTE FUnion NUMERIC @ATTRIBUTE FZwitter NUMERIC @ATTRIBUTE QAvgNeg NUMERIC @ATTRIBUTE QAvgPos NUMERIC @ATTRIBUTE F_NLP NUMERIC @ATTRIBUTE F_HBP NUMERIC @DATA 0,140.13966,119,155.82,10,7,0,3,0,0,0,0,0,0,10,1,0.4,0,0,0.6,0.2,1,1,0,1,0,0.821379409,7.560477932,4.753218858,3.935632246,8.1,3.408284024,1.75,113,0.5,2.424438128,2.752776376,1.425092593,0,0,0,0,0,0,4.542453704,-0.107083333,0,0,0,0,0,0,0,0,0,0,0,17.92375,4.715787037,0,0,0,0,0,0,0,0,0,0,0,0,5.260055556,0,0,0,0.736083333,0,0,3.896097222,0,0,2,0,1,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,7,3,0,3,1,3,0,0,0,0,0,0,0,0,0,0,1.90742968,1.846618531,2.929541575,0.531732868,49.69,12.12269514,2,3,2,3,2,3,0,0,0.959929078,-1.848558477,0.959929078,-1.848558477,0,0,2.036548711,0.749654162,0.218410885,-0.256126138,5.874774339,1.848558477,2.224946667,1.801269195,0.480470975,-0.666571143,-0.225399417,-0.57332234,1.237967338,-0.519125652,-0.553938614,-0.123918116,4.91E-02,0.634157793,4.91E-02,0.634157793,0.137199176,1.86E-02,1.20E-02,0.105645216,0.137199176,7.89E-02,1.86E-02,1.20E-02,0.137199176,7.89E-02,4.67E-02,8.70E-02,0.101014052,8.93E-02,7.88E-02,3.23E-02,0.765826152,0.382913076,0,0.382913076,0.147446258,-0.109688996,2.89E-03,-0.024229342,-3.47E-03,-1.62E-02,0,0,0.938940786,0.263159387,0.347939125,0.342932998,0.127426133,0.119101067,0.122529963,1.74E-02,0,0,6.61E-02,8.77E-02,0.178404214,5.04E-02,0,0,6.283630661,0.658452337,29.98243918,74,14.47704934,14.08629454,2,0,4.43E-02,0,0.95568254,0,4.43E-02,0,0.404431831,0.195568169 0,289.54679,206.5,233.36,17,12,0,2,0,0,3,0,0,3,18,2,0.333333333,0,0,0.666666667,0.470588235,2,2,0,1,0,1.642758818,12.41384908,8.058550648,7.54687783,13.43209877,5.76,3.484444444,536,0.588235294,1.836610834,4.506531208,0,0,0,0,0,0,0,9.392466231,1.946675328,0,0,0,0,0,0,0,0,0,0,0,9.619554971,5.450679012,0,0,0,0,0,0,0,0,0,17.42395779,0,0,2.693201927,0,0,0,0,0,0,8.502252719,0,0,1,0,1,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,15,2,0,6,1,4,0,0,0,0,0,1,0,0,0,0,3.476297808,3.091454904,5.196614933,0.263500422,29.46,15.52872761,1,1,1,2,1,2,0,0,0.505283756,-1.121816503,0.505283756,-1.121816503,0,0,1.818058893,0.392808641,0.218315255,-0.256269227,5.42901859,1.121816503,1.835660546,2.360282281,0.505283756,-0.643180491,-0.490396642,0.126764093,0.741133847,-1.106304738,0.618278782,6.14E-02,1.92E-02,0.488880715,0.390078634,0.488880715,0.123668223,1.02E-02,9.03E-03,5.81E-02,4.97E-02,2.15E-02,0.123668223,9.03E-03,4.97E-02,2.15E-02,2.86E-02,6.72E-02,6.69E-02,6.86E-02,5.04E-02,4.99E-02,1.047766714,0.355918094,0,0.523883357,0.228328283,-8.14E-02,1.14E-03,-4.54E-02,-1.90E-02,-1.45E-02,2.97E-02,5.03E-03,0.984002622,0.064708652,0.263891259,0.336976432,8.28E-02,8.79E-02,0.102924454,4.09E-02,4.46E-02,3.75E-02,2.44E-03,0.013825017,1.58E-02,0.093092589,2.31E-02,1.06E-02,6.60558284,0.362250854,60.22584089,146,27.12766468,26.97820274,1,0,0.52011989,0,0.47988011,0,0.52011989,0,0.207065876,2.82E-02 0,240.21704,196,247.43,17,10,2,5,0,0,0,0,0,0,17,1,0.529411765,0.117647059,0,0.352941176,0.235294118,1,1,0,1,0,0.821379409,13.37831518,7.641752976,8.215007891,15.05882353,5.325443787,3.484444444,472,0.352941176,2.902224462,3.813675084,5.111621315,0,0,-0.624143519,0,0,0,1.90962963,-1.393472222,0,0,0,0,0,0,0,0,0,-1.556296296,0,9.736799414,0,0,42.73252834,0,0,0,0,0,0,0,0,0,0,2.761628118,0,0,0,1.963352041,0,0,3.226277778,0,0,1,0,0,0,0,0,0,0,0,0,0,0,0,0,0,2,0,0,0,0,0,0,0,0,0,10,7,8,3,1,3,0,2,0,0,0,0,0,0,0,0,2.714084343,2.616159524,3.714262456,3.681980489,111.87,14.48186104,1,2,1,5,1,5,0,0,0.526235721,-2.174564108,0.526235721,-2.174564108,0,0,3.117556248,1.514318634,0.263230812,-0.394457078,8.418577852,2.984145671,2.945485244,2.488946938,0.526235721,-0.569271432,-1.140287881,1.740951461,-2.697006738,3.532508085,-4.657112917,5.678707307,0.299228624,0.509885865,0.299228624,0.509885865,7.40E-02,4.81E-02,1.19E-02,6.70E-02,7.40E-02,7.54E-03,4.81E-02,1.19E-02,7.40E-02,7.54E-03,2.79E-02,0.068943563,9.05E-02,7.71E-02,9.16E-02,8.17E-02,3.001715539,2.171911646,0.314030626,0.515773267,0.526417644,-0.463505951,-1.41E-02,-0.541927661,5.08E-02,-2.83E-02,-4.03E-02,1.67E-02,0.349080347,0.296393032,0.189101557,0.647489491,8.14E-02,9.56E-02,8.34E-02,6.67E-02,8.45E-02,2.39E-02,1.32E-02,0.146722331,8.27E-03,8.74E-02,1.82E-03,1.96E-02,6.871958478,0.418042209,56.4821115,126,22.6009351,21.59755203,1,0,0.989949093,0,1.01E-02,0,0.989949093,0,0.705291123,5.91E-04 0,179.00328,126,134.1,10,6,0,2,0,0,2,0,0,2,10,0,0.4,0,0,0.6,0,1,1,0,1,0,0.821379409,7.723614639,4.609060905,4.390260761,8.1,2.93877551,1.75,110,0.5,2.487265641,2.666666667,0,0,0,0,0,0,0,2.556481481,-0.311234568,0,0,0,0,0,0,0,0,0,0,0,17.75219136,0,0,0,0,0,0,0,0,0,0,10.89145062,0,0,5.271074074,0,0,0,0,0,0,2.761138889,0,0,2,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,8,2,0,3,1,4,0,0,0,0,0,0,0,0,0,0,1.991157985,1.788854382,2.571188984,0.247167044,40.46,12.95495247,1,2,2,2,2,2,0,0,1.014129437,-1.300304775,1.014129437,-1.300304775,0,0,1.508525935,0.506352011,0.218369574,-0.25602973,4.005253968,1.300304775,1.456558619,1.176131375,0.507236563,-0.654620826,-0.345202301,0.112063322,0.710762854,-0.849436624,0.174581223,0.095481087,3.24E-02,0.363225781,0.420831834,0.363225781,0.194234964,1.64E-02,0.015941346,9.13E-02,7.80E-02,3.43E-02,0.194234964,0.015941346,7.80E-02,3.43E-02,3.65E-02,0.101097185,9.59E-02,0.119339809,6.38E-02,0.019258661,0.699568919,0.242514237,0,0.34978446,0.124688396,-9.67E-02,4.76E-03,-2.27E-02,-1.10E-02,-6.94E-03,6.17E-03,0,0.938597919,6.12E-02,0.312479435,0.477304107,0.125594451,0.13201597,0.124366856,1.08E-02,3.77E-05,0,1.83E-03,2.70E-02,1.77E-02,0.23338943,1.22E-02,0,6.625600064,0.569314939,38.55385942,90,15.32911152,15.5052304,2,0,0.806484632,0,0.193515368,0,0.806860966,0,0.380686097,0.119313903 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