@RELATION AP400_Test_Known

@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
-0.16,150.22198,168,225.71,11,10,0,1,0,0,0,0,0,0,11,3,0.454545455,0,0,0.545454545,0.333333333,1,1,0,1,1,0.821379409,8.104448007,5.325698503,4.253158111,9.090909091,4.792899408,3.265306122,168,0.636363636,2.132484961,3.458848994,1.993657407,1.603407029,-0.182962963,0,0,0,0,10.06449735,1.210046296,0,0,0,0,0,0,0,0,0,0,0,9.311354875,0,0,0,0,0,0,0,0,0,0,0,0,0,2.405253118,0,0,0,2.463762826,0,0,5.630373583,0,1,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,10,1,0,3,0,0,0,0,0,0,0,0,0,0,0,0,2.367209836,2.331955516,3.576977431,0.485667105,20.23,12.50776366,0,0,1,1,1,1,0,0,0.434703633,-0.756306792,0.434703633,-0.756306792,0,0,1.667919213,0.39276155,0.210352609,-0.39276155,6.485379486,0.756306792,3.09343629,2.635636404,0.434703633,-0.756306792,0.189501318,0.128684808,-0.469766939,-0.281003355,0.531495331,-0.367684107,1.51E-02,0.697178403,1.51E-02,0.697178403,9.36E-02,1.51E-02,1.51E-02,8.84E-02,9.36E-02,4.64E-02,1.51E-02,1.51E-02,9.36E-02,4.64E-02,0.045959759,8.21E-02,8.86E-02,7.54E-02,6.61E-02,5.48E-02,3.45E-02,0,0,3.45E-02,1.65E-02,-6.52E-03,-2.23E-04,1.10E-04,-7.46E-05,0,0,0,1,1,0.25,0.331840859,0.125,0.125,0.125,0,0,0,0.125764578,0.125814417,0.124186867,0,0,0,5.750651912,0.549986042,30.06439699,82,20.19526972,18.36848902,0,0,0,0,1,0,0,0,0.181818182,9.09E-02
0.87,178.27606,210,280.13,13,12,0,1,0,0,0,0,0,0,13,6,0.538461538,0,0,0.461538462,0.333333333,1,1,0,1,1,0.821379409,9.355524862,6.431851653,4.706924542,11.07692308,7.408163265,5.333333333,314,0.769230769,1.861874739,4.709510291,0,6.092456774,0,0,0,0,0,10.56890777,1.422683768,0,0,0,0,0,0,0,0,0,0,0,8.582618351,0,0,0,0,0,0,0,0,0,0,0,0,0,2.33322078,0,0,0,3.307595309,0,0,5.536834778,0,1,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,12,1,0,3,0,0,0,0,0,0,0,0,0,0,0,0,3.253459174,3.199482207,5.325137596,0.242570913,20.23,13.35428831,0,0,1,1,1,1,0,0,0.430897522,-0.75210907,0.430897522,-0.75210907,0,0,1.912996696,0.396317675,0.209934122,-0.396317675,7.786409975,0.75210907,3.866260347,3.168040558,0.430897522,-0.75210907,0.86977877,-0.955585406,-8.29E-02,-9.21E-02,-4.01E-03,0.150134329,1.14E-02,0.694831971,1.14E-02,0.694831971,7.39E-02,1.14E-02,1.14E-02,7.39E-02,0.072551759,3.88E-02,1.14E-02,1.14E-02,0.072551759,3.88E-02,3.89E-02,7.17E-02,7.21E-02,0.060589932,0.05266387,4.54E-02,0.033221682,0,0,0.033221682,1.59E-02,-6.28E-03,-2.07E-04,1.02E-04,-6.91E-05,0,0,0,1,1,0.25,0.331895869,0.125,0.125,0.125,0,0,0,0.125735778,0.125781839,0.124219306,0,0,0,5.673257457,0.460457722,34.94984299,98,24.64683825,22.05428673,0,0,0,0,1,0,0,0,0.153846154,7.69E-02
0.12,150.22198,168,225.71,11,10,0,1,0,0,0,0,0,0,11,4,0.454545455,0,0,0.545454545,0.318181818,1,1,0,1,1,0.821379409,7.9413113,5.431851653,3.999817761,9.090909091,5.625,3.786982249,182,0.727272727,1.95831315,3.818614694,0,3.392501181,0,0,0,0,0,10.36790635,1.361990741,0,0,0,0,0,0,0,0,0,0,0,8.544268393,0,0,0,0,0,0,0,0,0,0,0,0,0,2.343207625,0,0,0,2.378429493,0,0,5.544511527,0,1,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,10,1,0,3,0,0,0,0,0,0,0,0,0,0,0,0,2.634459146,2.574509502,4.259051222,0.310983852,20.23,12.5740632,0,0,1,1,1,1,0,0,0.435035574,-0.751479877,0.435035574,-0.751479877,0,0,1.701262397,0.396317484,0.209934124,-0.396317484,6.213076656,0.751479877,3.077575354,2.384021424,0.435035574,-0.751479877,0.568083193,-0.644688185,-9.73E-02,4.91E-02,-0.296244254,0.356087672,1.36E-02,0.696942064,1.36E-02,0.696942064,8.84E-02,1.36E-02,1.36E-02,8.84E-02,8.68E-02,4.64E-02,1.36E-02,1.36E-02,8.68E-02,4.64E-02,4.67E-02,8.53E-02,8.40E-02,6.68E-02,5.80E-02,4.52E-02,3.29E-02,0,0,3.29E-02,1.57E-02,-6.22E-03,-2.03E-04,1.00E-04,-6.78E-05,0,0,0,1,1,0.25,0.331909185,0.125,0.125,0.125,0,0,0,0.125728813,0.125773984,0.124227129,0,0,0,5.724798039,0.550543174,29.76452543,82,20.2092947,18.36848902,0,0,0,0,1,0,0,0,0.181818182,9.09E-02
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