From 2e30fb9ac1369482838cf3b462a8e1b006183c99 Mon Sep 17 00:00:00 2001 From: dhanshreea Date: Thu, 23 Jan 2025 18:35:24 +0530 Subject: [PATCH] update deps to use mordredcommunity, revert code --- Dockerfile | 10 +++++----- model/framework/code/main.py | 6 +----- model/framework/examples/output.csv | 6 +++--- 3 files changed, 9 insertions(+), 13 deletions(-) diff --git a/Dockerfile b/Dockerfile index 28bcb70..0387091 100644 --- a/Dockerfile +++ b/Dockerfile @@ -1,12 +1,12 @@ FROM bentoml/model-server:0.11.0-py38 MAINTAINER ersilia -RUN pip install rdkit==2023.3.2 -RUN pip install mordred==1.2 -RUN pip install timeout-decorator==0.5.0 +RUN pip install mordredcommunity==2.0.6 +RUN pip install networkx==3.2.1 +RUN pip install numpy==1.26.4 RUN pip install pandas==1.3.5 -RUN pip install numpy==1.19.5 -RUN pip install networkx==2.0.0 +RUN pip install rdkit==2023.3.2 +RUN pip install timeout-decorator==0.5.0 WORKDIR /repo COPY ./repo diff --git a/model/framework/code/main.py b/model/framework/code/main.py index 8127c1b..484913f 100644 --- a/model/framework/code/main.py +++ b/model/framework/code/main.py @@ -34,9 +34,5 @@ def one_molecule(mol): r = [None for _ in range(len(columns))] R += [r] -# We read as float dtype because mordred gives us errors for many of the MAX... type descriptors -# Refer to https://github.com/mordred-descriptor/mordred/issues/68 -df = pd.DataFrame(R, columns=columns, dtype=float) -# Then we fill those empty columns with 0.0 -df.fillna(0.0, inplace=True) +df = pd.DataFrame(R, columns=columns) df.to_csv(outfile, index=False) diff --git a/model/framework/examples/output.csv b/model/framework/examples/output.csv index 1c946d9..e4ff2b5 100644 --- a/model/framework/examples/output.csv +++ b/model/framework/examples/output.csv @@ -1,4 +1,4 @@ ABC,ABCGG,nAcid,nBase,SpAbs_A,SpMax_A,SpDiam_A,SpAD_A,SpMAD_A,LogEE_A,VE1_A,VE2_A,VE3_A,VR1_A,VR2_A,VR3_A,nAromAtom,nAromBond,nAtom,nHeavyAtom,nSpiro,nBridgehead,nHetero,nH,nB,nC,nN,nO,nS,nP,nF,nCl,nBr,nI,nX,ATS0dv,ATS1dv,ATS2dv,ATS3dv,ATS4dv,ATS5dv,ATS6dv,ATS7dv,ATS8dv,ATS0d,ATS1d,ATS2d,ATS3d,ATS4d,ATS5d,ATS6d,ATS7d,ATS8d,ATS0s,ATS1s,ATS2s,ATS3s,ATS4s,ATS5s,ATS6s,ATS7s,ATS8s,ATS0Z,ATS1Z,ATS2Z,ATS3Z,ATS4Z,ATS5Z,ATS6Z,ATS7Z,ATS8Z,ATS0m,ATS1m,ATS2m,ATS3m,ATS4m,ATS5m,ATS6m,ATS7m,ATS8m,ATS0v,ATS1v,ATS2v,ATS3v,ATS4v,ATS5v,ATS6v,ATS7v,ATS8v,ATS0se,ATS1se,ATS2se,ATS3se,ATS4se,ATS5se,ATS6se,ATS7se,ATS8se,ATS0pe,ATS1pe,ATS2pe,ATS3pe,ATS4pe,ATS5pe,ATS6pe,ATS7pe,ATS8pe,ATS0are,ATS1are,ATS2are,ATS3are,ATS4are,ATS5are,ATS6are,ATS7are,ATS8are,ATS0p,ATS1p,ATS2p,ATS3p,ATS4p,ATS5p,ATS6p,ATS7p,ATS8p,ATS0i,ATS1i,ATS2i,ATS3i,ATS4i,ATS5i,ATS6i,ATS7i,ATS8i,AATS0dv,AATS1dv,AATS2dv,AATS3dv,AATS4dv,AATS5dv,AATS6dv,AATS7dv,AATS8dv,AATS0d,AATS1d,AATS2d,AATS3d,AATS4d,AATS5d,AATS6d,AATS7d,AATS8d,AATS0s,AATS1s,AATS2s,AATS3s,AATS4s,AATS5s,AATS6s,AATS7s,AATS8s,AATS0Z,AATS1Z,AATS2Z,AATS3Z,AATS4Z,AATS5Z,AATS6Z,AATS7Z,AATS8Z,AATS0m,AATS1m,AATS2m,AATS3m,AATS4m,AATS5m,AATS6m,AATS7m,AATS8m,AATS0v,AATS1v,AATS2v,AATS3v,AATS4v,AATS5v,AATS6v,AATS7v,AATS8v,AATS0se,AATS1se,AATS2se,AATS3se,AATS4se,AATS5se,AATS6se,AATS7se,AATS8se,AATS0pe,AATS1pe,AATS2pe,AATS3pe,AATS4pe,AATS5pe,AATS6pe,AATS7pe,AATS8pe,AATS0are,AATS1are,AATS2are,AATS3are,AATS4are,AATS5are,AATS6are,AATS7are,AATS8are,AATS0p,AATS1p,AATS2p,AATS3p,AATS4p,AATS5p,AATS6p,AATS7p,AATS8p,AATS0i,AATS1i,AATS2i,AATS3i,AATS4i,AATS5i,AATS6i,AATS7i,AATS8i,ATSC0c,ATSC1c,ATSC2c,ATSC3c,ATSC4c,ATSC5c,ATSC6c,ATSC7c,ATSC8c,ATSC0dv,ATSC1dv,ATSC2dv,ATSC3dv,ATSC4dv,ATSC5dv,ATSC6dv,ATSC7dv,ATSC8dv,ATSC0d,ATSC1d,ATSC2d,ATSC3d,ATSC4d,ATSC5d,ATSC6d,ATSC7d,ATSC8d,ATSC0s,ATSC1s,ATSC2s,ATSC3s,ATSC4s,ATSC5s,ATSC6s,ATSC7s,ATSC8s,ATSC0Z,ATSC1Z,ATSC2Z,ATSC3Z,ATSC4Z,ATSC5Z,ATSC6Z,ATSC7Z,ATSC8Z,ATSC0m,ATSC1m,ATSC2m,ATSC3m,ATSC4m,ATSC5m,ATSC6m,ATSC7m,ATSC8m,ATSC0v,ATSC1v,ATSC2v,ATSC3v,ATSC4v,ATSC5v,ATSC6v,ATSC7v,ATSC8v,ATSC0se,ATSC1se,ATSC2se,ATSC3se,ATSC4se,ATSC5se,ATSC6se,ATSC7se,ATSC8se,ATSC0pe,ATSC1pe,ATSC2pe,ATSC3pe,ATSC4pe,ATSC5pe,ATSC6pe,ATSC7pe,ATSC8pe,ATSC0are,ATSC1are,ATSC2are,ATSC3are,ATSC4are,ATSC5are,ATSC6are,ATSC7are,ATSC8are,ATSC0p,ATSC1p,ATSC2p,ATSC3p,ATSC4p,ATSC5p,ATSC6p,ATSC7p,ATSC8p,ATSC0i,ATSC1i,ATSC2i,ATSC3i,ATSC4i,ATSC5i,ATSC6i,ATSC7i,ATSC8i,AATSC0c,AATSC1c,AATSC2c,AATSC3c,AATSC4c,AATSC5c,AATSC6c,AATSC7c,AATSC8c,AATSC0dv,AATSC1dv,AATSC2dv,AATSC3dv,AATSC4dv,AATSC5dv,AATSC6dv,AATSC7dv,AATSC8dv,AATSC0d,AATSC1d,AATSC2d,AATSC3d,AATSC4d,AATSC5d,AATSC6d,AATSC7d,AATSC8d,AATSC0s,AATSC1s,AATSC2s,AATSC3s,AATSC4s,AATSC5s,AATSC6s,AATSC7s,AATSC8s,AATSC0Z,AATSC1Z,AATSC2Z,AATSC3Z,AATSC4Z,AATSC5Z,AATSC6Z,AATSC7Z,AATSC8Z,AATSC0m,AATSC1m,AATSC2m,AATSC3m,AATSC4m,AATSC5m,AATSC6m,AATSC7m,AATSC8m,AATSC0v,AATSC1v,AATSC2v,AATSC3v,AATSC4v,AATSC5v,AATSC6v,AATSC7v,AATSC8v,AATSC0se,AATSC1se,AATSC2se,AATSC3se,AATSC4se,AATSC5se,AATSC6se,AATSC7se,AATSC8se,AATSC0pe,AATSC1pe,AATSC2pe,AATSC3pe,AATSC4pe,AATSC5pe,AATSC6pe,AATSC7pe,AATSC8pe,AATSC0are,AATSC1are,AATSC2are,AATSC3are,AATSC4are,AATSC5are,AATSC6are,AATSC7are,AATSC8are,AATSC0p,AATSC1p,AATSC2p,AATSC3p,AATSC4p,AATSC5p,AATSC6p,AATSC7p,AATSC8p,AATSC0i,AATSC1i,AATSC2i,AATSC3i,AATSC4i,AATSC5i,AATSC6i,AATSC7i,AATSC8i,MATS1c,MATS2c,MATS3c,MATS4c,MATS5c,MATS6c,MATS7c,MATS8c,MATS1dv,MATS2dv,MATS3dv,MATS4dv,MATS5dv,MATS6dv,MATS7dv,MATS8dv,MATS1d,MATS2d,MATS3d,MATS4d,MATS5d,MATS6d,MATS7d,MATS8d,MATS1s,MATS2s,MATS3s,MATS4s,MATS5s,MATS6s,MATS7s,MATS8s,MATS1Z,MATS2Z,MATS3Z,MATS4Z,MATS5Z,MATS6Z,MATS7Z,MATS8Z,MATS1m,MATS2m,MATS3m,MATS4m,MATS5m,MATS6m,MATS7m,MATS8m,MATS1v,MATS2v,MATS3v,MATS4v,MATS5v,MATS6v,MATS7v,MATS8v,MATS1se,MATS2se,MATS3se,MATS4se,MATS5se,MATS6se,MATS7se,MATS8se,MATS1pe,MATS2pe,MATS3pe,MATS4pe,MATS5pe,MATS6pe,MATS7pe,MATS8pe,MATS1are,MATS2are,MATS3are,MATS4are,MATS5are,MATS6are,MATS7are,MATS8are,MATS1p,MATS2p,MATS3p,MATS4p,MATS5p,MATS6p,MATS7p,MATS8p,MATS1i,MATS2i,MATS3i,MATS4i,MATS5i,MATS6i,MATS7i,MATS8i,GATS1c,GATS2c,GATS3c,GATS4c,GATS5c,GATS6c,GATS7c,GATS8c,GATS1dv,GATS2dv,GATS3dv,GATS4dv,GATS5dv,GATS6dv,GATS7dv,GATS8dv,GATS1d,GATS2d,GATS3d,GATS4d,GATS5d,GATS6d,GATS7d,GATS8d,GATS1s,GATS2s,GATS3s,GATS4s,GATS5s,GATS6s,GATS7s,GATS8s,GATS1Z,GATS2Z,GATS3Z,GATS4Z,GATS5Z,GATS6Z,GATS7Z,GATS8Z,GATS1m,GATS2m,GATS3m,GATS4m,GATS5m,GATS6m,GATS7m,GATS8m,GATS1v,GATS2v,GATS3v,GATS4v,GATS5v,GATS6v,GATS7v,GATS8v,GATS1se,GATS2se,GATS3se,GATS4se,GATS5se,GATS6se,GATS7se,GATS8se,GATS1pe,GATS2pe,GATS3pe,GATS4pe,GATS5pe,GATS6pe,GATS7pe,GATS8pe,GATS1are,GATS2are,GATS3are,GATS4are,GATS5are,GATS6are,GATS7are,GATS8are,GATS1p,GATS2p,GATS3p,GATS4p,GATS5p,GATS6p,GATS7p,GATS8p,GATS1i,GATS2i,GATS3i,GATS4i,GATS5i,GATS6i,GATS7i,GATS8i,BCUTc-1h,BCUTc-1l,BCUTdv-1h,BCUTdv-1l,BCUTd-1h,BCUTd-1l,BCUTs-1h,BCUTs-1l,BCUTZ-1h,BCUTZ-1l,BCUTm-1h,BCUTm-1l,BCUTv-1h,BCUTv-1l,BCUTse-1h,BCUTse-1l,BCUTpe-1h,BCUTpe-1l,BCUTare-1h,BCUTare-1l,BCUTp-1h,BCUTp-1l,BCUTi-1h,BCUTi-1l,BalabanJ,SpAbs_DzZ,SpMax_DzZ,SpDiam_DzZ,SpAD_DzZ,SpMAD_DzZ,LogEE_DzZ,SM1_DzZ,VE1_DzZ,VE2_DzZ,VE3_DzZ,VR1_DzZ,VR2_DzZ,VR3_DzZ,SpAbs_Dzm,SpMax_Dzm,SpDiam_Dzm,SpAD_Dzm,SpMAD_Dzm,LogEE_Dzm,SM1_Dzm,VE1_Dzm,VE2_Dzm,VE3_Dzm,VR1_Dzm,VR2_Dzm,VR3_Dzm,SpAbs_Dzv,SpMax_Dzv,SpDiam_Dzv,SpAD_Dzv,SpMAD_Dzv,LogEE_Dzv,SM1_Dzv,VE1_Dzv,VE2_Dzv,VE3_Dzv,VR1_Dzv,VR2_Dzv,VR3_Dzv,SpAbs_Dzse,SpMax_Dzse,SpDiam_Dzse,SpAD_Dzse,SpMAD_Dzse,LogEE_Dzse,SM1_Dzse,VE1_Dzse,VE2_Dzse,VE3_Dzse,VR1_Dzse,VR2_Dzse,VR3_Dzse,SpAbs_Dzpe,SpMax_Dzpe,SpDiam_Dzpe,SpAD_Dzpe,SpMAD_Dzpe,LogEE_Dzpe,SM1_Dzpe,VE1_Dzpe,VE2_Dzpe,VE3_Dzpe,VR1_Dzpe,VR2_Dzpe,VR3_Dzpe,SpAbs_Dzare,SpMax_Dzare,SpDiam_Dzare,SpAD_Dzare,SpMAD_Dzare,LogEE_Dzare,SM1_Dzare,VE1_Dzare,VE2_Dzare,VE3_Dzare,VR1_Dzare,VR2_Dzare,VR3_Dzare,SpAbs_Dzp,SpMax_Dzp,SpDiam_Dzp,SpAD_Dzp,SpMAD_Dzp,LogEE_Dzp,SM1_Dzp,VE1_Dzp,VE2_Dzp,VE3_Dzp,VR1_Dzp,VR2_Dzp,VR3_Dzp,SpAbs_Dzi,SpMax_Dzi,SpDiam_Dzi,SpAD_Dzi,SpMAD_Dzi,LogEE_Dzi,SM1_Dzi,VE1_Dzi,VE2_Dzi,VE3_Dzi,VR1_Dzi,VR2_Dzi,VR3_Dzi,BertzCT,nBonds,nBondsO,nBondsS,nBondsD,nBondsT,nBondsA,nBondsM,nBondsKS,nBondsKD,RNCG,RPCG,C1SP1,C2SP1,C1SP2,C2SP2,C3SP2,C1SP3,C2SP3,C3SP3,C4SP3,HybRatio,FCSP3,Xch-3d,Xch-4d,Xch-5d,Xch-6d,Xch-7d,Xch-3dv,Xch-4dv,Xch-5dv,Xch-6dv,Xch-7dv,Xc-3d,Xc-4d,Xc-5d,Xc-6d,Xc-3dv,Xc-4dv,Xc-5dv,Xc-6dv,Xpc-4d,Xpc-5d,Xpc-6d,Xpc-4dv,Xpc-5dv,Xpc-6dv,Xp-0d,Xp-1d,Xp-2d,Xp-3d,Xp-4d,Xp-5d,Xp-6d,Xp-7d,AXp-0d,AXp-1d,AXp-2d,AXp-3d,AXp-4d,AXp-5d,AXp-6d,AXp-7d,Xp-0dv,Xp-1dv,Xp-2dv,Xp-3dv,Xp-4dv,Xp-5dv,Xp-6dv,Xp-7dv,AXp-0dv,AXp-1dv,AXp-2dv,AXp-3dv,AXp-4dv,AXp-5dv,AXp-6dv,AXp-7dv,SZ,Sm,Sv,Sse,Spe,Sare,Sp,Si,MZ,Mm,Mv,Mse,Mpe,Mare,Mp,Mi,SpAbs_Dt,SpMax_Dt,SpDiam_Dt,SpAD_Dt,SpMAD_Dt,LogEE_Dt,SM1_Dt,VE1_Dt,VE2_Dt,VE3_Dt,VR1_Dt,VR2_Dt,VR3_Dt,DetourIndex,SpAbs_D,SpMax_D,SpDiam_D,SpAD_D,SpMAD_D,LogEE_D,VE1_D,VE2_D,VE3_D,VR1_D,VR2_D,VR3_D,NsLi,NssBe,NssssBe,NssBH,NsssB,NssssB,NsCH3,NdCH2,NssCH2,NtCH,NdsCH,NaaCH,NsssCH,NddC,NtsC,NdssC,NaasC,NaaaC,NssssC,NsNH3,NsNH2,NssNH2,NdNH,NssNH,NaaNH,NtN,NsssNH,NdsN,NaaN,NsssN,NddsN,NaasN,NssssN,NsOH,NdO,NssO,NaaO,NsF,NsSiH3,NssSiH2,NsssSiH,NssssSi,NsPH2,NssPH,NsssP,NdsssP,NsssssP,NsSH,NdS,NssS,NaaS,NdssS,NddssS,NsCl,NsGeH3,NssGeH2,NsssGeH,NssssGe,NsAsH2,NssAsH,NsssAs,NsssdAs,NsssssAs,NsSeH,NdSe,NssSe,NaaSe,NdssSe,NddssSe,NsBr,NsSnH3,NssSnH2,NsssSnH,NssssSn,NsI,NsPbH3,NssPbH2,NsssPbH,NssssPb,SsLi,SssBe,SssssBe,SssBH,SsssB,SssssB,SsCH3,SdCH2,SssCH2,StCH,SdsCH,SaaCH,SsssCH,SddC,StsC,SdssC,SaasC,SaaaC,SssssC,SsNH3,SsNH2,SssNH2,SdNH,SssNH,SaaNH,StN,SsssNH,SdsN,SaaN,SsssN,SddsN,SaasN,SssssN,SsOH,SdO,SssO,SaaO,SsF,SsSiH3,SssSiH2,SsssSiH,SssssSi,SsPH2,SssPH,SsssP,SdsssP,SsssssP,SsSH,SdS,SssS,SaaS,SdssS,SddssS,SsCl,SsGeH3,SssGeH2,SsssGeH,SssssGe,SsAsH2,SssAsH,SsssAs,SsssdAs,SsssssAs,SsSeH,SdSe,SssSe,SaaSe,SdssSe,SddssSe,SsBr,SsSnH3,SssSnH2,SsssSnH,SssssSn,SsI,SsPbH3,SssPbH2,SsssPbH,SssssPb,MAXsLi,MAXssBe,MAXssssBe,MAXssBH,MAXsssB,MAXssssB,MAXsCH3,MAXdCH2,MAXssCH2,MAXtCH,MAXdsCH,MAXaaCH,MAXsssCH,MAXddC,MAXtsC,MAXdssC,MAXaasC,MAXaaaC,MAXssssC,MAXsNH3,MAXsNH2,MAXssNH2,MAXdNH,MAXssNH,MAXaaNH,MAXtN,MAXsssNH,MAXdsN,MAXaaN,MAXsssN,MAXddsN,MAXaasN,MAXssssN,MAXsOH,MAXdO,MAXssO,MAXaaO,MAXsF,MAXsSiH3,MAXssSiH2,MAXsssSiH,MAXssssSi,MAXsPH2,MAXssPH,MAXsssP,MAXdsssP,MAXsssssP,MAXsSH,MAXdS,MAXssS,MAXaaS,MAXdssS,MAXddssS,MAXsCl,MAXsGeH3,MAXssGeH2,MAXsssGeH,MAXssssGe,MAXsAsH2,MAXssAsH,MAXsssAs,MAXsssdAs,MAXsssssAs,MAXsSeH,MAXdSe,MAXssSe,MAXaaSe,MAXdssSe,MAXddssSe,MAXsBr,MAXsSnH3,MAXssSnH2,MAXsssSnH,MAXssssSn,MAXsI,MAXsPbH3,MAXssPbH2,MAXsssPbH,MAXssssPb,MINsLi,MINssBe,MINssssBe,MINssBH,MINsssB,MINssssB,MINsCH3,MINdCH2,MINssCH2,MINtCH,MINdsCH,MINaaCH,MINsssCH,MINddC,MINtsC,MINdssC,MINaasC,MINaaaC,MINssssC,MINsNH3,MINsNH2,MINssNH2,MINdNH,MINssNH,MINaaNH,MINtN,MINsssNH,MINdsN,MINaaN,MINsssN,MINddsN,MINaasN,MINssssN,MINsOH,MINdO,MINssO,MINaaO,MINsF,MINsSiH3,MINssSiH2,MINsssSiH,MINssssSi,MINsPH2,MINssPH,MINsssP,MINdsssP,MINsssssP,MINsSH,MINdS,MINssS,MINaaS,MINdssS,MINddssS,MINsCl,MINsGeH3,MINssGeH2,MINsssGeH,MINssssGe,MINsAsH2,MINssAsH,MINsssAs,MINsssdAs,MINsssssAs,MINsSeH,MINdSe,MINssSe,MINaaSe,MINdssSe,MINddssSe,MINsBr,MINsSnH3,MINssSnH2,MINsssSnH,MINssssSn,MINsI,MINsPbH3,MINssPbH2,MINsssPbH,MINssssPb,ECIndex,ETA_alpha,AETA_alpha,ETA_shape_p,ETA_shape_y,ETA_shape_x,ETA_beta,AETA_beta,ETA_beta_s,AETA_beta_s,ETA_beta_ns,AETA_beta_ns,ETA_beta_ns_d,AETA_beta_ns_d,ETA_eta,AETA_eta,ETA_eta_L,AETA_eta_L,ETA_eta_R,AETA_eta_R,ETA_eta_RL,AETA_eta_RL,ETA_eta_F,AETA_eta_F,ETA_eta_FL,AETA_eta_FL,ETA_eta_B,AETA_eta_B,ETA_eta_BR,AETA_eta_BR,ETA_dAlpha_A,ETA_dAlpha_B,ETA_epsilon_1,ETA_epsilon_2,ETA_epsilon_3,ETA_epsilon_4,ETA_epsilon_5,ETA_dEpsilon_A,ETA_dEpsilon_B,ETA_dEpsilon_C,ETA_dEpsilon_D,ETA_dBeta,AETA_dBeta,ETA_psi_1,ETA_dPsi_A,ETA_dPsi_B,fragCpx,fMF,nHBAcc,nHBDon,IC0,IC1,IC2,IC3,IC4,IC5,TIC0,TIC1,TIC2,TIC3,TIC4,TIC5,SIC0,SIC1,SIC2,SIC3,SIC4,SIC5,BIC0,BIC1,BIC2,BIC3,BIC4,BIC5,CIC0,CIC1,CIC2,CIC3,CIC4,CIC5,MIC0,MIC1,MIC2,MIC3,MIC4,MIC5,ZMIC0,ZMIC1,ZMIC2,ZMIC3,ZMIC4,ZMIC5,Kier1,Kier2,Kier3,Lipinski,GhoseFilter,FilterItLogS,VMcGowan,LabuteASA,PEOE_VSA1,PEOE_VSA2,PEOE_VSA3,PEOE_VSA4,PEOE_VSA5,PEOE_VSA6,PEOE_VSA7,PEOE_VSA8,PEOE_VSA9,PE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arg is an empty sequence (MAXsLi),max() arg is an empty sequence (MAXssBe),max() arg is an empty sequence (MAXssssBe),max() arg is an empty sequence (MAXssBH),max() arg is an empty sequence (MAXsssB),max() arg is an empty sequence (MAXssssB),2.174390169648106,max() arg is an empty sequence (MAXdCH2),1.0433852985638699,max() arg is an empty sequence (MAXtCH),max() arg is an empty sequence (MAXdsCH),2.0225925925925927,0.6321733539094649,max() arg is an empty sequence (MAXddC),max() arg is an empty sequence (MAXtsC),-0.7716577958343829,1.2697581254724115,max() arg is an empty sequence (MAXaaaC),max() arg is an empty sequence (MAXssssC),max() arg is an empty sequence (MAXsNH3),max() arg is an empty sequence (MAXsNH2),max() arg is an empty sequence (MAXssNH2),max() arg is an empty sequence (MAXdNH),max() arg is an empty sequence (MAXssNH),max() arg is an empty sequence (MAXaaNH),max() arg is an empty sequence (MAXtN),max() arg is an empty sequence (MAXsssNH),max() arg is an empty sequence (MAXdsN),max() arg is an empty sequence (MAXaaN),max() arg is an empty sequence (MAXsssN),max() arg is an empty sequence (MAXddsN),max() arg is an empty sequence (MAXaasN),max() arg is an empty sequence (MAXssssN),8.850157339170236,10.762425070336777,max() arg is an empty sequence (MAXssO),max() arg is an empty sequence (MAXaaO),max() arg is an empty sequence (MAXsF),max() arg is an empty sequence (MAXsSiH3),max() arg is an empty sequence (MAXssSiH2),max() arg is an empty sequence (MAXsssSiH),max() arg is an empty sequence (MAXssssSi),max() arg is an empty sequence (MAXsPH2),max() arg is an empty sequence (MAXssPH),max() arg is an empty sequence (MAXsssP),max() arg is an empty sequence (MAXdsssP),max() arg is an empty sequence (MAXsssssP),max() arg is an empty sequence (MAXsSH),max() arg is an empty sequence (MAXdS),max() arg is an empty sequence (MAXssS),max() arg is an empty sequence (MAXaaS),max() arg is an empty sequence (MAXdssS),max() arg is an empty sequence (MAXddssS),max() arg is an empty sequence (MAXsCl),max() arg is an empty sequence (MAXsGeH3),max() arg is an empty sequence (MAXssGeH2),max() arg is an empty sequence (MAXsssGeH),max() arg is an empty sequence (MAXssssGe),max() arg is an empty sequence (MAXsAsH2),max() arg is an empty sequence (MAXssAsH),max() arg is an empty sequence (MAXsssAs),max() arg is an empty sequence (MAXsssdAs),max() arg is an empty sequence (MAXsssssAs),max() arg is an empty sequence (MAXsSeH),max() arg is an empty sequence (MAXdSe),max() arg is an empty sequence (MAXssSe),max() arg is an empty sequence (MAXaaSe),max() arg is an empty sequence (MAXdssSe),max() arg is an empty sequence (MAXddssSe),max() arg is an empty sequence (MAXsBr),max() arg is an empty sequence (MAXsSnH3),max() arg is an empty sequence (MAXssSnH2),max() arg is an empty sequence (MAXsssSnH),max() arg is an empty sequence (MAXssssSn),max() arg is an empty sequence (MAXsI),max() arg is an empty sequence (MAXsPbH3),max() arg is an empty sequence (MAXssPbH2),max() arg is an empty sequence (MAXsssPbH),max() arg is an empty sequence (MAXssssPb),min() arg is an empty sequence (MINsLi),min() arg is an empty sequence (MINssBe),min() arg is an empty sequence (MINssssBe),min() arg is an empty sequence (MINssBH),min() arg is an empty sequence (MINsssB),min() arg is an empty sequence (MINssssB),1.7081207482993197,min() arg is an empty sequence (MINdCH2),1.0433852985638699,min() arg is an empty sequence (MINtCH),min() arg is an empty sequence (MINdsCH),1.9131944444444444,-0.4184259259259262,min() arg is an empty sequence (MINddC),min() arg is an empty sequence (MINtsC),-0.7716577958343829,0.8703760393046109,min() arg is an empty sequence (MINaaaC),min() arg is an empty sequence (MINssssC),min() arg is an empty sequence (MINsNH3),min() arg is an empty sequence (MINsNH2),min() arg is an empty sequence (MINssNH2),min() arg is an empty sequence (MINdNH),min() arg is an empty sequence (MINssNH),min() arg is an empty sequence (MINaaNH),min() arg is an empty sequence (MINtN),min() arg is an empty sequence (MINsssNH),min() arg is an empty sequence (MINdsN),min() arg is an empty sequence (MINaaN),min() arg is an empty sequence (MINsssN),min() arg is an empty sequence (MINddsN),min() arg is an empty sequence (MINaasN),min() arg is an empty sequence (MINssssN),8.850157339170236,10.762425070336777,min() arg is an empty sequence (MINssO),min() arg is an empty sequence (MINaaO),min() arg is an empty sequence (MINsF),min() arg is an empty sequence (MINsSiH3),min() arg is an empty sequence (MINssSiH2),min() arg is an empty sequence (MINsssSiH),min() arg is an empty sequence (MINssssSi),min() arg is an empty sequence (MINsPH2),min() arg is an empty sequence (MINssPH),min() arg is an empty sequence (MINsssP),min() arg is an empty sequence (MINdsssP),min() arg is an empty sequence (MINsssssP),min() arg is an empty sequence (MINsSH),min() arg is an empty sequence (MINdS),min() arg is an empty sequence (MINssS),min() arg is an empty sequence (MINaaS),min() arg is an empty sequence (MINdssS),min() arg is an empty sequence (MINddssS),min() arg is an empty sequence (MINsCl),min() arg is an empty sequence (MINsGeH3),min() arg is an empty sequence (MINssGeH2),min() arg is an empty sequence (MINsssGeH),min() arg is an empty sequence (MINssssGe),min() arg is an empty sequence (MINsAsH2),min() arg is an empty sequence (MINssAsH),min() arg is an empty sequence (MINsssAs),min() arg is an empty sequence (MINsssdAs),min() arg is an empty sequence (MINsssssAs),min() arg is an empty sequence (MINsSeH),min() arg is an empty sequence (MINdSe),min() arg is an empty sequence (MINssSe),min() arg is an empty sequence (MINaaSe),min() arg is an empty sequence (MINdssSe),min() arg is an empty sequence (MINddssSe),min() arg is an empty sequence (MINsBr),min() arg is an empty sequence (MINsSnH3),min() arg is an empty sequence (MINssSnH2),min() arg is an empty sequence (MINsssSnH),min() arg is an empty sequence (MINssssSn),min() arg is an empty sequence (MINsI),min() arg is an empty sequence (MINsPbH3),min() arg is an empty sequence (MINssPbH2),min() arg is an empty sequence (MINsssPbH),min() arg is an empty sequence (MINssssPb),203,7.166666666666666,0.47777777777777775,0.3023255813953488,0.3488372093023256,0.0,15.5,1.0333333333333334,8.0,0.5333333333333333,7.5,0.5,0.0,0.0,12.48483593933584,0.8323223959557227,4.191997762428997,0.27946651749526646,21.854726941491926,1.4569817960994618,7.002907755397974,0.4668605170265316,9.369891002156086,0.6246594001437391,2.810909992968977,0.18739399953126512,0.411305806975121,0.02742038713167473,0.49730580697512095,0.033153720465008064,0.0,0.02222222222222226,0.5282828282828286,0.8022222222222222,0.43333333333333374,0.4931623931623936,0.7708333333333334,0.09494949494949484,0.035120435120435,-0.05982905982905984,0.0313888888888888,-0.5,-0.03333333333333333,0.5955678670360111,0.11843213296398891,0.0,15.02,0.18181818181818182,1,1,1.251534532637368,2.897103093964585,3.6950206341166107,4.187889194919351,4.309101316131471,4.309101316131471,41.30063957703314,95.60440210083131,121.93568092584816,138.2003434323386,142.20034343233854,142.20034343233854,0.24810403450326324,0.5743213209385469,0.7325003849196747,0.830206580974281,0.8542356552979852,0.8542356552979852,0.24024296692907762,0.5561242016444868,0.7092914313228528,0.8039018493860223,0.8271695730231808,0.8271695730231808,3.7928595867210855,2.1472910253938684,1.3493734852418426,0.8565049244391023,0.7352928032269821,0.7352928032269821,10.761453417454081,24.448706819904615,28.172099433296182,30.002607912282308,30.12478973046413,30.12478973046413,53.80358693511226,32.08470788904832,24.715887842819726,21.03170034185004,20.662682872836896,20.662682872836896,13.066666666666666,5.915,4.1652892561983474,True,True,-2.8349605974739616,177.70999999999967,90.94175377251301,5.106527394840706,4.794537184071822,0.0,0.0,0.0,38.112942673227685,30.38936785217202,0.0,5.917906046161393,0.0,0.0,0.0,0.0,9.901064578912528,0.0,0.0,5.917906046161393,33.10993926815928,0.0,35.392371257240434,0.0,0.0,0.0,11.075832682792555,11.21535880699783,5.917906046161393,37.81602062862726,24.26546827384644,0.0,0.0,0.0,0.0,0.0,11.887211334113243,0.0,5.917906046161393,11.984273114623004,5.563451491696996,6.923737199690624,24.26546827384644,13.847474399381248,5.106527394840706,4.794537184071822,0.0,10.762425070336777,8.850157339170236,2.1401341647770225,-0.5579103678508441,7.871574074074074,1.0433852985638699,6.056901087595532,0.0,0.5952753944880748,3.919629443022255,4.290961840741611,invalid value encountered in scalar divide (MDEC-14),4.883593419305869,10.756893283700741,invalid value encountered in scalar divide (MDEC-24),3.3865457448640486,invalid value encountered in scalar divide (MDEC-34),invalid value encountered in scalar divide (MDEC-44),0.5000000000000001,invalid value encountered in scalar divide (MDEO-12),invalid value encountered in scalar divide (MDEO-22),invalid value encountered in scalar divide (MDEN-11),invalid value encountered in scalar divide (MDEN-12),invalid value encountered in scalar divide (MDEN-13),invalid value encountered in scalar divide (MDEN-22),invalid value encountered in scalar divide (MDEN-23),invalid value encountered in scalar divide 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,0.005040239522743267,29.0,27.585713096328366,26.254550580093632,42.184996358339404,41.02352941176471,41.7,27.002084431137728,46.82119757022459,0.7073170731707317,0.6728222706421553,0.6403548921974056,1.0289023502034,1.0005738880918222,1.0170731707317073,0.6585874251497007,1.1419804285420632,465.1904335772628,232.59521678863135,323.8329514760923,465.1904335772627,19.382934732385944,232.59521678863135,0.0,4.8598663492379455,0.20249443121824773,2.456479674731365,138.8989836522996,5.78745765217915,5.809215669969355,2742,197.87210287590256,98.93605143795126,139.7749302682236,197.87210287590253,8.244670953162606,98.93605143795126,4.824511450491091,0.2010213104371288,2.449178213234109,145.06115583879543,6.044214826616476,5.852624155262354,0,0,0,0,0,0,2,0,1,0,0,3,3,0,1,0,2,1,2,0,1,0,0,0,0,1,0,0,2,0,0,1,0,1,0,3,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,3.5243850256151843,0,-0.28723466238347184,0,0.0,4.729409919060217,-1.944922996976571,0,2.204554043839758,0.0,0.7526528643864956,0.5628694255479971,-2.3524289021164018,0,5.864547508818342,0,0,0,0,9.96752314814815,0,0,8.119213986520535,0.0,0,1.510959939531368,0,9.643577937347779,0.0,17.70489276266062,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,max() arg is an empty sequence (MAXsLi),max() arg is an empty sequence (MAXssBe),max() arg is an empty sequence (MAXssssBe),max() arg is an empty sequence (MAXssBH),max() arg is an empty sequence (MAXsssB),max() arg is an empty sequence (MAXssssB),1.7621925128075921,max() arg is an empty sequence (MAXdCH2),-0.28723466238347184,max() arg is an empty sequence (MAXtCH),max() arg is an empty sequence (MAXdsCH),1.7176062925170068,-0.5607553854875291,max() arg is an empty sequence (MAXddC),2.204554043839758,max() arg is an empty sequence (MAXdssC),0.45958333333333345,0.5628694255479971,-0.879257605820106,max() arg is an empty sequence (MAXsNH3),5.864547508818342,max() arg is an empty sequence (MAXssNH2),max() arg is an empty sequence (MAXdNH),max() arg is an empty sequence (MAXssNH),max() arg is an empty sequence (MAXaaNH),9.96752314814815,max() arg is an empty sequence (MAXsssNH),max() arg is an empty sequence (MAXdsN),4.176539115646259,max() arg is an empty sequence (MAXsssN),max() arg is an empty sequence (MAXddsN),1.510959939531368,max() arg is an empty sequence (MAXssssN),9.643577937347779,max() arg is an empty sequence (MAXdO),5.945804988662131,max() arg is an empty sequence (MAXaaO),max() arg is an empty sequence (MAXsF),max() arg is an empty sequence (MAXsSiH3),max() arg is an empty sequence (MAXssSiH2),max() arg is an empty sequence (MAXsssSiH),max() arg is an empty sequence (MAXssssSi),max() arg is an empty sequence (MAXsPH2),max() arg is an empty sequence (MAXssPH),max() arg is an empty sequence (MAXsssP),max() arg is an empty sequence (MAXdsssP),max() arg is an empty sequence (MAXsssssP),max() arg is an empty sequence (MAXsSH),max() arg is an empty sequence (MAXdS),max() arg is an empty sequence (MAXssS),max() arg is an empty sequence (MAXaaS),max() arg is an empty sequence (MAXdssS),max() arg is an empty sequence (MAXddssS),max() arg is an empty sequence (MAXsCl),max() arg is an empty sequence (MAXsGeH3),max() arg is an empty sequence (MAXssGeH2),max() arg is an empty sequence (MAXsssGeH),max() arg is an empty sequence (MAXssssGe),max() arg is an empty sequence (MAXsAsH2),max() arg is an empty sequence (MAXssAsH),max() arg is an empty sequence (MAXsssAs),max() arg is an empty sequence (MAXsssdAs),max() arg is an empty sequence (MAXsssssAs),max() arg is an empty sequence (MAXsSeH),max() arg is an empty sequence (MAXdSe),max() arg is an empty sequence (MAXssSe),max() arg is an empty sequence (MAXaaSe),max() arg is an empty sequence (MAXdssSe),max() arg is an empty sequence (MAXddssSe),max() arg is an empty sequence (MAXsBr),max() arg is an empty sequence (MAXsSnH3),max() arg is an empty sequence (MAXssSnH2),max() arg is an empty sequence (MAXsssSnH),max() arg is an empty sequence (MAXssssSn),max() arg is an empty sequence (MAXsI),max() arg is an empty sequence (MAXsPbH3),max() arg is an empty sequence (MAXssPbH2),max() arg is an empty sequence (MAXsssPbH),max() arg is an empty sequence (MAXssssPb),min() arg is an empty sequence (MINsLi),min() arg is an empty sequence (MINssBe),min() arg is an empty sequence (MINssssBe),min() arg is an empty sequence (MINssBH),min() arg is an empty sequence (MINsssB),min() arg is an empty sequence (MINssssB),1.7621925128075921,min() arg is an empty sequence (MINdCH2),-0.28723466238347184,min() arg is an empty sequence (MINtCH),min() arg is an empty sequence (MINdsCH),1.3083436870118417,-0.7046853741496608,min() arg is an empty sequence (MINddC),2.204554043839758,min() arg is an empty sequence (MINdssC),0.29306953105316214,0.5628694255479971,-1.4731712962962957,min() arg is an empty sequence (MINsNH3),5.864547508818342,min() arg is an empty sequence (MINssNH2),min() arg is an empty sequence (MINdNH),min() arg is an empty sequence (MINssNH),min() arg is an empty sequence (MINaaNH),9.96752314814815,min() arg is an empty sequence (MINsssNH),min() arg is an empty sequence (MINdsN),3.9426748708742756,min() arg is an empty sequence (MINsssN),min() arg is an empty sequence (MINddsN),1.510959939531368,min() arg is an empty sequence (MINssssN),9.643577937347779,min() arg is an empty sequence (MINdO),5.842143329554044,min() arg is an empty sequence (MINaaO),min() arg is an empty sequence (MINsF),min() arg is an empty sequence (MINsSiH3),min() arg is an empty sequence (MINssSiH2),min() arg is an empty sequence (MINsssSiH),min() arg is an empty sequence (MINssssSi),min() arg is an empty sequence (MINsPH2),min() arg is an empty sequence (MINssPH),min() arg is an empty sequence (MINsssP),min() arg is an empty sequence (MINdsssP),min() arg is an empty sequence (MINsssssP),min() arg is an empty sequence (MINsSH),min() arg is an empty sequence (MINdS),min() arg is an empty sequence (MINssS),min() arg is an empty sequence (MINaaS),min() arg is an empty sequence (MINdssS),min() arg is an empty sequence (MINddssS),min() arg is an empty sequence (MINsCl),min() arg is an empty sequence (MINsGeH3),min() arg is an empty sequence (MINssGeH2),min() arg is an empty sequence (MINsssGeH),min() arg is an empty sequence (MINssssGe),min() arg is an empty sequence (MINsAsH2),min() arg is an empty sequence (MINssAsH),min() arg is an empty sequence (MINsssAs),min() arg is an empty sequence (MINsssdAs),min() arg is an empty sequence (MINsssssAs),min() arg is an empty sequence (MINsSeH),min() arg is an empty sequence (MINdSe),min() arg is an empty sequence (MINssSe),min() arg is an empty sequence (MINaaSe),min() arg is an empty sequence (MINdssSe),min() arg is an empty sequence (MINddssSe),min() arg is an empty sequence (MINsBr),min() arg is an empty sequence (MINsSnH3),min() arg is an empty sequence (MINssSnH2),min() arg is an empty sequence (MINsssSnH),min() arg is an empty sequence (MINssssSn),min() arg is an empty sequence (MINsI),min() arg is an empty sequence (MINsPbH3),min() arg is an empty sequence (MINssPbH2),min() arg is an empty sequence (MINsssPbH),min() arg is an empty sequence (MINssssPb),377,10.833333333333336,0.451388888888889,0.19692307692307687,0.3138461538461538,0.09230769230769229,28.5,1.1875,17.0,0.7083333333333334,11.5,0.4791666666666667,0.5,0.020833333333333332,22.19055230252901,0.9246063459387087,5.980461338971172,0.24918588912379883,44.41371938268186,1.8505716409450776,11.415780653503013,0.4756575272292922,22.22316708015285,0.9259652950063688,5.435319314531841,0.2264716381054934,0.4984329088700825,0.02076803786958677,0.8424329088700825,0.035101371202920104,0.0,0.048611111111111015,0.6577235772357725,0.9111111111111109,0.4454545454545458,0.6259259259259261,0.8432098765432097,0.21226903178122664,0.03179765130984635,-0.18047138047138028,0.0679012345679012,-5.5,-0.22916666666666666,0.49542682926829296,0.218573170731707,0.0,177.09,0.4146341463414634,9,2,1.7551162068175872,3.9351517531180673,4.61938950445978,4.8329233459759635,4.8329233459759635,4.8329233459759635,71.95976447952107,161.34122187784075,189.39496968285096,198.1498571850145,198.1498571850145,198.1498571850145,0.32759667200705067,0.7345055633106424,0.8622201894592856,0.9020767958593957,0.9020767958593957,0.9020767958593957,0.31097819430577006,0.6972452204305971,0.8184810790942856,0.8563158208623439,0.8563158208623439,0.8563158208623439,3.6024357978004966,1.4224002515000165,0.7381625001583041,0.5246286586421203,0.5246286586421203,0.5246286586421203,17.331523884468485,37.77397359680218,41.283747341160414,42.230257746091645,42.230257746091645,42.230257746091645,80.15730515049225,35.57218630231133,27.60778967303318,25.697629048536992,25.697629048536992,25.697629048536992,17.415637860082306,6.020551649540292,2.560846560846561,True,True,-1.4518700554315402,226.34999999999968,137.0974695867162,25.050783733403037,0.0,9.499376414562832,10.360573363039524,0.0,0.0,25.980208536304467,0.0,12.300809959361379,36.225141268417985,11.604973930405624,5.601050810983688,0.0,19.31711625624085,5.261891554738487,14.59805822286387,0.0,43.54753552618044,12.340549441675103,24.15398220653622,0.0,6.069221312792274,5.733667477162185,50.410477898032994,19.811639672383833,11.33111286753076,19.54140239422971,18.460054211687762,0.0,5.516700717616262,0.0,5.817862777835028,0.0,29.70006112679919,6.606881964512918,17.02849149029975,0.0,10.842717968380164,25.980208536304467,0.0,16.151881642040518,19.944256338562333,10.368418949579192,19.215852702191988,3.9426748708742756,23.78764020114219,5.413828971403377,-0.5861880747669439,5.625620275888133,-0.6365793099647292,3.2371503632317125,0.0,0.5000000000000001,1.641134377013993,2.581890526620734,2.0000000000000004,2.566521744367867,9.90896370039048,2.8948950430168665,5.454766633798686,4.6100283797291635,0.33333333333333326,invalid value encountered in scalar divide (MDEO-11),0.7663094323935531,1.1447142425533319,0.1428571428571429,0.9778460448698022,0.5773502691896258,0.5000000000000001,1.1547005383792512,invalid value encountered in scalar divide (MDEN-33),49.24755144913952,2.0519813103808136,17.747549095653753,0.7394812123189064,31.50000235348577,1.312500098061907,9.865052336171944,0.41104384734049765,7.882496759481807,0.32843736497840864,0.0,0.0,43,63,94,124,148,167,180,182,175,1227,3.5553480614894135,4.162781723775329,4.794756953773458,5.423020845048994,5.907573297454596,6.304591616720791,6.68227501530585,7.0261735295134935,7.118104835059406,7.289178474207282,8.6993317887658,45.09348099999999,25.112519,4,0,0,3,1,0,0,0,0,0,0,0,4,0,0,3,1,0,0,0,0,0,0,0,2,0,0,1,1,0,0,0,0,0,0,0,2,0,0,1,1,0,0,0,0,0,0,0,2,0,0,2,0,0,0,0,0,0,0,0,2,0,0,2,0,0,0,0,0,0,0,0,2,0,0,0,0,1,1,0,0,0,0,2,0,0,0,0,1,1,0,0,0,0,1,0,0,0,0,0,1,0,0,0,0,1,0,0,0,0,0,1,0,0,0,0,1,0,0,0,0,1,0,0,0,0,0,1,0,0,0,0,1,0,0,0,0,0,2,0.07407407407407407,-0.05842000000000025,80.47420000000001,127.92,127.92,7.0,4.444444444444445,3.368055555555556,2.4133333333333336,1.403611111111111,0.6295691609977323,0.4480229591836735,0.2121519904257999,0.046875,0.0,0.25925925925925924,0.103359173126615,0.07484567901234568,0.053629629629629624,0.034234417344173436,0.018516740029345065,0.019479259094942324,0.017679332535483327,0.0078125,0.0,0.5888159900317937,9,5,0.8,0.4444444444444444,271.0963586227447,5.754887502163468,27.0,4.948759890378168,5.8664680569332965,6.834108738813838,7.780303087908373,8.751949058058614,9.708749225727084,10.680631153000125,11.642786379624626,12.614383700088258,129.8281392905324,4.007333185232471,0.0,5.424950017481403,3.4339872044851463,7.039660349862076,5.937536205082426,8.74687531957003,8.163656176168432,10.50821327149517,77.26221172937716,331.12805402400045,8.076294000585376,1148,45,140.0,176.0,8.402777777777779,5.1388888888888875 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,0.0921274921834177,0.05148849607435126,0.028475042654195527,0.016275833098697887,0.009067760840932713,28.0,26.256681375405876,27.30635192346835,44.308084486525864,42.705882352941174,43.30800000000001,28.964462874251502,49.48882383240233,0.6363636363636364,0.5967427585319517,0.6205989073515533,1.0070019201483151,0.9705882352941176,0.9842727272727274,0.6582832471420796,1.124745996190962,753.4275273415424,364.5833541184087,418.6370383792177,753.4275273415426,32.75771858006707,364.5833541184087,0.0,4.792690053810906,0.20837782842656113,2.4000009745936994,130.63489269662284,5.679777943331428,5.705315476349201,4187,176.86722231827474,88.43361115913737,123.62514821251128,176.86722231827477,7.689879231229338,88.43361115913737,4.727024222786804,0.20552279229507844,2.386204999079764,139.5125579785658,6.065763390372426,5.771063741496572,0,0,0,0,0,0,1,0,6,0,1,2,2,0,0,1,4,0,1,0,0,0,0,0,0,0,0,0,0,1,0,0,0,1,0,3,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1.6495510256571766,0,5.573638825900731,0,2.1756117724867723,4.187114984882841,-0.5928042328042331,0,0.0,0.7013118858654573,4.072187211304275,0.0,-0.12132133408919121,0,0.0,0,0,0,0,0.0,0,0,0.0,2.5275139361300076,0,0.0,0,10.95427059712774,0.0,16.62292532753842,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,max() arg is an empty sequence (MAXsLi),max() arg is an empty sequence (MAXssBe),max() arg is an empty sequence (MAXssssBe),max() arg is an empty sequence (MAXssBH),max() arg is an empty sequence (MAXsssB),max() arg is an empty sequence (MAXssssB),1.6495510256571766,max() arg is an empty sequence (MAXdCH2),1.1632930996472663,max() arg is an empty sequence (MAXtCH),2.1756117724867723,2.1022307256235826,0.006435185185184933,max() arg is an empty sequence (MAXddC),max() arg is an empty sequence (MAXtsC),0.7013118858654573,1.2618778344671204,max() arg is an empty sequence (MAXaaaC),-0.12132133408919121,max() arg is an empty sequence (MAXsNH3),max() arg is an empty sequence (MAXsNH2),max() arg is an empty sequence (MAXssNH2),max() arg is an empty sequence (MAXdNH),max() arg is an empty sequence (MAXssNH),max() arg is an empty sequence (MAXaaNH),max() arg is an empty sequence (MAXtN),max() arg is an empty sequence (MAXsssNH),max() arg is an empty sequence (MAXdsN),max() arg is an empty sequence (MAXaaN),2.5275139361300076,max() arg is an empty sequence (MAXddsN),max() arg is an empty sequence (MAXaasN),max() arg is an empty sequence (MAXssssN),10.95427059712774,max() arg is an empty sequence (MAXdO),5.585547996976569,max() arg is an empty sequence (MAXaaO),max() arg is an empty sequence (MAXsF),max() arg is an empty sequence (MAXsSiH3),max() arg is an empty sequence (MAXssSiH2),max() arg is an empty sequence (MAXsssSiH),max() arg is an empty sequence (MAXssssSi),max() arg is an empty sequence (MAXsPH2),max() arg is an empty sequence (MAXssPH),max() arg is an empty sequence (MAXsssP),max() arg is an empty sequence (MAXdsssP),max() arg is an empty sequence (MAXsssssP),max() arg is an empty sequence (MAXsSH),max() arg is an empty sequence (MAXdS),max() arg is an empty sequence (MAXssS),max() arg is an empty sequence (MAXaaS),max() arg is an empty sequence (MAXdssS),max() arg is an empty sequence (MAXddssS),max() arg is an empty sequence (MAXsCl),max() arg is an empty sequence (MAXsGeH3),max() arg is an empty sequence (MAXssGeH2),max() arg is an empty sequence (MAXsssGeH),max() arg is an empty sequence (MAXssssGe),max() arg is an empty sequence (MAXsAsH2),max() arg is an empty sequence (MAXssAsH),max() arg is an empty sequence (MAXsssAs),max() arg is an empty sequence (MAXsssdAs),max() arg is an empty sequence (MAXsssssAs),max() arg is an empty sequence (MAXsSeH),max() arg is an empty sequence (MAXdSe),max() arg is an empty sequence (MAXssSe),max() arg is an empty sequence (MAXaaSe),max() arg is an empty sequence (MAXdssSe),max() arg is an empty sequence (MAXddssSe),max() arg is an empty sequence (MAXsBr),max() arg is an empty sequence (MAXsSnH3),max() arg is an empty sequence (MAXssSnH2),max() arg is an empty sequence (MAXsssSnH),max() arg is an empty sequence (MAXssssSn),max() arg is an empty sequence (MAXsI),max() arg is an empty sequence (MAXsPbH3),max() arg is an empty sequence (MAXssPbH2),max() arg is an empty sequence (MAXsssPbH),max() arg is an empty sequence (MAXssssPb),min() arg is an empty sequence (MINsLi),min() arg is an empty sequence (MINssBe),min() arg is an empty sequence (MINssssBe),min() arg is an empty sequence (MINssBH),min() arg is an empty sequence (MINsssB),min() arg is an empty sequence (MINssssB),1.6495510256571766,min() arg is an empty sequence (MINdCH2),0.28202963592844554,min() arg is an empty sequence (MINtCH),2.1756117724867723,2.084884259259259,-0.599239417989418,min() arg is an empty sequence (MINddC),min() arg is an empty sequence (MINtsC),0.7013118858654573,0.7948275699168558,min() arg is an empty sequence (MINaaaC),-0.12132133408919121,min() arg is an empty sequence (MINsNH3),min() arg is an empty sequence (MINsNH2),min() arg is an empty sequence (MINssNH2),min() arg is an empty sequence (MINdNH),min() arg is an empty sequence (MINssNH),min() arg is an empty sequence (MINaaNH),min() arg is an empty sequence (MINtN),min() arg is an empty sequence (MINsssNH),min() arg is an empty sequence (MINdsN),min() arg is an empty sequence (MINaaN),2.5275139361300076,min() arg is an empty sequence (MINddsN),min() arg is an empty sequence (MINaasN),min() arg is an empty sequence (MINssssN),10.95427059712774,min() arg is an empty sequence (MINdO),5.4953057287729905,min() arg is an empty sequence (MINaaO),min() arg is an empty sequence (MINsF),min() arg is an empty sequence (MINsSiH3),min() arg is an empty sequence (MINssSiH2),min() arg is an empty sequence (MINsssSiH),min() arg is an empty sequence (MINssssSi),min() arg is an empty sequence (MINsPH2),min() arg is an empty sequence (MINssPH),min() arg is an empty sequence (MINsssP),min() arg is an empty sequence (MINdsssP),min() arg is an empty sequence (MINsssssP),min() arg is an empty sequence (MINsSH),min() arg is an empty sequence (MINdS),min() arg is an empty sequence (MINssS),min() arg is an empty sequence (MINaaS),min() arg is an empty sequence (MINdssS),min() arg is an empty sequence (MINddssS),min() arg is an empty sequence (MINsCl),min() arg is an empty sequence (MINsGeH3),min() arg is an empty sequence (MINssGeH2),min() arg is an empty sequence (MINsssGeH),min() arg is an empty sequence (MINssssGe),min() arg is an empty sequence (MINsAsH2),min() arg is an empty sequence (MINssAsH),min() arg is an empty sequence (MINsssAs),min() arg is an empty sequence (MINsssdAs),min() arg is an empty sequence (MINsssssAs),min() arg is an empty sequence (MINsSeH),min() arg is an empty sequence (MINdSe),min() arg is an empty sequence (MINssSe),min() arg is an empty sequence (MINaaSe),min() arg is an empty sequence (MINdssSe),min() arg is an empty sequence (MINddssSe),min() arg is an empty sequence (MINsBr),min() arg is an empty sequence (MINsSnH3),min() arg is an empty sequence (MINssSnH2),min() arg is an empty sequence (MINsssSnH),min() arg is an empty sequence (MINssssSn),min() arg is an empty sequence (MINsI),min() arg is an empty sequence (MINsPbH3),min() arg is an empty sequence (MINssPbH2),min() arg is an empty sequence (MINsssPbH),min() arg is an empty sequence (MINssssPb),373,10.733333333333336,0.4666666666666668,0.07763975155279501,0.36335403726708065,0.04658385093167701,23.0,1.0,16.0,0.6956521739130435,7.0,0.30434782608695654,0.0,0.0,24.143798110400706,1.0497303526261177,6.9167228228429645,0.3007270792540419,39.84728843744658,1.7324908016281122,11.226311962521509,0.4881005201096308,15.703490327045873,0.6827604490019945,4.309589139678544,0.18737344085558888,0.18790159985158716,0.008169634776155964,0.6179015998515871,0.026865286950069005,0.0,0.033333333333333215,0.587878787878788,0.8507246376811589,0.4508196721311479,0.5435897435897438,0.8277777777777774,0.13705911574764013,0.04428904428904423,-0.09277007145859589,0.022946859903381522,-9.0,-0.391304347826087,0.5485519591141401,0.16544804088585985,0.0,223.05,0.45454545454545453,5,1,1.4754017117210338,3.4367806344195087,4.715002357224489,4.987729629951763,5.078638720860853,5.078638720860853,64.91767531572549,151.21834791445838,207.46010371787753,219.46010371787756,223.46010371787756,223.46010371787756,0.27024822633263457,0.6295125343611039,0.8636434498288265,0.9135987000779994,0.9302504501610569,0.9302504501610569,0.2588224390875869,0.6028974613102723,0.8271295883051716,0.8749727874638865,0.8909205205167915,0.8909205205167915,3.9840299069162635,2.0226509842177887,0.7444292614128081,0.4717019886855347,0.3807928977764439,0.3807928977764439,13.61903339706409,32.97082625320604,36.698285534905565,38.15474008036011,38.74651280763283,38.74651280763283,78.6004884708341,36.2469634783023,26.405378464568418,23.30958320956748,22.208854967273798,22.208854967273798,15.270233196159122,5.5,2.0828402366863905,True,True,-2.7659525213926814,226.43999999999983,134.9924839568751,19.31711625624085,4.899909730850478,0.0,0.0,0.0,0.0,55.14287850184169,12.462662452073968,12.648722793660879,11.86313125940448,11.49902366656781,6.792942306099827,0.0,19.31711625624085,0.0,4.899909730850478,0.0,36.82326255507107,26.992252659202514,35.09482209880727,0.0,11.49902366656781,9.473725907600098,48.641581425025336,11.157684576726059,0.0,29.8864522754074,23.967919115413277,0.0,0.0,0.0,0.0,11.49902366656781,6.103966387748303,18.249773604644567,5.759164871656176,43.85100134717099,11.126902983393991,7.109797541277533,0.0,23.108663974607577,14.210588861400147,5.106527394840706,16.62292532753842,2.5275139361300076,10.95427059712774,2.329862055933485,2.3287508923322413,4.187114984882841,4.783879125724364,2.3661320546737215,1.6495510256571766,invalid value encountered in scalar divide (MDEC-11),1.5271939424071668,1.5387445816369196,0.25,10.468324070317584,19.975728992099004,3.931112091313345,8.857542075624217,2.897767768634503,invalid value encountered in scalar divide (MDEC-44),invalid value encountered in scalar divide (MDEO-11),0.5984084805885753,0.6223699000246825,invalid value encountered in scalar divide (MDEN-11),invalid value encountered in scalar divide (MDEN-12),invalid value encountered in scalar divide (MDEN-13),invalid value encountered in scalar divide (MDEN-22),invalid value encountered in scalar divide (MDEN-23),invalid value encountered in scalar divide (MDEN-33),48.6599792138611,2.115651270167874,10.063575374270597,0.4375467554030694,38.596403839590494,1.6781045147648042,2.266710763957403,0.09855264191119142,7.796864610313193,0.33899411349187797,0.0,0.0,42,65,97,128,164,200,243,281,306,1576,3.4657359027997265,4.051784947803305,4.646791860678911,5.208802859340288,5.715587520105964,6.0690041245634,6.421520636625984,6.778749345289831,7.042340803314556,7.282224093820084,8.5599892362165,48.370652999999976,27.985346999999997,5,0,0,3,1,1,0,0,0,0,0,0,3,0,0,2,0,1,0,0,0,0,0,0,1,0,0,0,1,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,4,0,0,3,0,1,0,0,0,0,0,0,3,0,0,2,0,1,0,0,0,0,0,0,1,0,0,0,0,0,0,0,0,0,1,1,0,0,0,0,0,0,0,0,0,1,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1,0,0,0,0,0,0,0,0,0,1,1,0,0,0,0,0,0,0,0,0,1,1,0.037037037037037035,1.7944,83.64680000000004,51.16000000000001,51.16000000000001,5.0,3.7777777777777795,2.6805555555555554,2.0694444444444446,0.851388888888889,0.6220861678004536,0.22487953514739226,0.061224489795918366,0.024691358024691357,0.0,0.18518518518518517,0.08994708994708997,0.057033096926713954,0.04598765432098766,0.023010510510510507,0.022217363135730483,0.012493307508188459,0.008746355685131196,0.012345679012345678,0.0,0.4569662422318831,9,5,0.8,0.4444444444444444,282.8137308511791,5.754887502163468,27.0,4.9344739331306915,5.8664680569332965,6.821107472256465,7.773594467360194,8.73568594451502,9.69467827290507,10.659351282951539,11.621286474640293,12.587173337185721,128.6938192418783,4.007333185232471,0.0,5.407171771460119,3.4339872044851463,7.007600613951853,5.8998973535824915,8.705993714307901,8.094683648698815,10.46296047312364,76.01962796484244,315.14705815200057,7.162433139818194,985,47,138.0,176.0,5.951388888888888,4.8888888888888875