SQLite format 3@ %-|WtableframeframeCREATE TABLE frame ( id INTEGER PRIMARY KEY, sid INTEGER NOT NULL DEFAULT 0 ) etablestructurestructureCREATE TABLE structure ( id INTEGER PRIMARY KEY, cellparameters VARCHAR(512) NOT NULL DEFAULT '', formula VARCHAR(512) NOT NULL DEFAULT '', name VARCHAR(256) NOT NULL DEFAULT '', natoms INTEGER NOT NULL DEFAULT 0, symmetry VARCHAR(16) NOT NULL DEFAULT '', tsstring BLOB NOT NULL DEFAULT '' )3ItableinfoinfoCREATE TABLE info ( id INTEGER PRIMARY KEY, item VARCHAR(512) NOT NULL DEFAULT '', value BLOB NOT NULL DEF # description-'Edate_creationThu May 18 20:13:30 CST 2023  C-WP9.60183 16.0556 23 90 90 90K8Mg8S8Cl8O54H44Kainite_XRD_1.cif_P1 (1 0 0) surfaceP1x[]m} T%y&,Se*V%rW]b`fn߾iwu`F_p$=~}~ݏ߫J/"O>}{Ç_??~xo^ϻOw/͋wO/>}|_oM}} S_o?.̲B~7/Ow4lNo>|ϷϷ7:g4ȹJ%J:RTgVEmUz_0PZLHUk>i4(1:JhaGo=ib!I68V{k ;KV^ gqGZ{w˓Q{hypnePkf4Ŕ 7$Bc[Uc)FJ\po4Pq1 Our@@8lma ʸ߰DxȎ5j-5tlz$DѰOCK u,͟K˚*P&j crM8G3b:B\A=p61P}KJ +~Zt/X#N a-}۴;IadSWkX-7aB 8rer1q +A?*n  @ #G 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etablestructurestructureCREATE TABLE structure ( id INTEGER PRIMARY KEY, cellparameters VARCHAR(512) NOT NULL DEFAULT '', formula VARCHAR(512) NOT NULL DEFAULT '', name VARCHAR(256) NOT NULL DEFAULT '', natoms INTEGER NOT NULL DEFAULT 0, symmetry VARCHAR(16) NOT NULL DEFAULT '', tsstring BLOB NOT NULL DEFAULT '' )|WtableframeframeCREATE TABLE frame ( id INTEGER PRIMARY KEY, sid INTEGER NOT NULL DEFAULT 0 ) *;5F %_indexframe_ix_sidframe CREATE INDEX "frame_ix_sid" ON frame(sid)tablepropertypropertyCREATE TABLE property ( id INTEGER PRIMARY KEY, sid INTEGER NOT NULL DEFAULT 0, name VARCHAR(256) NOT NULL DEFAULT '', type VARCHAR(64) NOT NULL DEFAULT 'string', "default" TEXT NOT NULL DEFAtablepropertypropertyCREATE TABLE property ( id INTEGER PRIMARY KEY, sid INTEGER NOT NULL DEFAULT 0, name VARCHAR(256) NOT NULL DEFAULT '', type VARCHAR(64) NOT NULL DEFAULT 'string', "default" TEXT NOT NULL DEFAULT '', size INTEGER NOT NULL DEFAULT 1, dimensions VARCHAR(128) NOT NULL DEFAULT '1', units VARCHAR(64) NOT NULL DEFAULT '' )S))atableframe_propertyframe_propertyCREATE TABLE frame_property ( id INTEGER PRIMARY KEY, prid INTEGER NOT NULL DEFAULT 0, fid INTEGER NOT NULL DEFAULT 0, value BLOB NOT NULL DEFAULT '' )%% Hxm[\7DR _kSh>χeKju_^@f"|j'9߶Nvv=wg1x"ou{6κ}Y8{ܖo>$O$>1#<'밴s{muvkʾOyywޙk}V_=׊>&+ﷵ1ޭ_2'lKb[{i|ogA0=Z;9Ӿ;gG&q۵t~bj@ZA.UwٙmJ"A\f6.!]'h3g. -`l3I#{d<܂]ctdl^bo.a&Y kxŬ]'NDh8A|H$ xXnI^WtJ<٠\k,.p*Z/oI"3ډ pS@2<2^K眬2! 4&h#p?,JnD& q2 %w$:lq v!'\D(1X>BK QA} ǥĿR5؊{a`V۩F̂ 4nv: H=6JC1RIIjXajw ${PGc]I)3Oo<,X$+d&]u3A%T :x50307$# #description' date_creation - K8Mg8S8Cl8O54H44                              Xd$x7)indexframe_property_ix_idsframe_propertyCREATE UNIQUE INDEX "frame_property_ix_ids" ON frame_property (prid,fid)k 7)indexframe_property_ix_fidframe_propertyCREATE INDEX "frame_property_ix_fid" ON frame_property(fid)n 9)indexframe_property_ix_pridframe_propertyCREATE INDEX "frame_property_ix_prid" ON frame_property(prid)U -oindexproperty_ix_namepropertyCREATE INDEX "property_ix_name" ON property(name)E%_indexinfo_ix_iteminfo CREATE INDEX "info_ix_item" ON info(item)b5indexstructure_ix_formulastructure CREATE INDEX "structure_ix_formula" ON structure(formula)_3{indexstructure_ix_natomsstructure CREATE INDEX "structure_ix_natoms" ON structure(natoms)F %_indexframe_ix_sidframe CREATE INDEX "frame_ix_sid" ON frame(sid)R +kindexproperty_ix_sidproperty CREATE INDEX "property_ix_sid" ON property(sid) nwl^0E n=approximateCBMinPosition=approximateVBMaxPosition9approximateCenterOfGap1approximateGapType)approximateGap3approximateMaterialPVAFactorEmpiricalToPrimitive-FormulaEmpirical 5FormulaPrimitiveCell Force_max Efermi %EVanderWaals 1Eelectronic_sigma0)PartialCharges Stress#CellVectorsCell Forces#Coordinates# Eelectronic ~~                                 h}voh                           J&p;~ !pӣ)E~8o9hb8t̅=E6i3 cPDetHx0u2oCY=: T)+) )H% @C$HM BJz-h4k1gMx5`_u8b@P'ɼN8,~e)E 4.9[ʕ`l ^Sze ^v$NCZXmKbV!cZ(Xa|qj)U=w: Wn`#JW68AsYu#Ō(#mq,7+v 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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  # Eelectronicdouble0.01eV //N #i CellVectorsdouble{{10.0 0.0 0.0} {0.0 10.0 0.0} {0.0 0.0 10.0}}3 3Ang6 K Celldouble{10.0 10.0 10.0 90.0 90.0 90.0}6Ang> G Forcesdouble{{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} {0.0 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 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 0.0 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 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 0.0} {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} {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} {0.0 0.0 0.0} 1d;hP:h15 ='  approximateCBMinPositiondouble{0.0 0.0 0.0}35 ='  approximateVBMaxPositiondouble{0.0 0.0 0.0}3+ 9 approximateCenterOfGapdouble0.01eV" 1  approximateGapTypestring1# ) approximateGapdouble0.01eV# 3  approximateMaterialstring1  Pdouble1GPa  Vdouble1Ang^3( A  FactorEmpiricalToPrimitiveint11 -  FormulaEmpiricalstring1$ 5  FormulaPrimitiveCellstring1  Force_maxdouble1eV/Ang  Efermidouble0.01eV! % EVanderWaalsdouble0.01eV' 1 Eelectronic_sigma0double0.01eVX )W -PartialChargesdouble{{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} {0.0 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 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 ? Stressdouble{0.0 0.0 0.0 0.0 0.0 0.0}6kbar0} {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} {0.0 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 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 0.0 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 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 0.0 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 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 0.0} {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} {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} {0.0 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 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 0.0 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 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 0.0 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 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 0.0} {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} {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} {0.0 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 0.0 0.0 0.0} {0.0 0.0 0.0 0.0}}130 4electron charges hftK7R^~᥈G ,| I`4,L8`{-%賂HuW> aP4+RoP3nI?Ix:B1%U@SXKIAYhl%̣T9ECZwL܉ (`9R&Z3JIY%/vɺ j!jpC"|tōRcL`ȱ~)R?B tmIN!x%e4pM08i6(GIwΨ$YTi Xt(+=ʡ^*OmArL[f1 %L_xP9;@F4X+h8y7.WQ̜]QVi% s HJ!x0H(da_ֲ'tBϼ( m,TyK܅=e80ýNhz0hյDf].#}_iplWa0uBi83߶$z(qkK ![ w}qXQTL_ąk~ ݵݧ͓T,R'@U fDrcGf䵲,@mTy+ʮT8ʮB+d+æcZC~rơx,GD^EABA[$,Jsq|HVM_@J2QeEKJ rhl%&JƱqP!9d`]즐6Q2Z"&9JL*J\\7]+r`kKs]?0:FjBnDf龡mkHZ7]/Z`>d)PM*T͑ V.͌v)EA5b[!< 5*$zu<0#X5zy3Ztւ(.rm fct_ \guf[Ϗ\{$dg|VOw-Ef9eO4#@AW"gVF9\ jVꘆRėNDC~KrW?H ip:k'0(NMALcZ$A͋ӥ!^,ηߒ6:Jj+-f"G^t@@):xRY$vaeKe/Pݚ)呖qC[ 4|= \,J! .(RC#ZgVKJy9(]>db'$s@!$ɆS ^o  *`[)űly2t6S' ,zyshQs:W% #U1J,;l1ʔ| d-<9C@tVztz0m@.VXf%JT! {^ I%z-p}T% վџH;:k b5x&j=~4 W[Jգ^TE+dHDavŅ1^K2u!EP4,Sas@KD-R!Q!HO=BWT}AN8G:i̎p[5M3jմ y"˱L2Gp@|] @ӟ\:OuH|"_di\(|!:rVӺͧKmH(e_ 1GFSSGם,c<ʺG,MάhX+HFGJ%(jVwzHQ&¤0-6f75d)[}z]<_3t$+X ͚%Y:-7{<5Ӂ gV-ZH4͹P3ܡPgP-tJ t5n,WW8PQٮB 뺋6ID(*G tO=75dSkq+a-vZ쬉{}lu]>hhUݿw?bj[mdd>B6<ڣ4qWU59 t(-=H6~zc7(y9 2?g5:4Nocغ\ X.B:I?#q,$ '6ZΫyæȏ}~Υ0@dy?C>գB[XLٹXŅiu1MN62kJ;Q72ːNjf񟜤e }֭Nnwn[8z%aos;l-#hWuv\;koju5oT>LWv7e%ekLYCE؆7j튬E5űw)l30|춛&r^F隨2m(r4T,Y2Gt"ݭq-GWRB0 0 #f_KƖꥏ>TΎsRt [7SZ+]|WWhT2}J] m֭g:6P#T-vLVeQR8,vtTyW`Dk j#9-WVc:Q΅bj2/cT.M(Jkߝ}Τpmؠ7bGNJ:JexRP⭱r]0ZgGչC=$t? . z*7[^`5uУ╒u@Au>8gK`5K]VY}<{3 aχeKju_^@f"|j'9߶Nvv=wg1x"ou{6κ}Y8{ܖo>$O$>1#<'밴s{muvkʾOyywޙk}V_=׊>&+ﷵ1ޭ_2'lKb[{i|ogA0=Z;9Ӿ;gG&q۵t~bj@ZA.UwٙmJ"A\f6.!]'h3g. -`l3I#{d<܂]ctdl^bo.a&Y kxŬ]'NDh8A|H$ xXnI^WtJ<٠\k,.p*Z/oI"3ډ pS@2<2^K眬2! 4&h#p?,JnD& q2 %w$:lq v!'\D(1X>BK QA} ǥĿR5؊{a`V۩F̂ 4nv: H=6JC1RIIjXajw ${PGc]I)3Oo<,X$+d&]u3A%T :x503077472W &|1 6x5030774kH xŕA0EHw-3d y__K_ RVD^dEHe#iF xMF:aōXٞn6M &Ar Ք%4TOa<+ 荌w-H/AVi&5jHndO}#ipv;O+j*#/*u-O;fLrgvDvg$OOrg}f??:+Owy?r;#3I'wVgɝ$_:+қ{H33}6n> |x% ! 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