16
Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2140.2489599031437 stress="-0.162722977215013 -0.06655149676910256 0.003040282818827518 -0.06655149676910256 -0.1269217322587808 0.0020592090476553326 0.003040282818827518 0.0020592090476553326 -0.1257163365260513" pbc="F F F"
Sc      21.06337117      21.10417909      21.01721659     -30.78565615     -39.24745954    -122.33197062 
Sc      22.76088892      22.91678010      22.37707958   -2609.12040805   -1914.02357555    1582.88563873 
Sc      24.18171960      20.99680271      20.96131740     -32.85635506    -138.96053920    -174.56957352 
Sc      25.39904430      22.33532292      22.82135345     933.66417314     308.31909078    -236.62640938 
Sc      20.89829817      24.28877948      21.13015092    -327.08406777     -80.54708893    -237.91022064 
Sc      22.69513406      25.46306832      22.34698460    -294.74555064     904.09991753     156.57782322 
Sc      24.16412505      23.94810527      21.27485702    2306.51955962    1110.85345853   -2804.70301973 
Sc      25.54054063      25.42225496      22.39714919     671.32509141     641.43302921     185.01638927 
Sc      21.09317098      21.37227844      23.67020404    -268.78818333    -177.19969336      81.15412474 
Sc      22.41694162      22.64767777      25.60847505     123.30901202    -189.30711517     336.74732600 
Sc      23.70164252      21.13222997      23.78825069    -361.25804674    -769.43393835     528.72826630 
Sc      25.64433510      22.67289517      25.54587648      63.58368214    -201.58531569     132.96829671 
Sc      21.05604751      24.07552015      24.07405638    -892.20824536    -379.18272642    -720.81823027 
Sc      22.32416679      25.31123232      25.46850347     395.80384478     852.02336720     878.70937502 
Sc      24.04205956      24.26928587      24.04257931    -852.81510602    -814.55092917    -492.15844890 
Sc      25.61160724      25.23211785      25.22867338    1175.45625602     887.30951813     906.33063307