16
Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2140.248959903134 stress="-12055.819935905847 -4930.6672926292595 225.24847348125604 -4930.6672926292595 -9403.377299588532 152.56267992267567 225.24847348125604 152.56267992267567 -9314.071940542086" pbc="F F F"
Sc       0.06337117       0.10417909       0.01721659     -30.78565615     -39.24745954    -122.33197062 
Sc       1.76088892       1.91678010       1.37707958   -2609.12040805   -1914.02357555    1582.88563873 
Sc       3.18171960      -0.00319729      -0.03868260     -32.85635506    -138.96053920    -174.56957352 
Sc       4.39904430       1.33532292       1.82135345     933.66417314     308.31909078    -236.62640938 
Sc      -0.10170183       3.28877948       0.13015092    -327.08406777     -80.54708893    -237.91022064 
Sc       1.69513406       4.46306832       1.34698460    -294.74555064     904.09991753     156.57782322 
Sc       3.16412505       2.94810527       0.27485702    2306.51955962    1110.85345853   -2804.70301973 
Sc       4.54054063       4.42225496       1.39714919     671.32509141     641.43302921     185.01638927 
Sc       0.09317098       0.37227844       2.67020404    -268.78818333    -177.19969336      81.15412474 
Sc       1.41694162       1.64767777       4.60847505     123.30901202    -189.30711517     336.74732600 
Sc       2.70164252       0.13222997       2.78825069    -361.25804674    -769.43393835     528.72826630 
Sc       4.64433510       1.67289517       4.54587648      63.58368214    -201.58531569     132.96829671 
Sc       0.05604751       3.07552015       3.07405638    -892.20824536    -379.18272642    -720.81823027 
Sc       1.32416679       4.31123232       4.46850347     395.80384478     852.02336720     878.70937502 
Sc       3.04205956       3.26928587       3.04257931    -852.81510602    -814.55092917    -492.15844890 
Sc       4.61160724       4.23211785       4.22867338    1175.45625602     887.30951813     906.33063307