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:Z:I:1:forces:R:3 energy=1940.2085561103424 pbc="F F F"
Sc      -0.13538344       0.33773542       0.10262463       21    -234.37207613    -145.83456589    -221.71325483 
Sc       1.63370891       1.27975890       1.53486778       21    -412.35444508     532.23835520    -332.40185682 
Sc       3.30964227       0.01547660      -0.13430332       21     -21.25875790    -179.83866552    -213.87472188 
Sc       4.52202644       1.48574328       1.58391632       21     785.02255907     719.78588155    -534.32295647 
Sc       0.08546620       3.24517364       0.06929586       21    -171.30978838     -17.76682110    -105.35977440 
Sc       1.67092335       4.48045534       1.72075949       21    -151.09341224     462.52136251    -365.71288281 
Sc       2.78699274       2.85564198      -0.19411689       21     113.96767032      72.48199124    -184.65447911 
Sc       4.55014109       4.60657799       1.36862463       21      48.67496454      27.83292728      -1.76891763 
Sc      -0.16239370       0.05382759       2.95976610       21    -147.06678619    -154.52927567      84.18297148 
Sc       1.87288301       1.33220310       4.39469022       21    -494.83825968    -690.06762211     900.48525165 
Sc       3.16672052       0.08416775       2.73437641       21     -45.50951246   -1532.58830456     576.02205968 
Sc       4.62397798       1.36458723       4.20838391       21     375.72615091     117.05192092     396.61373292 
Sc       0.12974955       2.79361759       3.23779642       21    -899.62205356    -466.34691031    -459.07693868 
Sc       1.53126279       4.23799885       4.29694547       21   -2091.44667477    3095.79298924    2777.39759477 
Sc       2.82393228       3.05163338       3.25498247       21    3282.26957623   -1891.10160612   -2362.65129329 
Sc       4.61008478       4.49603958       4.67417558       21      63.21084531      50.36834335      46.83546541