4
Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=3498.680050314676 stress="-14261.74898568806 -1216.5386483372158 5581.779309102108 -1216.5386483372158 -11946.944669460921 -1907.4993717692846 5581.779309102108 -1907.4993717692846 -19169.55296524737" pbc="F F F"
Db      -0.04919960      -0.00321414      -0.03513066   -4224.74943078   -4933.83403445   -5042.27183083 
Db       1.32480506       1.44582025      -0.08001057    7507.59721327    3890.39192019   -8801.50128933 
Db       1.55445852      -0.22096074       1.15740971    3789.72089991   -3411.79442862    1796.81398089 
Db       0.25212534       1.24626528       1.34544754   -7072.56868239    4455.23654288   12046.95913927