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=4190.15513425893 stress="-14329.439696098336 3225.712772751887 -403.7501695413648 3225.712772751887 -17825.651412072657 -6677.122729294988 -403.7501695413648 -6677.122729294988 -19405.338217184508" pbc="F F F"
Md       0.19359173       0.29669343       0.07445983   -3208.85171656   -8940.50188814  -12064.73352828 
Md       1.56399518       1.62568716       0.28491652    4646.10737502    3582.33177040   -1984.02831526 
Md       1.25325937       0.10551926       1.63247477    5963.75232805   -5419.31503729    4869.60911298 
Md      -0.02837841       1.41279072       1.40747682   -7401.00798652   10777.48515503    9179.15273057