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=914.4048506938983 stress="-56.25367941430576 0.5721289475988725 -0.8724979357014696 0.5721289475988725 -30.243713597426417 -1.644230209621083 -0.8724979357014696 -1.644230209621083 -57.613694983943724" free_energy=914.4048506938983 pbc="T F T"
I       2.96545771       0.10260142       0.23757633     -55.46374780    -284.88471490     -29.87094015 
I       1.35847550       1.63185401       2.97839446      57.59018344     314.56130084      43.33175768 
I       1.33058461       0.02278034       1.63760260      85.92762620    -312.61211851       6.02509928 
I       0.06109240       1.20032005       1.66886747     -88.05406184     282.93553257     -19.48591681