4 Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=38.58483738552184 stress="-168.6569886622867 -43.349363557706205 31.11484450488726 -43.349363557706205 -279.1622824587589 -162.21736859979515 31.11484450488726 -162.21736859979515 -251.07941472791128" pbc="T T F" user01 0.18362810 0.19581920 0.14685009 144.78411650 -365.44545906 -387.64475545 user01 0.97748741 0.81451915 0.04581097 -76.73646091 40.57331608 -77.24504728 user01 0.99249922 0.14111819 0.68391457 -218.91179133 -205.26691262 49.04115427 user01 0.03848316 0.70774659 0.66852158 150.86413574 530.13905560 415.84864846