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=37360.676129213505 stress="-207087.05078204526 -60517.3827634091 -13921.43592303885 -60517.3827634091 -188407.27274678234 -18810.187776768347 -13921.43592303885 -18810.187776768347 -56728.86333184649" pbc="F F F"
Es       0.28691075       0.43491411      -0.00575300 -136197.56839400 -127451.94345462  -42115.52626699 
Es       1.29611896       1.37392488       0.12968762  136743.33935596  129205.90096263    2807.60714225 
Es       1.22290729       0.20735571       1.39171737   65732.43607957  -66738.11413650   14828.97505284 
Es       0.17285790       1.23348909       1.44960169  -66278.20704153   64984.15662848   24478.94407190