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=48829.392196566696 stress="-241235.91166334716 128416.42521965133 30527.257828462636 128416.42521965133 -219102.89213407174 6439.4360499173345 30527.257828462636 6439.4360499173345 -134117.26842186195" pbc="F F F" Ac -0.23264389 -0.10631021 -0.25851365 -29024.57782455 -11873.95479676 -35330.97750797 Ac 1.58611608 1.53369179 0.02598936 19931.59829445 50835.70764252 -41607.82983608 Ac 1.22329650 -0.03624564 1.40583543 139737.09522986 -150802.36056573 31377.07844927 Ac -0.24440284 1.20178472 1.79874826 -130644.11569977 111840.60771997 45561.72889478