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=541493.5739955514 stress="-96495.49168643312 -43027.2767483245 -50804.33604826617 -43027.2767483245 -94177.86929972276 493.85786437854404 -50804.33604826617 493.85786437854404 -51415.83313471303" pbc="T F F" Np 0.46257293 0.17033765 0.12873753 -1504811.18090546 -1106916.75159423 -938727.69926726 Np 1.20147668 1.52486558 0.18667769 370514.03214475 1497975.29854225 -361139.84441484 Np 1.65169187 0.26318512 1.07813253 552879.67661190 -967772.28174721 927509.20147026 Np -0.18941263 1.21697182 1.54828248 581417.47214881 576713.73479918 372358.34221183