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=59.97595290124342 stress="-8.689351716958383 -0.3672490703961718 0.27256324810276733 -0.3672490703961718 -7.479669891270707 -0.6518491481758891 0.27256324810276733 -0.6518491481758891 -10.247118691063557" pbc="T F T" W 0.03848316 0.19178619 0.17895518 40.58713580 -73.92658012 -43.56145388 W 1.79140871 1.61455359 0.03253581 -56.74979116 64.14674613 -11.01968426 W 1.64904689 0.10609294 1.46603997 -59.56239004 -81.97237448 23.35436799 W -0.19401975 1.32157598 1.51361598 75.72504541 91.75220847 31.22677016