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=25944.568315039796 stress="-3993.4200734760175 -1552.6826138545425 -340.6461363622526 -1552.6826138545425 -4047.8943193731743 -128.71023636811043 -340.6461363622526 -128.71023636811043 -3762.322958183416" pbc="T F T" Bk 0.28513272 0.22832922 0.14387814 -75288.41945725 -63385.92745457 -18911.65787388 Bk 1.37519365 1.36302847 -0.06900952 60583.92363157 65791.81939209 -8803.32822158 Bk 1.27695082 0.29404130 1.49846240 34785.15484597 -27551.41568987 19301.35483169 Bk 0.20324287 1.67787862 1.32624082 -20080.65902029 25145.52375235 8413.63126377