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=7218.128977514944 stress="-1100.9386889706575 158.92376758626742 148.6529280044229 158.92376758626742 -1029.9028802798439 -148.09215177635875 148.6529280044229 -148.09215177635875 -1168.9393310736798" pbc="F F T" Cf 0.25913642 0.02821302 0.37961515 -6028.03990781 -12008.02333399 -7537.94926923 Cf 1.38918410 1.47001936 0.27335532 10241.90896308 9089.06199243 -8399.46141602 Cf 1.65013517 0.24825020 1.69172434 13239.22748822 -10616.07222221 3806.25088316 Cf 0.27427699 1.28706776 1.61212379 -17453.09654349 13535.03356377 12131.15980209