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=5.411953648300396 stress="-31.19412245936595 -3.6768410814412515 -0.6887477766290466 -3.6768410814412515 -32.11415507158675 -3.1368157745993432 -0.6887477766290466 -3.1368157745993432 -18.970477593583627" pbc="F F F" Hg 0.05919783 0.18239804 -0.17404061 -10.16235369 -16.04345452 -8.58915237 Hg 1.22445915 1.63997697 -0.01633659 11.92518525 14.74106222 -3.25390951 Hg 1.28190371 0.25870120 1.55140063 10.62348476 -8.30735518 5.47583725 Hg -0.28866734 1.35430926 1.40206160 -12.38631632 9.60974748 6.36722463