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:Z:I:1:forces:R:3 energy=2194702.2538613207 pbc="T T T" Hg 0.16245675 0.12054330 0.00279254 80 -6123453.10855764 -14013447.31670810 3004417.69957243 Hg 0.41989502 0.70688464 -0.13084028 80 6135387.48024757 13943889.91422687 -3234052.33552219 Hg 0.55639673 0.29684714 0.89970476 80 21655513.90859723 -12392721.16627876 4118999.17139608 Hg 0.01673661 0.60623427 0.79875046 80 -21667448.28028714 12462278.56876000 -3889364.53544632