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=4531.436452393314 stress="-490.9759833979841 27.46671569168614 95.9415638484972 27.46671569168614 -689.2121361678547 -320.97037946937064 95.9415638484972 -320.97037946937064 -910.8198748224944" pbc="F F T" Na 0.12341994 0.28592711 0.00703823 -2460.83697561 -11604.64436815 -10429.78762906 Na 1.44737512 1.79620016 0.06090554 4682.76654441 3667.28624426 -3503.23216302 Na 1.62211698 0.26456213 1.40412209 4698.38706669 -3717.53589471 1384.61353616 Na 0.12123511 1.40054034 1.30321583 -6920.31663549 11654.89401861 12548.40625592