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=5.96583210919 stress="-16.734852998042804 -0.7540415097371379 0.2071724091120017 -0.7540415097371379 -12.116861740931345 0.5939646766871197 0.2071724091120017 0.5939646766871197 -16.565555904958135" pbc="F F F" Zr 0.19303731 0.10837079 -0.19246931 -14.84530168 -15.36385432 -14.50736450 Zr 1.44932735 1.21221664 -0.09932462 16.23241112 17.46026226 -14.70149106 Zr 1.33106595 0.26246177 1.29350693 15.21204456 -14.48327048 18.46549576 Zr -0.09276006 1.21381714 1.29207607 -16.59915401 12.38686254 10.74335981