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=13.899894792030546 stress="-72.62107682988908 11.55785283416564 -4.024890363507083 11.55785283416564 -78.02505591057563 1.6008729200428178 -4.024890363507083 1.6008729200428178 -71.23777725485004" pbc="F F F" Zr -0.12320595 -0.04105180 0.20259391 -26.93081412 -19.24296914 -17.58899507 Zr 1.56504129 1.20865944 -0.13449789 20.29504975 15.72359286 -25.07111264 Zr 1.28802619 0.22277084 1.68584377 32.88844578 -35.47908118 30.11735862 Zr 0.18362810 1.69581920 1.64685009 -26.25268142 38.99845746 12.54274909