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=9.122484942125428 stress="-73.40442945923702 7.53443560629105 -3.6849634960033555 7.53443560629105 -77.43226163007598 0.8424600159143267 -3.6849634960033555 0.8424600159143267 -75.1919249345968" pbc="F F F" Zr -0.12320595 -0.04105180 0.20259391 -28.42597094 -20.87345337 -18.59978327 Zr 1.56504129 1.20865944 -0.13449789 21.66696716 16.66386732 -26.44657421 Zr 1.28802619 0.22277084 1.68584377 31.46631620 -33.46511392 31.24920561 Zr 0.18362810 1.69581920 1.64685009 -24.70731242 37.67469997 13.79715187