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=-10.194962358233953 stress="-27.867816277882838 0.4795577908818621 11.001730160569904 0.4795577908818621 -23.749137915205733 -3.3593732902485662 11.001730160569904 -3.3593732902485662 -26.47958825809701" pbc="F F F" Zr -0.21015034 -0.01264569 -0.07700850 -5.36563099 -8.39472971 -4.08051449 Zr 1.40698366 1.68107110 -0.17174679 12.77224884 4.83640590 -11.82622246 Zr 1.63102478 0.09995250 1.76120756 5.47116787 -5.61485159 2.83503136 Zr 0.01193751 1.75226748 1.46431997 -12.87778572 9.17317541 13.07170559