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=-10.194962358141028 stress="-27.867816058943987 0.47955782909684974 11.001730132069026 0.47955782909684974 -23.749137703360297 -3.3593733372997505 11.001730132069026 -3.3593733372997505 -26.479587968633265" pbc="F F F" Zr -0.21015034 -0.01264569 -0.07700850 -5.36563092 -8.39472964 -4.08051445 Zr 1.40698366 1.68107110 -0.17174679 12.77224875 4.83640581 -11.82622234 Zr 1.63102478 0.09995250 1.76120756 5.47116783 -5.61485153 2.83503128 Zr 0.01193751 1.75226748 1.46431997 -12.87778566 9.17317536 13.07170551