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:Z:I:1:forces:R:3 energy=57286.27258788126 pbc="T T F" Zr 0.16777107 -0.28663954 -0.21427555 40 -237528.79584454 239680.73019804 -33823.62125175 Zr 1.26734417 1.59437540 -0.10277638 40 241577.44219565 -238832.69306740 11586.03549251 Zr 1.26048876 -0.07566387 1.70910241 40 17771.20713332 -18379.57720951 13390.16257382 Zr -0.10163784 1.20565090 1.37039470 40 -21819.85348444 17531.54007888 8847.42318542