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=10.003968304863125 stress="-47.49331625616547 0.08422144263407771 0.5550444713649725 0.08422144263407771 -47.38471394053635 -5.08428038833171 0.5550444713649725 -5.08428038833171 -47.90975842585438" pbc="F F F" Zr 0.26959405 0.17626233 -0.14597521 -12.80175100 -19.05098164 -23.91361800 Zr 1.70996341 1.49207130 0.15300231 18.34559831 17.51569713 -10.44975813 Zr 1.53848316 -0.04225341 1.41852158 12.23648136 -15.71232820 15.94819538 Zr -0.04210664 1.38825682 1.27041603 -17.78032867 17.24761271 18.41518075