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=176890.28920939582 stress="-15785.178430753263 2967.9085406053437 -2526.3255289106132 2967.9085406053437 -29011.56014136052 -18832.931415452927 -2526.3255289106132 -18832.931415452927 -34639.681250127906" pbc="F F T"
Zr       0.22921750       0.04832090      -0.07230225  -76752.92650992 -116978.20150973  100751.21333575 
Zr       1.59786154       1.22676395      -0.21777745  153518.48150472  579847.13107887  688670.49997826 
Zr       1.54405727       0.27282393       1.66783583  168067.77185507 -667633.70990643 -663052.42659055 
Zr       0.24920876       1.26865330       1.71150289 -244833.32684986  204764.78033729 -126369.28672346