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=50152.73777908211 stress="-7851.196419743408 1629.0904464495213 643.6725832585281 1629.0904464495213 -7383.243448354869 2407.0033553763137 643.6725832585281 2407.0033553763137 -7534.452482418423" pbc="T F T"
Lu       0.02732506       0.13015092      -0.08022675  -23455.57529426  -62950.75322358   41111.07435376 
Lu       1.41464539       1.48327561       0.16412505   22244.00915897   60429.68927798  -27894.86293023 
Lu       1.39629153       0.27485702       1.54054063   67379.43501434 -101920.41656380    9354.91343741 
Lu       0.05448493       1.39714919       1.61362134  -66167.86887904  104441.48050941  -22571.12486093