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=28.335313756309056 stress="-2.961610178153094 0.8173786770692529 0.49634218200625957 0.8173786770692529 -3.080683082575741 0.3508676015920607 0.49634218200625957 0.3508676015920607 -4.388411981495699" free_energy=28.335313756309056 pbc="F T F" Ni 0.29874826 2.77290972 0.05835534 -37.52343238 59.10316714 -37.01403281 Ni 1.24645637 1.48193431 0.20070203 52.46211901 -57.90587303 -50.76385870 Ni 1.20342959 2.90085166 1.49793547 32.54556744 35.57938015 39.26984607 Ni 0.28187239 1.51001192 1.48453339 -47.48425406 -36.77667426 48.50804544