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=5559.539167234482 stress="-1149.4553438853354 -124.60155262061754 -672.628232081105 -124.60155262061754 -417.3578928424486 25.58419990716579 -672.628232081105 25.58419990716579 -933.3929501362223" pbc="F F T" Ca 0.20352251 0.09794811 0.27762050 -23027.29985869 -5118.48210477 -17971.66892335 Ca 1.22480488 1.67164886 0.25684340 3080.51853795 6112.77624594 -5384.15987358 Ca 1.36921242 0.26959058 1.21119634 23574.42222973 -2339.44084845 20566.37455410 Ca 0.09084624 1.62233943 1.60310891 -3627.64090899 1345.14670728 2789.45424283