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=0.7582479954570294 stress="-0.8951928621911412 0.0835787553977858 0.03580650512766928 0.0835787553977858 -0.92629416220234 0.12821369601550808 0.03580650512766928 0.12821369601550808 -0.6351793199477661" free_energy=0.7582479954570294 pbc="T T F" Li -0.12320595 -0.04105180 0.20259391 2.25870669 -0.74063115 -5.94888510 Li 1.56504129 1.20865944 0.22277084 -1.65117010 3.12213247 -5.67953457 Li 1.68584377 0.18362810 1.69581920 -1.95085393 -0.77832217 6.54513276 Li 0.00087488 1.76959405 1.67626233 1.34331734 -1.60317915 5.08328690