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=-8.374127734632701 stress="-0.23137834057857004 -0.037461044262687815 0.22120395686440072 -0.037461044262687815 -0.276653950285606 -0.02238983993540092 0.22120395686440072 -0.02238983993540092 -0.30813040907620914" free_energy=-8.374127734632701 pbc="T T F" Be 2.78802619 0.22277084 0.18584377 7.60583583 -1.98860901 -4.71090457 Be 1.68362810 1.65356579 0.14685009 -2.76590393 1.84302141 -2.00437507 Be 1.76959405 0.17626233 1.35402479 -3.41359237 -1.54791506 5.38841903 Be 0.40174959 1.49207130 1.65300231 -1.42633953 1.69350266 1.32686062