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=118.81736442549084 stress="-10.581723608876995 -1.9844926311972222 -0.9073770583591665 -1.9844926311972222 -13.44054894088698 1.1230293121928456 -0.9073770583591665 1.1230293121928456 -9.58308697185206" free_energy=118.81736442549084 pbc="F T F"
Mo       0.04852473       0.01848935       0.13661615    -136.39072907     -12.10727011    -114.65166023
Mo       1.40480033       1.28303047       0.11041876      88.72838434      31.28318364     -95.00494766
Mo       1.26735611      -0.16466555       1.24148635     138.47710824      10.05175118     123.15092202
Mo       0.08611608       1.53369179       1.52598936     -90.81476351     -29.22766471      86.50568586