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=-0.6257001422957967 stress="-5.524076958678377 0.310974492598982 0.794146792692139 0.310974492598982 -5.928623513531161 0.827280275209753 0.794146792692139 0.827280275209753 -7.667130589614661" free_energy=-0.6257001422957967 pbc="F F T"
Mo       0.29874826       0.05835534       2.74645637     -52.77375469     -64.98530044      27.10395330 
Mo       1.48193431       1.42001865       0.20070203      57.01797927      55.61390818      -9.33829969 
Mo       1.20342959       0.28187239       1.51083794      73.38551047     -65.67072972     -12.61081150 
Mo       0.10170120       1.37793365       1.46528483     -77.62973506      75.04212198      -5.15484212