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=-8.579308066250398 stress="-0.958757374024734 -0.24111060144578042 0.15583847248895305 -0.24111060144578042 -1.0817740440855537 0.444947561111107 0.15583847248895305 0.444947561111107 -1.2340339317977358" free_energy=-8.579308066250398 pbc="F T T"
B        0.18190327      -0.17816502       0.21219253      -7.78204907      -4.43490568       2.38992592
B        1.42485375       1.62990665      -0.21779550      12.37042843      -5.84928534     -14.65506777
B        1.78278197       0.06210000       1.63362859       5.83889683       8.71719473       8.97911270
B        0.07034430       1.54852473       1.55473499     -10.42727619       1.56699629       3.28602914