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=-5.039108167090471 stress="-0.9298001091463577 -0.24771372310632378 0.296132747182536 -0.24771372310632378 -0.6517474227246558 -0.10035382884885907 0.296132747182536 -0.10035382884885907 -1.0758004180455376" free_energy=-5.039108167090471 pbc="T F T"
B       2.85402479       0.20996341       2.99207130      -0.55390692      -6.53272943       0.52606543 
B       1.65300231       1.53848316       2.95774659      -7.15724764       9.38472630      -4.17592618 
B       1.56756847       0.19178619       1.67895518      -3.77138529      -6.42077876      -2.20049705 
B       0.29140871       1.61455359       1.53253581      11.48253985       3.56878189       5.85035781