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=9.816860933295404 stress="-0.4282313541745134 0.09680973743701958 -0.3866997345948851 0.09680973743701958 -0.35468770302337155 -0.10831248816037117 -0.3866997345948851 -0.10831248816037117 0.11828365751232653" free_energy=9.816860933295404 pbc="T T T"
F       2.60704314       0.11042859       0.20947124      -5.14032777       4.24731345      15.32161439 
F       1.51001633       1.55280714       2.61579628       0.87638588       3.77011512      -7.66961728 
F       1.51086573       2.68666965       1.32230844       6.18679839      -2.04250243      -1.17583141 
F       2.89893225       1.22286420       1.43858073      -1.92285650      -5.97492614      -6.47616570