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=86.53230112672063 stress="-11.005612264059286 -1.0591520384262472 3.521541512166622 -1.0591520384262472 -8.272966728717414 0.5755388804422655 3.521541512166622 0.5755388804422655 -9.684487487110529" free_energy=86.53230112672063 pbc="T F F"
U       2.92299150       0.18107110       0.13102478      39.72998933     -75.10948264     -95.69817042 
U       1.59995250       1.76120756       0.01193751      26.87144369      65.42872123     -98.23829515 
U       1.75226748       0.04396501       1.57236142     -53.03176387     -61.90690869      95.81177483 
U       0.22410373       1.73854596       1.26922180     -13.56966915      71.58767010      98.12469073