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:Z:I:1:forces:R:3 energy=73.7071619619 pbc="T F T" Cs 0.19724111 -0.03787426 0.19740151 55 -2.66433765 -11.86595644 -1.05585015 Cs 1.34126820 1.34140700 -0.18331863 55 2.74360596 11.27919239 1.02732724 Cs 1.21571798 -0.03508962 1.41257404 55 2.47706265 -12.62959050 0.84047180 Cs 0.48439216 1.43381326 1.55618294 55 -2.55633096 13.21635455 -0.81194889