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=21.398710770669137 stress="-14.404186001703579 -0.05030670552608851 0.6057831159294098 -0.05030670552608851 -12.543189140765808 -0.03917231758827455 0.6057831159294098 -0.03917231758827455 -13.517459688281502" pbc="F F F" Cs -0.14801295 -0.02432459 0.06329927 -5.34559594 -4.02151880 -4.82872003 Cs 1.43745442 1.27846858 -0.00548572 4.65133413 4.71485452 -4.57332583 Cs 1.34126820 -0.15859300 1.31668137 4.91241192 -5.19055701 4.22602795 Cs -0.08013605 1.24396547 1.59073906 -4.21815012 4.49722130 5.17601791