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=12212.1956881199 stress="-1280.2623854972335 282.56029567913805 -138.25139117897749 282.56029567913805 -1852.0881138646407 -184.77421196763558 -138.25139117897749 -184.77421196763558 -2507.36035594027" pbc="F T T" Bk 0.09911992 0.29397648 0.22354548 -12265.31510209 -21703.75600251 -8991.45766186 Bk 1.61743482 1.44814568 0.12556803 8766.97807607 3698.33337747 136.20236011 Bk 1.34195381 -0.07968001 1.61658954 17474.43717799 -11439.35749136 2672.69595790 Bk 0.13216002 1.23284452 1.69178893 -13976.10015197 29444.78011640 6182.55934385