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=3776.8006629235842 stress="-632.2838785305589 277.8484384754665 136.0527351832472 277.8484384754665 -551.8823937703445 91.81387759682796 136.0527351832472 91.81387759682796 -504.5845884762085" free_energy=3776.8006629235842 pbc="F T T"
Kr       0.23171545       0.18190327      -0.17816502   -4958.33902969   -3930.06777499    6657.68744558
Kr       1.62780321       1.32965408       0.00710170    2034.79069667    2288.08378119     813.33614024
Kr       1.28220450       0.28278197       1.56210000   12639.72181854   -9172.41639945   -4824.86329398
Kr       0.13362859       1.32702941       1.57034430   -9716.17348551   10814.40039325   -2646.16029184