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=1495.0649042160665 stress="-238.60735759368876 49.85203462322842 -62.55460755563652 49.85203462322842 -225.1919715677741 -29.8295384219834 -62.55460755563652 -29.8295384219834 -208.62270492858383" free_energy=1495.0649042160665 pbc="T T F"
Kr       0.18584377       0.18362810       0.19581920   -1993.71328684    -594.45597727   -3055.24355179
Kr       1.56537167       1.72748741       0.17626233     725.04434653     -72.87798314   -1315.54193422
Kr       1.35402479       0.20996341       1.49207130    2977.03706042   -1111.58197350    2664.88072267
Kr       0.15300231       1.53848316       1.45774659   -1708.36812011    1778.91593391    1705.90476334