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=2060.683964440184 stress="-8644.65131149811 647.2243162126252 -5099.227168408948 647.2243162126252 -5424.626420519091 -1308.3405264310954 -5099.227168408948 -1308.3405264310954 -10799.4214918639" pbc="F F F"
Kr       0.19178619       0.17895518       0.29140871   -5650.55005259   -2784.97184642   -8221.10303816 
Kr       1.46654064       1.50821123       0.21234616    1168.34509551    1668.41474396    -816.15503216 
Kr       1.28091226       0.10609294       1.46603997    6023.70782435   -1588.73024420    6526.57356633 
Kr      -0.19401975       1.32157598       1.51361598   -1541.50286726    2705.28734666    2510.68450399