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=0.3318839449403285 stress="-0.17073724329906934 0.07663703492397558 -0.004928684867545057 0.07663703492397558 -0.16385419429291717 0.014899752618045737 -0.004928684867545057 0.014899752618045737 -0.08995645504751854" pbc="T T F"
Kr       0.09964314      -0.08237877       0.27570636      -2.64529180       2.77860064      -1.07565333 
Kr       1.35800072       1.72471815       0.24437196       2.49489853      -2.45619775      -0.57469686 
Kr       1.36614192       0.09457544       1.73065627       0.88888965       0.67117790       0.70920885 
Kr       0.01976833       1.71852519       1.74089876      -0.73849637      -0.99358080       0.94114134