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=3483.2911829371096 stress="-16825.745386050603 421.3831354673964 -4398.92237811903 421.3831354673964 -6053.291293152151 201.19259574955095 -4398.92237811903 201.19259574955095 -22017.484214808435" pbc="F F F"
Db       0.22126680      -0.06756126      -0.04858186   -9262.47293676   -1360.41675352  -10453.65744138 
Db       1.50267083       1.48416273      -0.05542543    6287.23625629    1409.35355036   -5631.65319378 
Db       1.30326452      -0.17584872       1.33828702    8243.39976005   -2112.88250446   10590.41204573 
Db       0.24975572       1.69487120       1.27836360   -5268.16307958    2063.94570762    5494.89858943