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=81.91202699726 stress="-11.490922190417036 0.008679332335773522 0.47703659732344506 0.008679332335773522 -11.71507055676303 -0.8715663613977218 0.47703659732344506 -0.8715663613977218 -7.945796080564766" free_energy=81.91202699726 pbc="T T F"
U       0.02103145       2.77761356       0.18220204     -23.81015915      40.97574359     -78.70921801 
U       1.39362841       1.73573857       0.02724172      25.70883841     -55.20636498     -84.41825775 
U       1.27538150       2.70296332       1.34887301      46.34613953      25.96473725      82.69105369 
U       0.22083292       1.28984966       1.48735431     -48.24481879     -11.73411586      80.43642206