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=146.1033165807625 stress="-8.241703665631427 -0.24273041813926322 -0.048255954325453945 -0.24273041813926322 -8.016530909338156 0.37313566183474717 -0.048255954325453945 0.37313566183474717 -4.2255222552558305" free_energy=146.1033165807625 pbc="T T F"
Ba       0.06504129      -0.29134056       0.22277084       7.26013471      14.70392572     -40.61685711
Ba       1.68584377       1.68362810       0.19581920      -9.24388390      -7.34567032     -42.47802552
Ba       1.64685009       0.42259636       1.67626233      -7.94935960      -5.06432758      40.56590560
Ba      -0.14597521       1.70996341       1.49207130       9.93310880      -2.29392782      42.52897702