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=146.8565770487663 stress="-8.268441223163515 -0.24294672322938027 -0.04832851375455399 -0.24294672322938027 -8.042355937049003 0.3731945115360827 -0.04832851375455399 0.3731945115360827 -4.22580099452652" free_energy=146.8565770487663 pbc="T T F"
Ba       0.06504129      -0.29134056       0.22277084       7.25973061      14.70504822     -40.61955324
Ba       1.68584377       1.68362810       0.19581920      -9.24490235      -7.34557056     -42.48073339
Ba       1.64685009       0.42259636       1.67626233      -7.94867544      -5.06451674      40.56912872
Ba      -0.14597521       1.70996341       1.49207130       9.93384718      -2.29496091      42.53115791