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=55.53792507433762 stress="-2.817350409061223 -0.044782904856316454 -0.008263559413663071 -0.044782904856316454 -2.7709057114231648 0.0701778992818365 -0.008263559413663071 0.0701778992818365 -1.2179938661791647" free_energy=55.53792507433762 pbc="T T F" K 0.06504129 -0.29134056 0.22277084 1.40224751 2.70276855 -11.60546505 K 1.68584377 1.68362810 0.19581920 -1.77399223 -1.34594003 -12.25677838 K 1.64685009 0.42259636 1.67626233 -1.61002209 -1.13390697 12.30862118 K -0.14597521 1.66771000 1.49207130 1.98176681 -0.22292156 11.55362225