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=255.2668446292344 stress="-19.247679456731927 1.9809748177874318 0.22108316629827302 1.9809748177874318 -12.392312731848017 -0.32527341500381923 0.22108316629827302 -0.32527341500381923 -11.098571669231633" free_energy=255.2668446292344 pbc="T F F" K 2.93926330 0.00882294 0.10878037 15.61359507 -113.42487323 -101.05801250 K 1.77852494 1.48026295 0.11434322 -14.07498753 121.64136731 -116.73743867 K 1.40115487 0.20457492 1.41186948 22.24032075 -123.33260152 116.80572724 K 0.24583810 1.57026468 1.57529174 -23.77892828 115.11610744 100.98972394