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=19.145978790652094 stress="-15.888548764685034 0.2685461807128665 -0.1358280638660343 0.2685461807128665 -14.122944586382683 0.1937866056620301 -0.1358280638660343 0.1937866056620301 -13.990964852996143" pbc="F F F" K 0.26959405 0.17626233 -0.14597521 -4.34744043 -4.81642654 -6.47359607 K 1.70996341 1.49207130 0.15300231 5.95950377 5.56438184 -3.60491753 K 1.53848316 -0.04225341 1.41852158 4.30357131 -5.38814655 5.35858226 K -0.04210664 1.38825682 1.27041603 -5.91563464 4.64019125 4.71993135