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=-14.319399701971918 stress="-0.35590044483948474 0.0016827782508176256 0.02345628548294889 0.0016827782508176256 -0.04336637881853944 0.036166723354149014 0.02345628548294889 0.036166723354149014 -0.2812694415331436" free_energy=-14.319399701971918 pbc="T T F" C 0.35559622 0.06504129 0.22277084 1.27170609 0.56880029 -3.17151323 C 1.68584377 1.64137469 0.19581920 -1.01778905 0.22540858 -2.40125182 C 1.56537167 0.22748741 1.67626233 -1.83751516 0.20447905 2.47593265 C 2.85402479 1.70996341 1.49207130 1.58359812 -0.99868791 3.09683241