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=4.520598169388894 stress="-2.5115040486817257 0.12690544191578704 -0.06250938751241661 0.12690544191578704 -2.3615178673163935 0.1439145235438529 -0.06250938751241661 0.1439145235438529 -1.9402289234003154" free_energy=4.520598169388894 pbc="T T F" V 0.14803915 -0.23583546 0.14526935 -3.99024343 13.94375526 -17.87339632 V 1.53806039 1.57797747 0.26599513 3.25987728 -12.43759175 -17.72118435 V 1.67918122 0.05957798 1.66192607 -5.80573638 1.99242488 16.63932525 V -0.00490765 1.53099333 1.69045800 6.53610253 -3.49858838 18.95525542