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=1461.63388355748 stress="-6285.075021714192 -701.8065943267138 -1116.0466014823483 -701.8065943267138 -5590.213468045402 -1080.1954931427103 -1116.0466014823483 -1080.1954931427103 -6560.783275997273" pbc="F F F" Cf 0.29051977 0.09648209 0.00676316 -2816.57712309 -2809.15827435 -3508.83906560 Cf 1.39472266 1.77851010 -0.00877296 1699.60875375 2131.05223317 -1321.87575006 Cf 1.74335910 0.07584840 1.27145540 2708.53583231 -828.27193481 2292.40680031 Cf -0.00685672 1.41662460 1.44120585 -1591.56746297 1506.37797600 2538.30801534