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=-0.5928668355830444 stress="-3.5172651202350167 -0.9678476869132635 1.11736520523371 -0.9678476869132635 -3.295045583199425 -0.3111679175712855 1.11736520523371 -0.3111679175712855 -2.675756063119078" pbc="F F F"
H      -0.16903503      -0.11798803      -0.06699407      -1.14569955      -1.81157840      -0.41677400 
H       1.22002482       1.27696427      -0.08338442       2.07134822       1.36790582      -1.34890240 
H       1.46512192       0.22586561       1.79391194       0.31225968      -0.50935115       0.54136356 
H      -0.27385471       1.52103145       1.27761356      -1.23790835       0.95302374       1.22431283