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=2039.940471830297 stress="-3876.7471880543862 -2073.218760962451 446.19050556103235 -2073.218760962451 -11140.745938935246 -7776.351763117718 446.19050556103235 -7776.351763117718 -10766.601815615171" pbc="F F F" Bk -0.26438155 0.20706088 0.22632529 -2067.31885163 -7781.60442890 -6482.10985504 Bk 1.22377423 1.67079289 -0.15171536 1856.98528633 1413.43369547 -1387.31561946 Bk 1.70167311 -0.03899221 1.49834365 587.68587301 -399.96003998 398.61213755 Bk -0.15265905 1.53289909 1.52940941 -377.35230772 6768.13077341 7470.81333695