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=20.28076421696121 stress="-2.668689357424395 -0.1399298361357856 -0.08409381394433241 -0.1399298361357856 -2.7435470039502823 0.07554601587620108 -0.08409381394433241 0.07554601587620108 -2.750592756761791" pbc="T T T" Al -0.14459490 0.11115480 0.11044915 1.56711543 -0.75361181 -1.08427242 Al 1.70960170 1.18822856 -0.16166483 -3.54705514 1.45059604 1.75212125 Al 1.28829595 -0.16490224 1.64041416 -2.55272911 -0.24571747 -1.49150148 Al -0.22187219 1.51878885 1.32834452 4.53266883 -0.45126676 0.82365265