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=-2.416918894975961 stress="-0.4800926077259811 0.144548657406382 -0.1028643166374125 0.144548657406382 -0.5346856561442022 -0.18526673049275322 -0.1028643166374125 -0.18526673049275322 -0.722491575870775" pbc="T T T" Al -0.14459490 0.11115480 0.11044915 5.26944256 -11.19411935 -3.49635134 Al 1.70960170 1.31143450 -0.16166483 -8.48171562 8.98317863 1.75950325 Al 1.28829595 0.03769167 1.64041416 -1.39409686 -6.96417830 -2.74808965 Al -0.22187219 1.22744829 1.32834452 4.60636992 9.17511902 4.48493774