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=30.12273352329534 stress="-3.8592446548116044 0.2535728263803041 -0.21142252303800088 0.2535728263803041 -3.818794719186993 -0.3062397659566474 -0.21142252303800088 -0.3062397659566474 -4.365098799484945" pbc="T T T" Al -0.14459490 0.11115480 0.11044915 11.11988852 -22.86614357 -6.27226524 Al 1.70960170 1.31143450 -0.16166483 -17.62961331 19.10149502 3.48313232 Al 1.28829595 0.03769167 1.64041416 -3.74881775 -15.66538193 -5.33446341 Al -0.22187219 1.22744829 1.32834452 10.25854254 19.43003048 8.12359634