500 Lattice="20.73857903858606 0.0 0.0 0.0 20.73857903858606 0.0 0.0 0.0 20.73857903858606" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1055.4340074890777 stress="-0.002126712968238947 -0.00012101049430779424 0.00011492492832724591 -0.00012101049430779424 -0.002204190677518283 0.0001280644249166675 0.00011492492832724591 0.0001280644249166675 -0.002166191098069954" free_energy=-1055.4340074890777 pbc="F F F" Al 0.02634230 0.01660188 0.03071951 -0.35104202 -0.42641487 -0.35286950 Al 2.03971812 2.06076391 0.02483282 0.78075622 0.34191639 -0.70229575 Al 2.06498836 0.00799293 2.11137387 0.49700846 -0.72346748 0.10790663 Al 0.01506870 2.05063520 2.05611909 -0.74115073 0.54297230 0.57225122 Al 4.18787870 0.00287546 0.02167828 -0.15273536 -0.26309865 -0.41974676 Al 6.26300064 2.11011294 0.03198763 -0.15118911 0.27318406 -0.58109918 Al 6.19264990 0.03665532 2.05049726 0.11958012 -0.51657145 0.59414250 Al 4.11748821 2.07696532 2.10792577 0.19123120 0.47347674 0.11175184 Al 8.27462314 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