108 Lattice="12.717796394137876 0.0 0.0 0.0 12.717796394137876 0.0 0.0 0.0 12.717796394137876" Properties=species:S:1:pos:R:3:forces:R:3 energy=-292.74849739571005 stress="0.0537205867456217 4.3667611366306214e-05 -0.0007952052591426083 4.3667611366306214e-05 0.053642493220146935 -0.000335410342046606 -0.0007952052591426083 -0.000335410342046606 0.05446988136574955" free_energy=-292.74849739571005 pbc="F F F" Al 0.03002756 0.01422675 0.02213867 0.44216515 0.50172646 0.44243984 Al 2.12692434 2.19344879 0.07003742 0.02286212 -0.01518166 0.53974403 Al 2.05776275 0.07099219 2.13054949 0.23296097 0.51205104 0.06492483 Al 0.04878571 2.13880916 2.19145801 0.43195029 0.01303860 -0.08488038 Al 4.20362648 0.08364612 0.07481815 -0.00541328 0.56069553 0.56612843 Al 6.44330019 2.01546387 0.01368610 -0.13096060 0.28093820 0.35373174 Al 6.41453232 0.05645267 2.03693912 -0.08289771 0.38828029 0.26797075 Al 4.28177435 2.19367874 2.05392680 -0.21036789 -0.18792102 0.12674824 Al 8.55361586 0.06559007 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