16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-65.70001410898418 stress="-0.001203075270192909 0.00018289639756823516 6.0327745266903434e-05 0.00018289639756823516 -0.0009146369966106747 -0.0003454239519692072 6.0327745266903434e-05 -0.0003454239519692072 -0.0011259384842605814" pbc="F F F" Pt 20.91870436 21.04860922 21.20118821 0.68033117 0.31085434 0.50642605 Pt 22.70960170 22.31143450 22.33833517 -5.43363582 7.47542461 -0.31122950 Pt 23.78829595 20.83509776 21.14041416 3.88505656 -6.57226873 -5.95422850 Pt 25.27812781 22.79098848 22.26215777 5.35537083 -1.93035753 1.77966488 Pt 21.00812325 24.21873489 21.38625107 -12.68764557 -7.79917368 -7.64404373 Pt 22.56504129 25.20865944 22.36550211 -10.11657732 27.63876113 20.54223953 Pt 23.78802619 24.22277084 21.18584377 18.15638760 -10.29650848 -22.73556730 Pt 25.68362810 25.49167323 22.59494463 -1.27134302 -1.38344989 0.49740890 Pt 21.49053896 21.40797779 24.03592806 -6.53263875 -6.04742122 0.26988679 Pt 22.53179838 22.70426383 25.57785606 3.83888625 -0.31526383 7.11601358 Pt 24.16838981 20.95774659 23.70072608 1.42747691 -2.37975852 2.62332332 Pt 25.51999336 22.52188541 25.09744544 0.06764394 0.70448106 0.19062628 Pt 21.19178619 24.24929948 24.33993344 -7.73337137 -1.82357156 -4.13473716 Pt 22.66928858 25.44814650 25.55384723 1.57494242 6.19631486 6.27818331 Pt 23.78091226 24.10609294 23.96603997 6.71224968 -4.19921827 -0.06165906 Pt 25.18317529 25.12026604 25.62403475 2.07686651 0.42115572 1.03769261