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=2.6026411685975273 stress="-0.0005441197762832317 -0.00021194064951687828 -0.00014874443124828957 -0.00021194064951687828 -0.000558188411090767 1.193882465748886e-05 -0.00014874443124828957 1.193882465748886e-05 -0.00038481392719911975" pbc="F F F" Mg 21.17019426 21.22862372 21.03788326 -0.24264641 -0.25075672 -0.18958287 Mg 22.67940646 22.69603867 22.47611627 -2.01624099 -0.05310799 1.54624104 Mg 24.06681647 21.25967277 21.04898242 0.31481892 -0.86887290 -0.83652182 Mg 25.46259055 22.71561118 22.64811419 1.32789199 -1.11237660 0.35680797 Mg 20.86989581 24.06442547 20.85502028 0.11094128 -0.02135261 0.11528871 Mg 22.15304512 25.44172237 23.02813538 4.20873644 4.69782221 -3.72048871 Mg 24.01223184 24.11520895 21.23445950 -6.43830657 -4.90516561 -9.31765706 Mg 25.24600233 25.33849946 22.41564463 7.61198608 7.96194708 6.64582662 Mg 21.26193617 21.12309286 24.00436195 -4.23985467 0.04006412 0.07904987 Mg 22.39042759 22.94933243 25.67461572 -0.13752721 -0.55967071 0.55530120 Mg 23.52679263 20.97019266 23.98465646 4.43446660 -1.04810478 0.53710035 Mg 25.21002265 22.49647785 25.44055401 3.87497302 -5.88487632 4.35767567 Mg 20.83241945 23.87537206 23.80977503 -4.61311745 -4.58518944 2.31136831 Mg 22.22517603 25.58725191 25.46565105 0.09947016 0.32002806 1.23321068 Mg 24.21523513 24.05719781 24.32221033 -8.41708840 2.07537372 -6.36374426 Mg 25.61837158 25.48373751 25.23026107 4.12149723 4.19423850 2.69012430