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=-18.699583151536903 stress="-0.0014085926548533566 8.299787120487947e-05 7.908235238172552e-05 8.299787120487947e-05 -0.0011546030917761328 -0.00042859895295538326 7.908235238172552e-05 -0.00042859895295538326 -0.0012836641705978725" pbc="F F F" Au 20.91870436 21.04860922 21.20118821 -1.43004039 -0.86933937 -1.01000374 Au 22.70960170 22.31143450 22.33833517 -4.96481662 7.60355534 3.29859082 Au 23.78829595 20.83509776 21.14041416 5.16929002 -8.32397887 -6.99235620 Au 25.27812781 22.79098848 22.26215777 7.12760761 -3.47136918 1.65399437 Au 20.87679405 24.09027739 21.46238060 -8.24761788 -4.94482375 -4.24124593 Au 22.56504129 25.20865944 22.36550211 -17.88755635 27.40645087 18.43163363 Au 23.78802619 24.22277084 21.18584377 18.65028090 -11.62277658 -26.95538190 Au 25.40955323 25.48086654 22.83050726 3.38574941 2.98454514 -0.74649779 Au 21.26959405 21.37914956 23.93745809 -8.24433712 -6.49627989 -2.18413125 Au 22.50581744 22.44016584 25.47483729 5.68102409 1.07084932 8.47138625 Au 24.25067569 20.95774659 23.84337532 0.27974867 -2.58648652 1.10275268 Au 25.58780002 22.17046132 25.55319800 0.20211686 1.35832571 0.53904101 Au 21.19178619 24.24105518 24.42503730 -10.42813646 -5.04998165 -6.60225189 Au 22.44158300 25.53253581 25.64904689 6.29702708 7.67850638 7.51293595 Au 23.78091226 24.10609294 23.96603997 4.17938374 -4.71992314 7.31217648 Au 25.37632455 25.37010071 25.56835097 0.23027645 -0.01727380 0.40935751