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=-37.70277975199958 stress="0.00030588918889090097 5.500681185835035e-05 5.3857995944370814e-05 5.500681185835035e-05 0.00030086219930923247 -7.94672782506856e-06 5.3857995944370814e-05 -7.94672782506856e-06 0.0002831724369566805" pbc="F F F" Ni 20.85540510 21.11115480 21.11044915 1.27174113 1.05183641 1.08239945 Ni 22.70960170 22.31143450 22.33833517 -0.85687350 2.10156130 1.27579700 Ni 23.64028300 20.83509776 21.14041416 0.09198727 -0.04121389 0.20375946 Ni 25.27812781 22.51878885 22.32834452 -1.43511465 0.58121913 1.05354454 Ni 20.87679405 23.95894820 21.20259391 1.32664287 -1.13822401 1.06007612 Ni 22.56504129 25.20865944 22.36550211 -1.79669388 0.95524582 2.13769423 Ni 23.78802619 24.22277084 21.18584377 1.61173786 -1.98846787 -0.71158820 Ni 25.68362810 25.69581920 22.64685009 -1.55964318 -1.45573154 0.77420187 Ni 21.26959405 21.17626233 23.85402479 1.14086896 1.10419372 -0.58342063 Ni 22.70996341 22.49207130 25.65300231 0.65556825 0.73654911 -1.77712291 Ni 24.03848316 20.95774659 23.91852158 -0.79496996 1.27396849 -0.48545665 Ni 25.45789336 22.38825682 25.27041603 -1.47040962 1.12345706 -1.09759972 Ni 21.19178619 24.17895518 24.29140871 1.48005421 -1.01462857 -0.98087349 Ni 22.61455359 25.53253581 25.64904689 0.99521215 -1.10744632 -0.94291894 Ni 23.78091226 24.10609294 23.94171539 0.54883991 -1.16471872 0.19666787 Ni 25.30598025 25.32157598 25.51361598 -1.20894781 -1.01760012 -1.20516002