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=-41.30343407601594 stress="0.00026265478518738134 4.6368954647934875e-05 4.6790538300656685e-05 4.6368954647934875e-05 0.0002658474809855882 -1.0540633764148761e-05 4.6790538300656685e-05 -1.0540633764148761e-05 0.00024541078812769174" free_energy=-41.30343407601594 pbc="F F F" Ni 20.85540510 21.11115480 21.11044915 1.30719393 1.09440788 1.09142102 Ni 22.70960170 22.31143450 22.33833517 -1.22735660 2.69151638 1.25869559 Ni 23.64028300 20.89839703 21.14041416 0.25090442 -0.53400656 -0.12132837 Ni 25.27812781 22.51878885 22.32834452 -0.96235691 0.54658769 0.96496971 Ni 20.87679405 23.95894820 21.20259391 1.15336228 -1.32269011 0.84415740 Ni 22.56504129 25.20865944 22.36550211 -1.66803101 1.24237093 1.71651850 Ni 23.78802619 24.22277084 21.18584377 1.58888528 -1.52916851 -0.59102738 Ni 25.68362810 25.69581920 22.64685009 -1.85435992 -1.65398049 0.83752129 Ni 21.26959405 21.17626233 23.85402479 0.83962097 0.82736363 -0.33814328 Ni 22.70996341 22.49207130 25.65300231 0.60492437 0.67028159 -1.61682604 Ni 24.03848316 20.95774659 23.91852158 -0.98029150 0.87847634 -0.53713720 Ni 25.45789336 22.38825682 25.27041603 -1.28780573 1.41430118 -0.92951290 Ni 21.19178619 24.17895518 24.29140871 0.98943486 -1.25361551 -1.15060383 Ni 22.61455359 25.53253581 25.64904689 1.14889138 -0.86043292 -0.57195935 Ni 23.78091226 24.10609294 23.90349439 1.12342183 -1.24869909 0.43340149 Ni 25.30598025 25.32157598 25.51361598 -1.02643765 -0.96271244 -1.29014666