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=-61.62428560600371 stress="0.00013643811075676437 8.565281393833257e-05 6.052884823868945e-05 8.565281393833257e-05 0.00013790414935527056 -2.0290477904801874e-05 6.052884823868945e-05 -2.0290477904801874e-05 0.00011137886194359574" free_energy=-61.62428560600371 pbc="F F F" Ni 20.85540510 21.11115480 21.11044915 0.85433537 0.85285078 0.80799012 Ni 22.70960170 22.31143450 22.33833517 -0.95423086 1.60548525 -0.00252869 Ni 23.78829595 20.83509776 21.11608958 0.51120131 -0.38706324 -0.12072172 Ni 25.27812781 22.58208812 22.32834452 -0.89121085 0.05647107 0.54175273 Ni 20.87679405 23.95894820 21.20259391 0.80453942 -0.80712419 0.58471287 Ni 22.56504129 25.20865944 22.36550211 -4.61203698 3.18668430 2.51288109 Ni 23.78802619 24.22277084 21.18584377 3.58632381 -2.61292672 -2.62089714 Ni 25.68362810 25.69581920 22.64685009 -1.17324984 -1.22861769 0.48650885 Ni 21.26959405 21.17626233 23.79147921 0.55215058 0.60756839 0.28379500 Ni 22.48843198 22.48658558 25.65300231 0.54018150 0.25961465 -1.69936351 Ni 24.03848316 20.95774659 23.75978977 -0.47943141 0.75438246 0.27160865 Ni 25.45789336 22.38825682 25.27041603 -1.15367103 0.80274629 -0.89224009 Ni 21.19178619 24.17895518 24.29140871 0.80269126 -1.00953723 -0.85255271 Ni 22.61455359 25.53253581 25.49045389 0.89806922 -0.34576690 -0.11095773 Ni 23.78091226 24.10609294 23.78272134 1.43324710 -1.06470417 1.78138755 Ni 25.30598025 25.32157598 25.51361598 -0.71890860 -0.67006303 -0.97137528