32 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=-43.552124673619744 stress="-0.002604844073658491 -4.906943188893602e-05 -6.846486718825549e-05 -4.906943188893602e-05 -0.002359088719025672 -8.950805353184752e-05 -6.846486718825549e-05 -8.950805353184752e-05 -0.002686666007085717" free_energy=-43.552124673619744 pbc="F F F" Ni 20.83733940 21.11115480 21.11044915 -2.06073417 -3.48685563 -4.28629637 Ni 22.70960170 22.31143450 20.83833517 -1.24641113 2.20157335 -3.43962284 Ni 22.28829595 20.83509776 22.56043281 3.31164892 -4.16442420 -0.61740269 Ni 20.77812781 22.51878885 22.32834452 -3.46692387 2.01090099 1.93510712 Ni 24.07749608 20.95894820 21.20259391 -2.42955105 -5.62868264 -3.46916050 Ni 25.56504129 22.20865944 20.86550211 3.30638418 3.82998615 -3.54957500 Ni 25.28802619 21.22277084 22.68584377 6.71851489 -10.61840632 -6.63103298 Ni 24.18362810 22.69581920 22.64685009 -7.97922282 -5.80574977 -2.67017554 Ni 21.26959405 24.17626233 20.85402479 -6.58964078 -7.16016510 -9.30085193 Ni 22.41339299 25.49207130 21.15300231 5.37310062 9.79237067 -8.29749498 Ni 22.53848316 23.95774659 22.31937324 -0.03517966 -8.74056147 2.07083613 Ni 20.95789336 25.38825682 22.27041603 -8.51917833 9.30313147 2.81515894 Ni 24.18972166 24.17895518 21.29140871 0.40250342 -5.15074402 -15.50155273 Ni 25.61455359 25.53253581 21.14904689 3.09053732 3.02147467 -1.51017008 Ni 25.28091226 24.10609294 22.74791236 15.92294339 -3.12424339 -4.34147433 Ni 23.80598025 25.32157598 22.51361598 1.12292811 15.53869905 1.54599215 Ni 20.85198705 20.97567541 24.06329927 -7.48727939 -4.04230007 -3.10245400 Ni 22.43745442 22.27846858 24.00452620 2.15980754 6.52663572 -1.51342575 Ni 22.34126820 20.84140700 25.31668137 3.33186792 -6.80467139 5.32132678 Ni 20.91986395 22.24396547 25.59073906 -2.76566021 4.94201613 3.59836016 Ni 24.27219963 20.93381326 24.13132919 -6.43135219 -6.54515962 2.45304891 Ni 25.75978669 22.22592512 23.78504734 9.51605386 7.74859877 7.00259647 Ni 25.68365717 21.18742062 25.58343331 3.03372414 -1.45979082 4.07492013 Ni 23.89755523 22.32602819 25.72094491 -0.79404169 3.17672667 3.16898706 Ni 21.23171545 24.18190327 23.54087884 -6.53816904 -4.30643408 8.23783846 Ni 22.71219253 25.42485375 24.12990665 -3.54203203 10.37957545 -4.57597379 Ni 22.28220450 24.28278197 25.56210000 1.19343698 -13.20313475 5.26614436 Ni 21.13362859 25.32702941 25.57034430 -8.56455645 6.36517921 1.70846354 Ni 24.04852473 24.05473499 23.91561068 -7.18480331 -6.67859993 6.89978743 Ni 25.63661615 25.40480033 23.87802106 5.47426283 10.30558586 1.42718972 Ni 25.29869006 24.11041876 25.26735611 7.71284910 -5.66479741 7.06206959 Ni 23.83533445 25.24148635 25.58611608 3.96417291 7.44226642 8.21883657