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=-23.81239373927567 stress="-0.003995053208446296 0.00040957916691565765 -0.0003580305045611077 0.00040957916691565765 -0.004031688576216006 -0.00017779941160985544 -0.0003580305045611077 -0.00017779941160985544 -0.003941342060025835" free_energy=-23.81239373927567 pbc="F F F" Ni 20.88909689 21.11115480 21.11044915 -5.67124900 -5.53867787 -10.29460013 Ni 22.70960170 22.31143450 20.86432452 -11.39362016 18.55186994 -6.65103679 Ni 22.01159245 20.83509776 22.60416852 11.22076305 -8.83730880 -1.07023794 Ni 21.07687608 22.51878885 22.32834452 -5.55988405 7.37514264 2.42970118 Ni 23.64970377 20.95894820 21.08349577 12.79288094 -20.49698035 2.64650175 Ni 25.42640788 22.26701478 20.84743642 1.69362154 1.31915998 -2.62583994 Ni 25.20804484 21.22277084 22.68584377 1.18412872 -27.69014536 -30.77344459 Ni 24.18362810 22.69581920 22.64685009 -12.17418263 -8.19519141 -3.24305522 Ni 21.26959405 24.17626233 20.85402479 -5.94995077 -4.97651693 -9.08712387 Ni 22.70996341 25.49207130 21.15300231 -7.90755783 16.63094181 -16.01510817 Ni 22.73918519 23.95774659 22.12195116 -19.34213852 -14.27267075 14.33168016 Ni 20.95789336 25.38825682 22.27041603 -4.39286141 8.07738276 3.17860001 Ni 24.19178619 24.17895518 21.29140871 1.38711074 -10.64494822 -42.79325879 Ni 25.61455359 25.53253581 21.14904689 4.15414109 6.80663436 -3.94907690 Ni 25.28091226 24.10609294 22.46603997 30.57867956 -3.16975022 17.38988398 Ni 23.80598025 25.32157598 22.51361598 9.66583631 23.85718137 15.10186264 Ni 20.85198705 20.97567541 24.06329927 -13.02778506 -6.06527947 -0.49697499 Ni 22.33830608 22.27846858 23.99244975 6.04686745 9.11659754 -2.76721483 Ni 22.34126820 20.84140700 25.31668137 3.74296481 -8.47085798 7.27585449 Ni 20.91986395 22.24396547 25.59073906 -3.94522058 6.41009044 5.64789364 Ni 24.27219963 20.93381326 24.13132919 -11.41173698 -11.45467422 6.15356365 Ni 25.75978669 22.22592512 23.78504734 20.89419254 26.08820606 23.16388673 Ni 25.69366909 21.18742062 25.58343331 3.42335905 -2.23089862 3.74712291 Ni 23.89755523 22.32602819 25.43998877 -0.01594735 4.94503150 4.76331857 Ni 21.23171545 24.18190327 23.82266099 -3.93220920 -5.84525883 -1.24693974 Ni 22.71219253 25.42485375 24.12990665 -4.01754735 9.70623909 -8.33784991 Ni 22.28220450 24.28278197 25.56210000 20.49022914 -34.19840112 5.98516554 Ni 21.13362859 25.32702941 25.57034430 -31.10718343 28.11442095 6.94085249 Ni 24.04852473 24.05473499 23.91561068 -6.25662850 -5.73660911 4.26379854 Ni 25.63661615 25.40480033 24.12343602 5.68895854 11.80470365 -7.10153592 Ni 25.29869006 24.11041876 25.26735611 7.42683833 -11.87200426 11.69112649 Ni 23.83533445 25.24148635 25.58611608 5.71513104 10.89257140 11.74248491