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=-75.19736371206606 stress="-0.004689267628865712 0.00013756057753007482 -0.00017569799148770557 0.00013756057753007482 -0.005657083642836951 -0.00016274620775854227 -0.00017569799148770557 -0.00016274620775854227 -0.005417895731584161" free_energy=-75.19736371206606 pbc="F F F" Ni 20.88909689 21.13714415 21.07420351 -10.39407835 -7.49398061 -20.08437248 Ni 22.70960170 22.21726994 20.83833517 -5.47069287 4.97408772 -5.07529407 Ni 22.04389311 20.83509776 22.34219889 6.95919929 -17.31821009 1.61513167 Ni 21.07687608 22.29169857 22.20924639 -14.15878551 13.58994698 5.94181091 Ni 23.73816064 20.95894820 21.26094925 11.90464689 -8.61001828 -5.00066203 Ni 25.31149766 22.20865944 20.84743642 1.53994925 -8.65089677 -4.27820750 Ni 25.28802619 21.22277084 22.68584377 4.04002605 -13.84024612 -21.62939453 Ni 24.18362810 22.69581920 22.56686874 -12.10162000 -14.71735621 1.50861923 Ni 21.47029608 23.87969192 20.85196026 4.90828234 5.56808455 2.93471669 Ni 22.70996341 25.49207130 21.15300231 -7.15065464 17.05942621 -27.82523341 Ni 22.53848316 23.95774659 22.41852158 -17.44002977 -19.84293838 -7.66991391 Ni 21.23976575 25.38825682 22.28042795 -2.37277315 3.40051191 -1.27520209 Ni 24.19178619 24.16348857 21.29140871 2.00051108 -0.69052669 -36.58286981 Ni 25.61455359 25.41046947 20.86809075 10.30177415 -0.56503561 -8.36436060 Ni 25.28091226 24.10691896 22.71228095 31.79411157 -5.95333678 21.19960709 Ni 23.80598025 25.32157598 22.51361598 -18.60130918 36.12250094 11.17804907 Ni 20.99501107 21.08610401 24.27277051 -22.14169520 -19.22099154 -29.22073318 Ni 22.29258293 22.33127571 23.99451428 7.13920311 0.98483628 -1.79671702 Ni 22.25460703 20.99629482 25.37656677 21.73690933 -22.92750047 20.60595106 Ni 21.08417477 22.05822276 25.57917971 -23.82980051 16.53428690 32.16243200 Ni 24.27219963 20.93381326 24.13132919 -0.05806538 -13.07796633 11.57218619 Ni 25.75978669 22.22592512 23.78504734 21.98738772 9.01443118 14.82948137 Ni 25.71643430 21.10260697 25.45709467 -2.31299821 1.11236380 -0.45800575 Ni 23.75683077 22.23028762 25.48810560 7.99820228 5.01801222 3.70627079 Ni 21.42581781 24.01286824 23.70384695 -0.27989625 -3.24679802 -4.42949199 Ni 22.71219253 25.42485375 24.12990665 -3.65862565 36.88164160 3.42654803 Ni 22.28220450 24.28278197 25.56210000 -8.57202080 -11.45256532 23.32714649 Ni 21.13362859 25.26003534 25.29036912 -7.77172901 6.38943167 -0.23781404 Ni 23.82548900 24.05473499 23.91561068 -6.66835840 -9.40928452 12.75963411 Ni 25.63661615 25.40480033 23.79381063 12.23293194 18.43439058 2.03268205 Ni 25.29869006 24.11041876 25.23247803 6.10506777 -9.60117028 -5.33869080 Ni 23.83533445 25.24148635 25.58611608 12.33493011 11.53486945 10.46669647