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=-39.371722201073666 stress="0.00032459218145768136 1.530235249517872e-05 -7.877291370076923e-05 1.530235249517872e-05 0.00028369957027166956 3.392276391657912e-05 -7.877291370076923e-05 3.392276391657912e-05 0.0003300400985645059" pbc="F F F" Ni 21.02598936 20.72329650 20.96375436 0.71485141 0.86707950 0.80228113 Ni 22.40583543 22.25559716 22.20178472 1.37787220 0.65119967 0.58490351 Ni 24.29874826 20.77290972 20.88090187 -1.22730449 0.95681907 1.03404049 Ni 25.36136659 22.43201670 22.24645637 -0.80706886 0.44763432 1.65783869 Ni 20.94291105 23.92001865 21.20070203 0.29765303 -1.00536024 0.55665889 Ni 22.20342959 25.40085166 22.49793547 0.56933417 -0.70928519 0.65807347 Ni 24.28187239 24.01001192 20.98453339 -1.99700732 -0.54159145 0.53119341 Ni 25.60170120 25.37793365 22.21904386 -0.57869995 -0.70790136 1.54862752 Ni 21.00082602 21.24624097 24.14302402 1.14226151 -0.40142605 -0.85201577 Ni 22.35498893 22.61042859 25.70947124 1.27814518 0.65274539 -1.27375072 Ni 23.85512851 21.05280714 23.91333883 -0.85491949 1.23994374 -0.68541380 Ni 25.34655491 22.37241235 25.32230844 -1.30294734 1.29217264 -1.14814576 Ni 20.91049160 23.50505727 23.93858073 1.32595984 1.51583640 -0.95405181 Ni 22.25205420 25.65488783 25.55988540 0.80245177 -1.74577941 -1.53188910 Ni 23.70245745 24.16431082 23.81425730 0.60320721 -1.23564516 0.33862404 Ni 25.48844065 25.53277713 25.39971974 -1.34378890 -1.27644188 -1.26697418