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=-66.03359564443659 stress="0.00026466059432117745 8.080965163835244e-05 7.713167053188733e-06 8.080965163835244e-05 0.0003273558443113858 5.9707841238443125e-05 7.713167053188733e-06 5.9707841238443125e-05 0.00020081259042931696" free_energy=-66.03359564443659 pbc="F F F" Ni 21.21219253 20.92485375 21.12990665 0.87607603 1.01255722 0.95748932 Ni 22.28220450 22.78278197 22.56210000 2.10298975 -2.17052945 -0.89836076 Ni 24.13362859 20.82702941 21.07034430 -0.74533712 1.46324396 1.30270936 Ni 25.54852473 22.69775901 22.41561068 -1.01236685 -0.34972579 0.47689385 Ni 21.13661615 23.75978927 20.87719504 0.75021941 -0.04585790 0.53043073 Ni 22.29869006 25.61041876 22.26735611 0.69946782 -2.08625494 0.52479309 Ni 23.94576304 23.74148635 21.08611608 -0.52200414 0.48767414 0.84737544 Ni 25.53369179 25.52598936 22.22329650 -1.22248803 -1.51409303 0.32422162 Ni 20.96375436 20.90583543 23.75559716 1.36949334 1.34693278 -0.42444864 Ni 22.20178472 22.79874826 25.27290972 2.31761849 -1.49965982 0.57829937 Ni 23.88090187 20.86136659 24.05835534 -0.61057220 1.90069104 -0.77904439 Ni 25.24645637 22.48193431 25.42001865 -0.73077466 0.31433046 -0.73708211 Ni 21.20070203 23.70342959 23.90085166 -1.91059478 2.86687269 -0.54339912 Ni 22.49793547 25.78187239 25.51001192 0.84182908 -1.55213245 -1.11231753 Ni 24.19400463 23.95682971 23.93074079 -1.03895294 0.72709765 -0.25822869 Ni 25.21904386 25.50082602 25.74624097 -1.16460318 -0.90114657 -0.78933154