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=-47.88056113619977 stress="0.00040945473530542057 3.939762100371589e-05 2.9808077306313606e-05 3.939762100371589e-05 0.0003789237083301751 4.8921196374229636e-05 2.9808077306313606e-05 4.8921196374229636e-05 0.0004074866720970518" pbc="F F F" Ni 20.82702941 21.07034430 21.04852473 1.35854961 1.26852481 1.39179413 Ni 22.55473499 22.41561068 22.63661615 0.11309526 1.50978170 -2.00313014 Ni 23.90480033 20.87719504 20.79869006 -0.71691232 1.70764140 1.70778288 Ni 25.61041876 22.26735611 22.33533445 -2.34351974 0.87654082 0.51343257 Ni 20.74148635 24.08611608 21.03369179 1.39913305 -1.22693349 1.30942580 Ni 22.52598936 25.22329650 22.31030927 0.76833131 -1.22428856 0.29129081 Ni 23.90583543 23.75559716 20.70178472 -0.29044634 -0.84735091 2.12899983 Ni 25.79874826 25.27290972 22.38090187 -1.75262550 -1.54770958 0.85113852 Ni 20.86136659 21.05835534 23.74645637 1.35019816 1.19968143 -0.49099150 Ni 22.48193431 22.42001865 25.70070203 0.34726094 0.53870596 -2.42534492 Ni 23.57584194 20.90085166 23.82024391 0.59875150 0.56469400 0.42184850 Ni 25.78187239 22.51001192 25.48453339 -1.70316452 0.98607444 -1.43734360 Ni 21.10170120 23.87793365 23.71904386 0.88321447 -0.41546393 0.40090393 Ni 22.50082602 25.74624097 25.64302402 0.88515856 -1.37640030 -1.20761049 Ni 23.76548053 24.11042859 24.20947124 0.11502544 -0.92298319 -0.53513606 Ni 25.35512851 25.55280714 25.41333883 -1.01204988 -1.09051458 -0.91706028