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=-43.60366174354817 stress="0.00016884751173654018 8.021102216282908e-05 5.407510384115522e-05 8.021102216282908e-05 0.00013271773881735327 -3.3448344216451263e-05 5.407510384115522e-05 -3.3448344216451263e-05 0.00011993628435062747" free_energy=-43.60366174354817 pbc="F F F" Ni 20.85540510 21.11115480 21.11044915 1.00671814 0.73289825 0.84639180 Ni 22.70960170 22.31143450 22.33833517 -1.38710956 2.17177907 1.02837286 Ni 23.64028300 20.83509776 21.11608958 0.57453811 -1.05705104 -0.34802347 Ni 25.27812781 22.51878885 22.32834452 -0.95271435 0.27215846 0.51082430 Ni 20.87679405 23.95894820 21.20259391 1.01542992 -1.04697270 0.37201770 Ni 22.56504129 25.20865944 22.36550211 -3.74960696 3.72088413 2.74378296 Ni 23.78802619 24.22277084 21.18584377 2.78288797 -2.77915324 -2.61947187 Ni 25.68362810 25.69581920 22.64685009 -1.34601901 -1.01976625 0.44902814 Ni 21.26959405 21.17626233 23.91732405 0.74292822 0.69191099 -0.31815388 Ni 22.64741783 22.49207130 25.65300231 0.46576708 0.45097459 -1.21131206 Ni 24.03848316 20.95774659 23.91852158 -0.69816776 0.89986221 -0.41698353 Ni 25.45789336 22.38825682 25.27041603 -0.94578825 0.87114188 -0.66229708 Ni 21.19178619 24.17895518 24.29140871 0.84102966 -0.86641754 -0.82265575 Ni 22.61455359 25.53253581 25.64904689 0.80909137 -0.72699469 -0.64996282 Ni 23.78091226 24.10609294 23.74450855 1.71392489 -1.58121405 2.08429879 Ni 25.30598025 25.32157598 25.51361598 -0.87290945 -0.73404006 -0.98585608