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=-24.597707498289868 stress="0.0001941610154222478 1.0336161383945494e-05 7.877379248148346e-07 1.0336161383945494e-05 0.00026314549623724867 2.731688899375454e-05 7.877379248148346e-07 2.731688899375454e-05 0.00018900114801821658" pbc="F F F" H 20.90332151 21.19410236 20.83096497 0.10083858 0.95042480 0.46640714 H 22.38201197 22.43300593 21.98431742 -0.36728191 0.22458135 -0.23455325 H 23.77696427 20.91661558 20.96512192 0.24118480 0.63580216 0.84643154 Ni 25.72586561 22.79391194 22.22614529 -1.50055383 0.26364173 0.68156971 Ni 21.02103145 23.77761356 21.18220204 1.09728525 -0.98939057 0.60818101 Ni 22.39362841 25.73573857 22.52724172 0.22576734 -1.37988116 0.64992314 H 23.90506368 23.92276860 20.84887301 -0.00918963 -0.04209209 0.43833206 H 25.72083292 25.28984966 22.78713085 -0.39344317 -0.67079237 0.08852474 Ni 20.92299150 20.90698366 24.36650915 1.10019356 0.77189408 -0.15235482 Ni 22.32825321 22.63102478 25.59995250 0.61893755 0.23732361 -1.13351467 Ni 24.26120756 21.01193751 24.25226748 -0.62750730 1.80735259 -0.24605105 H 25.46431997 22.49857443 25.57236142 -0.49357120 0.08527595 -0.46510386 H 21.27707274 24.23854596 23.96911903 0.09865230 0.22327748 0.03269728 Ni 22.28229695 25.52031036 25.68745344 0.59742409 -1.26067703 -1.08109384 Ni 24.14976952 23.75396636 24.43431934 0.13407378 -0.01017346 -0.05380350 H 25.37871118 25.25213077 25.23125112 -0.82281020 -0.84656706 -0.44559161