# generated using pymatgen data_Li2Ni5(PRu)7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.23066174 _cell_length_b 9.20546219 _cell_length_c 3.65138197 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.70909646 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Ni5(PRu)7 _chemical_formula_sum 'Li2 Ni5 P7 Ru7' _cell_volume 266.75870313 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Li Li0 1 0.99956622 0.00038767 0.00000000 1.0 Li Li1 1 0.33506874 0.67050261 0.50000000 1.0 Ni Ni2 1 0.30293820 0.90091037 0.00000000 1.0 Ni Ni3 1 0.60071371 0.69810119 0.00000000 1.0 Ni Ni4 1 0.82805064 0.61686626 0.00000000 1.0 Ni Ni5 1 0.77924030 0.16885208 0.00000000 1.0 Ni Ni6 1 0.39022235 0.21356134 0.00000000 1.0 P P7 1 0.66703633 0.33432732 0.00000000 1.0 P P8 1 0.08063429 0.63245061 0.00000000 1.0 P P9 1 0.54585934 0.91450273 0.00000000 1.0 P P10 1 0.37292510 0.44923906 0.00000000 1.0 P P11 1 0.79446760 0.74646007 0.50000000 1.0 P P12 1 0.95267634 0.21286214 0.50000000 1.0 P P13 1 0.25852039 0.04803500 0.50000000 1.0 Ru Ru14 1 0.10041469 0.40051809 0.00000000 1.0 Ru Ru15 1 0.06031979 0.77258434 0.50000000 1.0 Ru Ru16 1 0.71010426 0.93919863 0.50000000 1.0 Ru Ru17 1 0.23081902 0.28133272 0.50000000 1.0 Ru Ru18 1 0.86714514 0.41504895 0.50000000 1.0 Ru Ru19 1 0.53925343 0.12083826 0.50000000 1.0 Ru Ru20 1 0.58402612 0.46341753 0.50000000 1.0