# generated using pymatgen data_Li3Ni9As7Ru2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.34586535 _cell_length_b 9.39701641 _cell_length_c 3.67991144 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.33844127 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li3Ni9As7Ru2 _chemical_formula_sum 'Li3 Ni9 As7 Ru2' _cell_volume 278.92425304 _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 0.78993712 0.23288553 0.50000000 1.0 Li Li1 1 0.33149520 0.66792378 0.00000000 1.0 Li Li2 1 0.99393079 0.99567214 0.50000000 1.0 Ni Ni3 1 0.28354972 0.38457161 0.50000000 1.0 Ni Ni4 1 0.62149841 0.90269120 0.50000000 1.0 Ni Ni5 1 0.10279840 0.72002709 0.50000000 1.0 Ni Ni6 1 0.50008660 0.45477037 0.00000000 1.0 Ni Ni7 1 0.55182043 0.05179929 0.00000000 1.0 Ni Ni8 1 0.94908867 0.49279737 0.00000000 1.0 Ni Ni9 1 0.72161430 0.76516618 0.00000000 1.0 Ni Ni10 1 0.23441589 0.95721518 0.00000000 1.0 Ni Ni11 1 0.04819270 0.28298180 0.00000000 1.0 As As12 1 0.95770073 0.74981021 0.00000000 1.0 As As13 1 0.24636858 0.20627159 0.00000000 1.0 As As14 1 0.79660460 0.03710659 0.00000000 1.0 As As15 1 0.66367208 0.33460800 0.00000000 1.0 As As16 1 0.54124250 0.62641039 0.50000000 1.0 As As17 1 0.37669996 0.91824930 0.50000000 1.0 As As18 1 0.08989164 0.46478601 0.50000000 1.0 Ru Ru19 1 0.75632113 0.54631236 0.50000000 1.0 Ru Ru20 1 0.44307255 0.20794301 0.50000000 1.0