# generated using pymatgen data_LiMgP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.32241566 _cell_length_b 9.32241546 _cell_length_c 3.87358482 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000229 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiMgP7Ru12 _chemical_formula_sum 'Li1 Mg1 P7 Ru12' _cell_volume 291.54165047 _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 0.00000000 0.00000000 0.00000000 1.0 Mg Mg1 1 0.33333300 0.66666700 0.50000000 1.0 P P2 1 0.66666700 0.33333300 0.00000000 1.0 P P3 1 0.07700561 0.64477670 0.00000000 1.0 P P4 1 0.56777209 0.92299439 0.00000000 1.0 P P5 1 0.35522330 0.43222791 0.00000000 1.0 P P6 1 0.78181020 0.73442968 0.50000000 1.0 P P7 1 0.95261948 0.21818980 0.50000000 1.0 P P8 1 0.26557032 0.04738052 0.50000000 1.0 Ru Ru9 1 0.10431557 0.41806686 0.00000000 1.0 Ru Ru10 1 0.31375029 0.89568443 0.00000000 1.0 Ru Ru11 1 0.58193314 0.68624971 0.00000000 1.0 Ru Ru12 1 0.81735308 0.60903472 0.00000000 1.0 Ru Ru13 1 0.79168264 0.18264692 0.00000000 1.0 Ru Ru14 1 0.39096528 0.20831736 0.00000000 1.0 Ru Ru15 1 0.05998882 0.77789140 0.50000000 1.0 Ru Ru16 1 0.71790258 0.94001118 0.50000000 1.0 Ru Ru17 1 0.22210860 0.28209742 0.50000000 1.0 Ru Ru18 1 0.87335039 0.42169148 0.50000000 1.0 Ru Ru19 1 0.54834109 0.12664961 0.50000000 1.0 Ru Ru20 1 0.57830852 0.45165891 0.50000000 1.0