# generated using pymatgen data_Ti6Ga16Ru7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.66387251 _cell_length_b 8.66387251 _cell_length_c 8.66387251 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti6Ga16Ru7 _chemical_formula_sum 'Ti6 Ga16 Ru7' _cell_volume 459.85526203 _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 Ti Ti0 1 0.72332900 0.72332900 0.27667100 1.0 Ti Ti1 1 0.27667100 0.72332900 0.27667100 1.0 Ti Ti2 1 0.72332900 0.27667100 0.27667100 1.0 Ti Ti3 1 0.27667100 0.27667100 0.72332900 1.0 Ti Ti4 1 0.72332900 0.27667100 0.72332900 1.0 Ti Ti5 1 0.27667100 0.72332900 0.72332900 1.0 Ga Ga6 1 0.87689100 0.87689100 0.36932800 1.0 Ga Ga7 1 0.87689100 0.36932800 0.87689100 1.0 Ga Ga8 1 0.36932800 0.87689100 0.87689100 1.0 Ga Ga9 1 0.87689100 0.87689100 0.87689100 1.0 Ga Ga10 1 0.12310900 0.12310900 0.63067200 1.0 Ga Ga11 1 0.12310900 0.63067200 0.12310900 1.0 Ga Ga12 1 0.63067200 0.12310900 0.12310900 1.0 Ga Ga13 1 0.12310900 0.12310900 0.12310900 1.0 Ga Ga14 1 0.64786000 0.64786000 0.05642100 1.0 Ga Ga15 1 0.64786000 0.05642100 0.64786000 1.0 Ga Ga16 1 0.05642100 0.64786000 0.64786000 1.0 Ga Ga17 1 0.64786000 0.64786000 0.64786000 1.0 Ga Ga18 1 0.35214000 0.35214000 0.94357900 1.0 Ga Ga19 1 0.35214000 0.94357900 0.35214000 1.0 Ga Ga20 1 0.94357900 0.35214000 0.35214000 1.0 Ga Ga21 1 0.35214000 0.35214000 0.35214000 1.0 Ru Ru22 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru23 1 0.00000000 0.00000000 0.50000000 1.0 Ru Ru24 1 0.50000000 0.00000000 0.50000000 1.0 Ru Ru25 1 0.00000000 0.50000000 0.50000000 1.0 Ru Ru26 1 0.50000000 0.50000000 0.00000000 1.0 Ru Ru27 1 0.00000000 0.50000000 0.00000000 1.0 Ru Ru28 1 0.50000000 0.00000000 0.00000000 1.0