# generated using pymatgen data_Ti12Ga7Cu5O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.03032910 _cell_length_b 8.00431159 _cell_length_c 8.03032916 _cell_angle_alpha 59.89242180 _cell_angle_beta 60.00000375 _cell_angle_gamma 59.89242055 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti12Ga7Cu5O4 _chemical_formula_sum 'Ti12 Ga7 Cu5 O4' _cell_volume 364.39095526 _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 0.93208138 0.56715765 0.56867960 1.0 Ti Ti1 1 0.68198687 0.31918182 0.68198687 1.0 Ti Ti2 1 0.93208138 0.56715765 0.93208138 1.0 Ti Ti3 1 0.56526738 0.93563238 0.93383286 1.0 Ti Ti4 1 0.31627048 0.68410847 0.31627048 1.0 Ti Ti5 1 0.56526738 0.93563238 0.56526738 1.0 Ti Ti6 1 0.68335058 0.68410847 0.31627048 1.0 Ti Ti7 1 0.93383286 0.93563238 0.56526738 1.0 Ti Ti8 1 0.31684344 0.31918182 0.68198687 1.0 Ti Ti9 1 0.68198687 0.31918182 0.31684344 1.0 Ti Ti10 1 0.56867960 0.56715765 0.93208138 1.0 Ti Ti11 1 0.31627048 0.68410847 0.68335058 1.0 Ga Ga12 1 0.25664274 0.91400927 0.91467399 1.0 Ga Ga13 1 0.33671166 0.32784460 0.33671166 1.0 Ga Ga14 1 0.33671166 0.32784460 0.99873209 1.0 Ga Ga15 1 0.91437869 0.25686494 0.91437869 1.0 Ga Ga16 1 0.91467399 0.91400927 0.91467399 1.0 Ga Ga17 1 0.99873209 0.32784460 0.33671166 1.0 Ga Ga18 1 0.91467399 0.91400927 0.25664274 1.0 Cu Cu19 1 0.33461041 0.99616776 0.33461041 1.0 Cu Cu20 1 0.12572639 0.62281982 0.12572639 1.0 Cu Cu21 1 0.12466127 0.12322925 0.62744721 1.0 Cu Cu22 1 0.62744721 0.12322925 0.12466127 1.0 Cu Cu23 1 0.12466127 0.12322925 0.12466127 1.0 O O24 1 0.62479636 0.12561192 0.62479636 1.0 O O25 1 0.62325595 0.62834941 0.12513970 1.0 O O26 1 0.12513970 0.62834941 0.62325595 1.0 O O27 1 0.62325595 0.62834941 0.62325595 1.0