# generated using pymatgen data_Ti6Be15Cu8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.56897432 _cell_length_b 7.56897849 _cell_length_c 7.56897547 _cell_angle_alpha 60.00169905 _cell_angle_beta 60.00174262 _cell_angle_gamma 60.00169265 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti6Be15Cu8 _chemical_formula_sum 'Ti6 Be15 Cu8' _cell_volume 306.62901906 _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 0.69740159 0.30259431 0.30259273 1.0 Ti Ti1 1 0.30259133 0.69740837 0.69740661 1.0 Ti Ti2 1 0.30259160 0.69740442 0.30259524 1.0 Ti Ti3 1 0.69740552 0.30259443 0.69740876 1.0 Ti Ti4 1 0.30258946 0.30259468 0.69740497 1.0 Ti Ti5 1 0.69740332 0.69740849 0.30259496 1.0 Be Be6 1 0.32650642 0.32650965 0.32650918 1.0 Be Be7 1 0.67349009 0.67349281 0.67349329 1.0 Be Be8 1 0.32649850 0.32650068 0.02048951 1.0 Be Be9 1 0.32649818 0.02048868 0.32650113 1.0 Be Be10 1 0.67349791 0.67350086 0.97950979 1.0 Be Be11 1 0.67349817 0.97950917 0.67350133 1.0 Be Be12 1 0.02049175 0.32649897 0.32649963 1.0 Be Be13 1 0.97951238 0.67349899 0.67349904 1.0 Be Be14 1 0.49999681 0.99999534 0.00000629 1.0 Be Be15 1 0.99999896 0.50001017 0.49999040 1.0 Be Be16 1 0.99999347 0.50000386 0.00000414 1.0 Be Be17 1 0.50000238 0.00000204 0.49999152 1.0 Be Be18 1 0.99999851 0.00000062 0.49999176 1.0 Be Be19 1 0.49999550 0.50000379 0.00000538 1.0 Be Be20 1 -0.00000246 0.00000162 0.00000234 1.0 Cu Cu21 1 0.12199653 0.12198531 0.12198916 1.0 Cu Cu22 1 0.87801650 0.87800091 0.87800797 1.0 Cu Cu23 1 0.12200144 0.12198654 0.63402511 1.0 Cu Cu24 1 0.12199747 0.63402642 0.12198939 1.0 Cu Cu25 1 0.87801630 0.87800512 0.36597489 1.0 Cu Cu26 1 0.87801672 0.36597577 0.87800784 1.0 Cu Cu27 1 0.63402219 0.12198967 0.12199745 1.0 Cu Cu28 1 0.36597147 0.87800931 0.87801221 1.0