# generated using pymatgen data_Ti3Al(CuRh3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.26256223 _cell_length_b 6.03092946 _cell_length_c 12.77927400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Al(CuRh3)2 _chemical_formula_sum 'Ti6 Al2 Cu4 Rh12' _cell_volume 328.51950745 _cell_formula_units_Z 2 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 0.00000000 0.50000000 0.00828665 1.0 Ti Ti1 1 0.50000300 0.00000000 0.16781001 1.0 Ti Ti2 1 0.00000000 0.50000000 0.33218799 1.0 Ti Ti3 1 0.50000000 0.00000000 0.49171335 1.0 Ti Ti4 1 0.00000000 0.50000000 0.66052218 1.0 Ti Ti5 1 0.49999600 0.00000000 0.83947982 1.0 Al Al6 1 0.00000000 0.00000000 0.66734135 1.0 Al Al7 1 0.49999800 0.50000000 0.83266165 1.0 Cu Cu8 1 0.00000000 0.00000000 0.99942096 1.0 Cu Cu9 1 0.50000300 0.50000000 0.16550576 1.0 Cu Cu10 1 0.00000000 0.00000000 0.33449224 1.0 Cu Cu11 1 0.50000000 0.50000000 0.50057604 1.0 Rh Rh12 1 0.50000000 0.25371585 0.99759641 1.0 Rh Rh13 1 0.50000000 0.74628515 0.99759641 1.0 Rh Rh14 1 0.00000000 0.24821993 0.16750079 1.0 Rh Rh15 1 0.00000000 0.75178007 0.16750079 1.0 Rh Rh16 1 0.50000300 0.25178507 0.33249721 1.0 Rh Rh17 1 0.50000300 0.74821593 0.33249721 1.0 Rh Rh18 1 0.00000000 0.24628615 0.50240359 1.0 Rh Rh19 1 0.00000000 0.75371385 0.50240359 1.0 Rh Rh20 1 0.49999800 0.24653066 0.66843043 1.0 Rh Rh21 1 0.49999800 0.75347034 0.66843043 1.0 Rh Rh22 1 0.00000000 0.25346834 0.83157357 1.0 Rh Rh23 1 0.00000000 0.74653166 0.83157357 1.0