# generated using pymatgen
data_Ti2CuIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.23840006
_cell_length_b   10.23840006
_cell_length_c   10.23840006
_cell_angle_alpha   124.43787893
_cell_angle_beta   119.47041169
_cell_angle_gamma   86.70445487
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2CuIr
_chemical_formula_sum   'Ti2 Cu1 Ir1'
_cell_volume   733.29773450
_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  0.00000000  0.27053700  0.27053700  1.0
  Ti  Ti1  1  0.00000000  0.72946300  0.72946300  1.0
  Cu  Cu2  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir3  1  0.00000000  0.50000000  0.50000000  1.0