# generated using pymatgen
data_Ti3Ir2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.40204301
_cell_length_b   4.40204446
_cell_length_c   5.38350798
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998913
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3Ir2W
_chemical_formula_sum   'Ti3 Ir2 W1'
_cell_volume   90.34512991
_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  0.33333300  0.66666700  0.66400768  1.0
  Ti  Ti1  1  0.66666700  0.33333300  0.33599232  1.0
  Ti  Ti2  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir3  1  0.33333300  0.66666700  0.16325428  1.0
  Ir  Ir4  1  0.66666700  0.33333300  0.83674572  1.0
  W  W5  1  0.00000000  0.00000000  0.50000000  1.0