# generated using pymatgen
data_Ta3Ti(NbIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15989420
_cell_length_b   5.14130001
_cell_length_c   5.08631956
_cell_angle_alpha   89.98822743
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3Ti(NbIr)2
_chemical_formula_sum   'Ta3 Ti1 Nb2 Ir2'
_cell_volume   134.93275172
_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
  Ta  Ta0  1  0.50000000  0.75031436  0.99623704  1.0
  Ta  Ta1  1  0.25000351  0.99930843  0.50346084  1.0
  Ta  Ta2  1  0.74999649  0.99930843  0.50346084  1.0
  Ti  Ti3  1  0.00000000  0.50074515  0.74981185  1.0
  Nb  Nb4  1  0.50000000  0.24978835  0.99659436  1.0
  Nb  Nb5  1  0.00000000  0.50044590  0.25054336  1.0
  Ir  Ir6  1  0.50000000  0.50209910  0.50033394  1.0
  Ir  Ir7  1  0.00000000  0.99799028  0.99955678  1.0