# generated using pymatgen
data_Ta12ReIr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15362165
_cell_length_b   5.15241668
_cell_length_c   10.29316353
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta12ReIr3
_chemical_formula_sum   'Ta12 Re1 Ir3'
_cell_volume   273.32061063
_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  0.00000000  0.50000000  0.37450604  1.0
  Ta  Ta1  1  0.00000000  0.50000000  0.87604559  1.0
  Ta  Ta2  1  0.50000000  0.25017993  0.00000000  1.0
  Ta  Ta3  1  0.50000000  0.24929350  0.50000000  1.0
  Ta  Ta4  1  0.75077825  0.00000000  0.25151065  1.0
  Ta  Ta5  1  0.75077825  0.00000000  0.74848935  1.0
  Ta  Ta6  1  0.00000000  0.50000000  0.12395441  1.0
  Ta  Ta7  1  0.00000000  0.50000000  0.62549396  1.0
  Ta  Ta8  1  0.50000000  0.74982007  0.00000000  1.0
  Ta  Ta9  1  0.50000000  0.75070650  0.50000000  1.0
  Ta  Ta10  1  0.24922175  0.00000000  0.25151065  1.0
  Ta  Ta11  1  0.24922175  0.00000000  0.74848935  1.0
  Re  Re12  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir13  1  0.50000000  0.50000000  0.24862736  1.0
  Ir  Ir14  1  0.50000000  0.50000000  0.75137264  1.0
  Ir  Ir15  1  0.00000000  0.00000000  0.00000000  1.0