# generated using pymatgen
data_Nb5Ir7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.85367300
_cell_length_b   4.86285500
_cell_length_c   13.77393500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb5Ir7
_chemical_formula_sum   'Nb5 Ir7'
_cell_volume   191.14086867
_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
  Nb  Nb0  1  0.00000000  0.69175600  0.34046200  1.0
  Nb  Nb1  1  0.00000000  0.32999500  0.16612400  1.0
  Nb  Nb2  1  0.00000000  0.69175600  0.65953800  1.0
  Nb  Nb3  1  0.00000000  0.32999500  0.83387600  1.0
  Nb  Nb4  1  0.00000000  0.95331800  0.00000000  1.0
  Ir  Ir5  1  0.50000000  0.46288900  0.00000000  1.0
  Ir  Ir6  1  0.50000000  0.50963900  0.50000000  1.0
  Ir  Ir7  1  0.50000000  0.17805000  0.33595700  1.0
  Ir  Ir8  1  0.50000000  0.82629600  0.17013700  1.0
  Ir  Ir9  1  0.50000000  0.17805000  0.66404300  1.0
  Ir  Ir10  1  0.50000000  0.82629600  0.82986300  1.0
  Ir  Ir11  1  0.00000000  0.02196000  0.50000000  1.0