data_[Er8Ga2Ir4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Ga  1.8100  1.3000  0.7600
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.0901]
_cell_length_b [7.1141]
_cell_length_c [7.3868]
_cell_angle_alpha [106.2492]
_cell_angle_beta [107.2713]
_cell_angle_gamma [104.2128]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Er4GaIr2]
_chemical_formula_sum '[Er8 Ga2 Ir4]'
_cell_volume [318.8794]
_cell_formula_units_Z [2]
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
[
  Er  Er0  1  0.1016  0.3253  0.3252  1.0
  Er  Er1  1  0.1606  0.4951  0.9168  1.0
  Er  Er2  1  0.2744  0.9064  0.3828  1.0
  Er  Er3  1  0.5248  0.2696  0.1306  1.0
  Er  Er4  1  0.5495  0.4499  0.7203  1.0
  Er  Er5  1  0.6833  0.8279  0.1794  1.0
  Er  Er6  1  0.7327  0.0322  0.7962  1.0
  Er  Er7  1  0.9205  0.6847  0.5446  1.0
  Ga  Ga8  1  0.1138  0.9487  0.9828  1.0
  Ga  Ga9  1  0.7983  0.2245  0.5137  1.0
  Ir  Ir10  1  0.1518  0.1202  0.6737  1.0
  Ir  Ir11  1  0.3696  0.8021  0.8107  1.0
  Ir  Ir12  1  0.4894  0.6360  0.4174  1.0
  Ir  Ir13  1  0.8796  0.5274  0.1058  1.0
]