# generated using pymatgen
data_LaEr2IrO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.41194497
_cell_length_b   6.41194518
_cell_length_c   7.42550032
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   109.76692747
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaEr2IrO7
_chemical_formula_sum   'La2 Er4 Ir2 O14'
_cell_volume   287.29632522
_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
  La  La0  1  0.00000000  0.00000000  0.50000000  1.0
  La  La1  1  0.00000000  0.00000000  0.00000000  1.0
  Er  Er2  1  0.51313657  0.06222578  0.25000000  1.0
  Er  Er3  1  0.93777422  0.48686343  0.75000000  1.0
  Er  Er4  1  0.48686343  0.93777422  0.75000000  1.0
  Er  Er5  1  0.06222578  0.51313657  0.25000000  1.0
  Ir  Ir6  1  0.50000000  0.50000000  0.50000000  1.0
  Ir  Ir7  1  0.50000000  0.50000000  0.00000000  1.0
  O  O8  1  0.44604049  0.18159252  0.53533575  1.0
  O  O9  1  0.81840748  0.55395951  0.46466425  1.0
  O  O10  1  0.44604049  0.18159252  0.96466425  1.0
  O  O11  1  0.81840748  0.55395951  0.03533575  1.0
  O  O12  1  0.55395951  0.81840748  0.46466425  1.0
  O  O13  1  0.18159252  0.44604049  0.53533575  1.0
  O  O14  1  0.55395951  0.81840748  0.03533575  1.0
  O  O15  1  0.18159252  0.44604049  0.96466425  1.0
  O  O16  1  0.16198340  0.87372438  0.25000000  1.0
  O  O17  1  0.12627562  0.83801660  0.75000000  1.0
  O  O18  1  0.83801660  0.12627562  0.75000000  1.0
  O  O19  1  0.87372438  0.16198340  0.25000000  1.0
  O  O20  1  0.39712770  0.39712770  0.25000000  1.0
  O  O21  1  0.60287230  0.60287230  0.75000000  1.0