# generated using pymatgen
data_Ca3ErIr8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.30773569
_cell_length_b   5.30773683
_cell_length_c   8.71576506
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999897
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3ErIr8
_chemical_formula_sum   'Ca3 Er1 Ir8'
_cell_volume   212.64482612
_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
  Ca  Ca0  1  0.33333400  0.66666700  0.07242492  1.0
  Ca  Ca1  1  0.33333400  0.66666700  0.43234933  1.0
  Ca  Ca2  1  0.66666700  0.33333300  0.56268758  1.0
  Er  Er3  1  0.66666700  0.33333300  0.92981456  1.0
  Ir  Ir4  1  0.00000000  0.00000000  0.00081882  1.0
  Ir  Ir5  1  0.34058565  0.17029232  0.24808716  1.0
  Ir  Ir6  1  0.82970668  0.17029232  0.24808716  1.0
  Ir  Ir7  1  0.82970768  0.65941235  0.24808716  1.0
  Ir  Ir8  1  0.00000000  0.00000000  0.50022829  1.0
  Ir  Ir9  1  0.17039454  0.34078909  0.75247234  1.0
  Ir  Ir10  1  0.17039554  0.82960646  0.75247234  1.0
  Ir  Ir11  1  0.65921091  0.82960646  0.75247234  1.0