# generated using pymatgen
data_Ca8HoErIr4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.58766484
_cell_length_b   7.38060268
_cell_length_c   8.61786994
_cell_angle_alpha   97.51069655
_cell_angle_beta   112.47061797
_cell_angle_gamma   89.99999545
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca8HoErIr4
_chemical_formula_sum   'Ca8 Ho1 Er1 Ir4'
_cell_volume   383.30278815
_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  0.97747146  0.91930246  0.17271430  1.0
  Ca  Ca1  1  0.80475916  0.58069754  0.82728570  1.0
  Ca  Ca2  1  0.02273668  0.08026549  0.82718895  1.0
  Ca  Ca3  1  0.19554673  0.41973451  0.17281105  1.0
  Ca  Ca4  1  0.63464005  0.81919527  0.43297107  1.0
  Ca  Ca5  1  0.20166898  0.68080473  0.56702893  1.0
  Ca  Ca6  1  0.36478538  0.18070053  0.56677088  1.0
  Ca  Ca7  1  0.79801550  0.31929947  0.43322912  1.0
  Ho  Ho8  1  0.56022764  0.25000000  1.00000000  1.0
  Er  Er9  1  0.44071555  0.75000000  0.00000000  1.0
  Ir  Ir10  1  0.80418542  0.57475966  0.20644075  1.0
  Ir  Ir11  1  0.59774467  0.92524034  0.79355925  1.0
  Ir  Ir12  1  0.19576211  0.42627244  0.79402143  1.0
  Ir  Ir13  1  0.40173968  0.07372756  0.20597857  1.0