# generated using pymatgen
data_CaY3Ir8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33298804
_cell_length_b   5.33298737
_cell_length_c   8.69597688
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99997985
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaY3Ir8
_chemical_formula_sum   'Ca1 Y3 Ir8'
_cell_volume   214.18559595
_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  0.33333300  0.66666700  0.43543901  1.0
  Y  Y1  1  0.33333300  0.66666700  0.07430500  1.0
  Y  Y2  1  0.66666700  0.33333300  0.56270135  1.0
  Y  Y3  1  0.66666700  0.33333300  0.93079941  1.0
  Ir  Ir4  1  0.00000000  0.00000000  0.99965819  1.0
  Ir  Ir5  1  0.00000000  0.00000000  0.49914891  1.0
  Ir  Ir6  1  0.83052876  0.66105851  0.24840910  1.0
  Ir  Ir7  1  0.16986958  0.83013042  0.75090694  1.0
  Ir  Ir8  1  0.66026083  0.83013042  0.75090694  1.0
  Ir  Ir9  1  0.33894149  0.16947124  0.24840910  1.0
  Ir  Ir10  1  0.83052876  0.16947124  0.24840910  1.0
  Ir  Ir11  1  0.16986958  0.33973917  0.75090694  1.0