# generated using pymatgen
data_Ca3Nd5(CdIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.97931342
_cell_length_b   9.97931351
_cell_length_c   9.97931374
_cell_angle_alpha   60.00000250
_cell_angle_beta   60.00000222
_cell_angle_gamma   60.00000554
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Nd5(CdIr)2
_chemical_formula_sum   'Ca6 Nd10 Cd4 Ir4'
_cell_volume   702.72764933
_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
  Ca  Ca0  1  0.94172279  0.55827721  0.55827721  1.0
  Ca  Ca1  1  0.55827721  0.94172279  0.94172279  1.0
  Ca  Ca2  1  0.55827721  0.94172279  0.55827721  1.0
  Ca  Ca3  1  0.94172279  0.55827721  0.94172279  1.0
  Ca  Ca4  1  0.55827721  0.55827721  0.94172279  1.0
  Ca  Ca5  1  0.94172279  0.94172279  0.55827721  1.0
  Nd  Nd6  1  0.34618216  0.34618216  0.34618216  1.0
  Nd  Nd7  1  0.34618216  0.34618216  0.96145351  1.0
  Nd  Nd8  1  0.34618216  0.96145351  0.34618216  1.0
  Nd  Nd9  1  0.96145351  0.34618216  0.34618216  1.0
  Nd  Nd10  1  0.80535974  0.19464026  0.19464026  1.0
  Nd  Nd11  1  0.19464026  0.80535974  0.80535974  1.0
  Nd  Nd12  1  0.19464026  0.80535974  0.19464026  1.0
  Nd  Nd13  1  0.80535974  0.19464026  0.80535974  1.0
  Nd  Nd14  1  0.19464026  0.19464026  0.80535974  1.0
  Nd  Nd15  1  0.80535974  0.80535974  0.19464026  1.0
  Cd  Cd16  1  0.57709998  0.57709998  0.57709998  1.0
  Cd  Cd17  1  0.57709998  0.57709998  0.26869705  1.0
  Cd  Cd18  1  0.57709998  0.26869705  0.57709998  1.0
  Cd  Cd19  1  0.26869705  0.57709998  0.57709998  1.0
  Ir  Ir20  1  0.13990623  0.13990623  0.13990623  1.0
  Ir  Ir21  1  0.13990623  0.13990623  0.58028332  1.0
  Ir  Ir22  1  0.13990623  0.58028332  0.13990623  1.0
  Ir  Ir23  1  0.58028332  0.13990623  0.13990623  1.0