# generated using pymatgen
data_CaNd(In2Ir)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59171679
_cell_length_b   5.59171612
_cell_length_c   8.07809392
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   134.19648376
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaNd(In2Ir)2
_chemical_formula_sum   'Ca1 Nd1 In4 Ir2'
_cell_volume   181.08817992
_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  0.93411391  0.06588609  0.75000000  1.0
  Nd  Nd1  1  0.06782518  0.93217482  0.25000000  1.0
  In  In2  1  0.64864470  0.35135530  0.55509593  1.0
  In  In3  1  0.35187930  0.64812070  0.45234487  1.0
  In  In4  1  0.64864470  0.35135530  0.94490407  1.0
  In  In5  1  0.35187930  0.64812070  0.04765513  1.0
  Ir  Ir6  1  0.77988508  0.22011492  0.25000000  1.0
  Ir  Ir7  1  0.21712782  0.78287218  0.75000000  1.0