# generated using pymatgen
data_CaHo2(SiIr2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54473928
_cell_length_b   5.54473919
_cell_length_c   14.99761663
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001229
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaHo2(SiIr2)3
_chemical_formula_sum   'Ca2 Ho4 Si6 Ir12'
_cell_volume   399.31449842
_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  0.33333300  0.66666700  0.75000000  1.0
  Ca  Ca1  1  0.66666700  0.33333300  0.25000000  1.0
  Ho  Ho2  1  0.33333300  0.66666700  0.54149556  1.0
  Ho  Ho3  1  0.66666700  0.33333300  0.45850444  1.0
  Ho  Ho4  1  0.66666700  0.33333300  0.04149556  1.0
  Ho  Ho5  1  0.33333300  0.66666700  0.95850444  1.0
  Si  Si6  1  0.00000000  0.00000000  0.25000000  1.0
  Si  Si7  1  0.00000000  0.00000000  0.75000000  1.0
  Si  Si8  1  0.33333300  0.66666700  0.25000000  1.0
  Si  Si9  1  0.66666700  0.33333300  0.75000000  1.0
  Si  Si10  1  0.00000000  0.00000000  0.00000000  1.0
  Si  Si11  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir12  1  0.16764650  0.33529400  0.12869587  1.0
  Ir  Ir13  1  0.83235350  0.66470600  0.87130413  1.0
  Ir  Ir14  1  0.66470600  0.83235350  0.12869587  1.0
  Ir  Ir15  1  0.83235350  0.66470600  0.62869587  1.0
  Ir  Ir16  1  0.33529400  0.16764650  0.87130413  1.0
  Ir  Ir17  1  0.16764650  0.33529400  0.37130413  1.0
  Ir  Ir18  1  0.16764650  0.83235350  0.12869587  1.0
  Ir  Ir19  1  0.33529400  0.16764650  0.62869587  1.0
  Ir  Ir20  1  0.83235350  0.16764650  0.87130413  1.0
  Ir  Ir21  1  0.66470600  0.83235350  0.37130413  1.0
  Ir  Ir22  1  0.83235350  0.16764650  0.62869587  1.0
  Ir  Ir23  1  0.16764650  0.83235350  0.37130413  1.0