# generated using pymatgen
data_Ca2Si2IrOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.19911317
_cell_length_b   4.19911317
_cell_length_c   6.79879918
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2Si2IrOs
_chemical_formula_sum   'Ca2 Si2 Ir1 Os1'
_cell_volume   119.88017603
_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  0.00000000  0.50000000  0.32679756  1.0
  Ca  Ca1  1  0.50000000  0.00000000  0.67320244  1.0
  Si  Si2  1  0.00000000  0.50000000  0.82332434  1.0
  Si  Si3  1  0.50000000  0.00000000  0.17667566  1.0
  Ir  Ir4  1  0.50000000  0.50000000  0.00000000  1.0
  Os  Os5  1  0.00000000  0.00000000  0.00000000  1.0