# generated using pymatgen
data_CaY(Al5Os)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.83051722
_cell_length_b   6.83056908
_cell_length_c   9.09793216
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.71047797
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaY(Al5Os)4
_chemical_formula_sum   'Ca1 Y1 Al20 Os4'
_cell_volume   421.56807261
_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  0.87261851  0.12737808  0.75000000  1.0
  Y  Y1  1  0.12732728  0.87267225  0.25000000  1.0
  Al  Al2  1  0.52141545  0.78383890  0.75000000  1.0
  Al  Al3  1  0.78149733  0.51915661  0.25000000  1.0
  Al  Al4  1  0.48085647  0.21851503  0.25000000  1.0
  Al  Al5  1  0.21617400  0.47859317  0.75000000  1.0
  Al  Al6  1  0.62285662  0.37714092  0.96180368  1.0
  Al  Al7  1  0.37652232  0.62347793  0.05274562  1.0
  Al  Al8  1  0.62285662  0.37714092  0.53819632  1.0
  Al  Al9  1  0.37652232  0.62347793  0.44725438  1.0
  Al  Al10  1  0.40886443  0.14249347  0.75000000  1.0
  Al  Al11  1  0.14117224  0.41244226  0.25000000  1.0
  Al  Al12  1  0.58756267  0.85883928  0.25000000  1.0
  Al  Al13  1  0.85751655  0.59112006  0.75000000  1.0
  Al  Al14  1  0.84604913  0.15394879  0.40023172  1.0
  Al  Al15  1  0.15967638  0.84032207  0.60052487  1.0
  Al  Al16  1  0.84604913  0.15394879  0.09976828  1.0
  Al  Al17  1  0.15967638  0.84032207  0.89947513  1.0
  Al  Al18  1  0.77439804  0.77547206  0.00071533  1.0
  Al  Al19  1  0.77439804  0.77547206  0.49928467  1.0
  Al  Al20  1  0.22450813  0.22560616  0.00072105  1.0
  Al  Al21  1  0.22450813  0.22560616  0.49927895  1.0
  Os  Os22  1  0.49922709  0.00074199  0.99996398  1.0
  Os  Os23  1  0.99925883  0.50076651  0.99996615  1.0
  Os  Os24  1  0.49922709  0.00074199  0.50003602  1.0
  Os  Os25  1  0.99925883  0.50076651  0.50003385  1.0