data_[Sr8Y8O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Y  1.2200  1.8000  1.0400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [25.0240]
_cell_length_b [4.0276]
_cell_length_c [7.9289]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.9103]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SrYO]
_chemical_formula_sum '[Sr8 Y8 O8]'
_cell_volume [798.6861]
_cell_formula_units_Z [8]
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
[
  Sr  Sr0  4  0.0680  0.5000  0.8550  1.0
  Sr  Sr1  4  0.0758  0.0000  0.3582  1.0
  Y  Y2  4  0.2082  0.5000  0.6198  1.0
  Y  Y3  4  0.2092  0.5000  0.1215  1.0
  O  O4  4  0.2493  0.0000  0.6239  1.0
  O  O5  4  0.2499  0.5000  0.8740  1.0
]