data_[Ba4Y4Mn8O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Y  1.2200  1.8000  1.0400
  Mn  1.5500  1.4000  0.6483
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.9434]
_cell_length_b [7.8013]
_cell_length_c [7.8561]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.5213]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [BaYMn2O6]
_chemical_formula_sum '[Ba4 Y4 Mn8 O24]'
_cell_volume [486.8093]
_cell_formula_units_Z [4]
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
[
  Ba  Ba0  4  0.2473  0.0000  0.9940  1.0
  Y  Y1  4  0.2312  0.0000  0.4929  1.0
  Mn  Mn2  8  0.0011  0.2518  0.7416  1.0
  O  O3  8  0.2478  0.2809  0.2857  1.0
  O  O4  4  0.0000  0.1936  0.5000  1.0
  O  O5  4  0.0000  0.2686  0.0000  1.0
  O  O6  4  0.0322  0.0000  0.2430  1.0
  O  O7  4  0.0340  0.5000  0.6937  1.0
]