data_[Sr6Ca2Ti6Mn2O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ca  1.0000  1.8000  1.1400
  Ti  1.5400  1.4000  0.8517
  Mn  1.5500  1.4000  0.6483
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pma2]
_cell_length_a [7.8896]
_cell_length_b [7.7935]
_cell_length_c [7.7994]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [28]
_chemical_formula_structural [Sr3CaTi3MnO12]
_chemical_formula_sum '[Sr6 Ca2 Ti6 Mn2 O24]'
_cell_volume [479.5640]
_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
[
  Sr  Sr0  2  0.2500  0.2468  0.2465  1
  Sr  Sr1  2  0.2500  0.7532  0.2467  1
  Sr  Sr2  2  0.2500  0.7535  0.7534  1
  Ca  Ca3  2  0.2500  0.2465  0.7536  1
  Ti  Ti4  2  0.0000  0.0000  0.5021  1
  Ti  Ti5  2  0.0000  0.5000  0.5014  1
  Ti  Ti6  2  0.0000  0.5000  0.9986  1
  Mn  Mn7  2  0.0000  0.0000  0.9991  1
  O  O8  4  0.0016  0.2495  0.5025  1
  O  O9  4  0.0020  0.2478  0.9972  1
  O  O10  2  0.0000  0.0000  0.2478  1
  O  O11  2  0.0000  0.0000  0.7523  1
  O  O12  2  0.0000  0.5000  0.2494  1
  O  O13  2  0.0000  0.5000  0.7505  1
  O  O14  2  0.2500  0.0017  0.5026  1
  O  O15  2  0.2500  0.0029  0.9966  1
  O  O16  2  0.2500  0.4983  0.5027  1
  O  O17  2  0.2500  0.4984  0.9973  1
]