data_[Sr6Fe4Cu4S4O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Fe  1.8300  1.4000  0.8525
  Cu  1.9000  1.3500  0.8200
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [3.9688]
_cell_length_b [3.9688]
_cell_length_c [26.5495]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [139]
_chemical_formula_structural [Sr3Fe2Cu2S2O5]
_chemical_formula_sum '[Sr6 Fe4 Cu4 S4 O10]'
_cell_volume [418.1846]
_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  4  0.0000  0.0000  0.3576  1.0
  Sr  Sr1  2  0.0000  0.0000  0.5000  1.0
  Fe  Fe2  4  0.0000  0.0000  0.0727  1.0
  Cu  Cu3  4  0.0000  0.5000  0.2500  1.0
  S  S4  4  0.0000  0.0000  0.1976  1.0
  O  O5  8  0.0000  0.5000  0.0829  1.0
  O  O6  2  0.0000  0.0000  0.0000  1.0
]