data_[Sr8Ge2I10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ge  2.0100  1.2500  0.7700
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [20.7748]
_cell_length_b [4.5098]
_cell_length_c [9.8063]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5793]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sr4GeI5]
_chemical_formula_sum '[Sr8 Ge2 I10]'
_cell_volume [889.1778]
_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  0.0013  0.0000  0.2388  1
  Sr  Sr1  4  0.1583  0.5000  0.0942  1
  Ge  Ge2  2  0.0000  0.5000  0.0000  1
  I  I3  4  0.1668  0.0000  0.3391  1
  I  I4  4  0.1703  0.0000  0.8481  1
  I  I5  2  0.0000  0.5000  0.5000  1
]