data_[Sr4Li4Mn4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Li  0.9800  1.4500  0.9000
  Mn  1.5500  1.4000  0.6483
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.7044]
_cell_length_b [10.7164]
_cell_length_c [10.5907]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.2749]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [SrLiMnCl5]
_chemical_formula_sum '[Sr4 Li4 Mn4 Cl20]'
_cell_volume [1059.7307]
_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
[
  Sr  Sr0  4  0.0000  0.0000  0.0000  1.0
  Li  Li1  4  0.0000  0.3199  0.2500  1.0
  Mn  Mn2  4  0.0000  0.3747  0.7500  1.0
  Cl  Cl3  8  0.0225  0.2625  0.9486  1.0
  Cl  Cl4  8  0.1860  0.4703  0.3321  1.0
  Cl  Cl5  4  0.0000  0.1055  0.2500  1.0
]