data_[Mn8Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.0651]
_cell_length_b [2.9524]
_cell_length_c [6.1898]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5504]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mn2Pt]
_chemical_formula_sum '[Mn8 Pt4]'
_cell_volume [173.3297]
_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
[
  Mn  Mn0  4  0.0229  0.0000  0.7869  1
  Mn  Mn1  4  0.1672  0.5000  0.1177  1
  Pt  Pt2  4  0.1475  0.5000  0.5640  1
]