data_[Mn6Zn2Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Zn  1.6500  1.3500  0.8800
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.3551]
_cell_length_b [4.5465]
_cell_length_c [9.7448]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.0979]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Mn3ZnPt6]
_chemical_formula_sum '[Mn6 Zn2 Pt12]'
_cell_volume [301.9251]
_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
[
  Mn  Mn0  2  0.2227  0.2500  0.0173  1
  Mn  Mn1  2  0.3706  0.7500  0.7819  1
  Mn  Mn2  2  0.4569  0.2500  0.6226  1
  Zn  Zn3  2  0.0415  0.2500  0.4219  1
  Pt  Pt4  2  0.0687  0.7500  0.8666  1
  Pt  Pt5  2  0.1504  0.2500  0.7130  1
  Pt  Pt6  2  0.1570  0.7500  0.1759  1
  Pt  Pt7  2  0.2574  0.7500  0.4878  1
  Pt  Pt8  2  0.3359  0.2500  0.3238  1
  Pt  Pt9  2  0.4613  0.7500  0.0755  1
]