data_[Zr2Zn10Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Zn  1.6500  1.3500  0.8800
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [4.1092]
_cell_length_b [12.2393]
_cell_length_c [7.3162]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [ZrZn5Pt6]
_chemical_formula_sum '[Zr2 Zn10 Pt12]'
_cell_volume [367.9559]
_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
[
  Zr  Zr0  2  0.0000  0.0000  0.0000  1
  Zn  Zn1  4  0.0000  0.3269  0.0000  1
  Zn  Zn2  4  0.0000  0.3358  0.5000  1
  Zn  Zn3  2  0.0000  0.0000  0.5000  1
  Pt  Pt4  8  0.0000  0.1685  0.2564  1
  Pt  Pt5  4  0.0000  0.5000  0.2566  1
]