data_[Mg2Zn10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.5322]
_cell_length_b [2.8653]
_cell_length_c [6.5792]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.2382]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [MgZn5]
_chemical_formula_sum '[Mg2 Zn10]'
_cell_volume [191.5649]
_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
[
  Mg  Mg0  2  0.3873  0.0000  0.2743  1.0
  Zn  Zn1  2  0.0024  0.0000  0.9949  1.0
  Zn  Zn2  2  0.0591  0.0000  0.6191  1.0
  Zn  Zn3  2  0.1645  0.5000  0.3364  1.0
  Zn  Zn4  2  0.2200  0.5000  0.9401  1.0
  Zn  Zn5  2  0.3334  0.0000  0.6686  1.0
]