data_[Mg10Zn4Ga10]
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
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.6596]
_cell_length_b [4.3723]
_cell_length_c [9.1230]
_cell_angle_alpha [90.0000]
_cell_angle_beta [128.1291]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg5Zn2Ga5]
_chemical_formula_sum '[Mg10 Zn4 Ga10]'
_cell_volume [459.9704]
_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  4  0.0945  0.5000  0.9100  1.0
  Mg  Mg1  4  0.1826  0.5000  0.3358  1.0
  Mg  Mg2  2  0.0000  0.5000  0.5000  1.0
  Zn  Zn3  4  0.1515  0.0000  0.7527  1.0
  Ga  Ga4  4  0.0658  0.0000  0.3614  1.0
  Ga  Ga5  4  0.2336  0.0000  0.1711  1.0
  Ga  Ga6  2  0.0000  0.0000  0.0000  1.0
]