data_[Mg2Zn6Ga2]
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 [P2_1/m]
_cell_length_a [5.0660]
_cell_length_b [5.4103]
_cell_length_c [6.7468]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.7595]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [MgZn3Ga]
_chemical_formula_sum '[Mg2 Zn6 Ga2]'
_cell_volume [174.0319]
_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  0.2868  0.2500  0.3001  1
  Zn  Zn1  4  0.2689  0.0073  0.8324  1
  Zn  Zn2  2  0.2507  0.7500  0.1477  1
  Ga  Ga3  2  0.1213  0.7500  0.4768  1
]