data_[Mg3Ga2Au7]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Ga  1.8100  1.3000  0.7600
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.1838]
_cell_length_b [3.7340]
_cell_length_c [15.2622]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.6109]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Mg3Ga2Au7]
_chemical_formula_sum '[Mg3 Ga2 Au7]'
_cell_volume [236.3278]
_cell_formula_units_Z [1]
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  0.2047  0.0000  0.4067  1
  Mg  Mg1  1  0.5000  0.5000  0.0000  1
  Ga  Ga2  2  0.3668  0.5000  0.7278  1
  Au  Au3  2  0.0802  0.5000  0.1648  1
  Au  Au4  2  0.2805  0.5000  0.5635  1
  Au  Au5  2  0.4316  0.0000  0.8584  1
  Au  Au6  1  0.0000  0.0000  0.0000  1
]