data_[Mg2Al1Zn1Au6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Al  1.6100  1.2500  0.6750
  Zn  1.6500  1.3500  0.8800
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.8444]
_cell_length_b [5.2520]
_cell_length_c [7.3611]
_cell_angle_alpha [73.3942]
_cell_angle_beta [79.6480]
_cell_angle_gamma [85.0712]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Mg2AlZnAu6]
_chemical_formula_sum '[Mg2 Al1 Zn1 Au6]'
_cell_volume [176.4360]
_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  0.0587  0.3898  0.2131  1.0
  Al  Al1  1  0.5000  0.5000  0.5000  1.0
  Zn  Zn2  1  0.0000  0.0000  0.0000  1.0
  Au  Au3  2  0.0578  0.7922  0.3880  1.0
  Au  Au4  2  0.4337  0.8846  0.7038  1.0
  Au  Au5  2  0.4375  0.3087  0.8952  1.0
]