data_[Mg5Ag4Ge1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Ag  1.9300  1.6000  1.0867
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.3188]
_cell_length_b [3.3188]
_cell_length_c [17.0026]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Mg5Ag4Ge]
_chemical_formula_sum '[Mg5 Ag4 Ge1]'
_cell_volume [187.2710]
_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  0.5000  0.5000  0.1053  1.0
  Mg  Mg1  2  0.5000  0.5000  0.3036  1.0
  Mg  Mg2  1  0.5000  0.5000  0.5000  1.0
  Ag  Ag3  2  0.0000  0.0000  0.2054  1.0
  Ag  Ag4  2  0.0000  0.0000  0.4016  1.0
  Ge  Ge5  1  0.0000  0.0000  0.0000  1.0
]