data_[Mg6Ag1Pd5]
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
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.5295]
_cell_length_b [6.4552]
_cell_length_c [7.0575]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.3492]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Mg6AgPd5]
_chemical_formula_sum '[Mg6 Ag1 Pd5]'
_cell_volume [198.0112]
_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  4  0.1723  0.2534  0.3407  1
  Mg  Mg1  2  0.5000  0.2580  0.0000  1
  Ag  Ag2  1  0.0000  0.0000  0.0000  1
  Pd  Pd3  2  0.3326  0.5000  0.6694  1
  Pd  Pd4  2  0.3342  0.0000  0.6717  1
  Pd  Pd5  1  0.0000  0.5000  0.0000  1
]