data_[Ca4Mg2Ge4Pd10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Mg  1.3100  1.5000  0.8600
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [10.2609]
_cell_length_b [10.2609]
_cell_length_c [3.5482]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Ca2MgGe2Pd5]
_chemical_formula_sum '[Ca4 Mg2 Ge4 Pd10]'
_cell_volume [373.5738]
_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
[
  Ca  Ca0  4  0.1740  0.6740  0.0000  1.0
  Mg  Mg1  2  0.0000  0.0000  0.0000  1.0
  Ge  Ge2  4  0.1262  0.3738  0.0000  1.0
  Pd  Pd3  8  0.0608  0.2071  0.5000  1.0
  Pd  Pd4  2  0.0000  0.5000  0.5000  1.0
]