data_[Sr1Ge4Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [7.3598]
_cell_length_b [7.3598]
_cell_length_c [4.0409]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [Sr(Ge2Pd3)2]
_chemical_formula_sum '[Sr1 Ge4 Pd6]'
_cell_volume [189.5565]
_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
[
  Sr  Sr0  1  0.0000  0.0000  0.0000  1.0
  Ge  Ge1  3  0.3888  0.1944  0.5000  1.0
  Ge  Ge2  1  0.3333  0.6667  0.0000  1.0
  Pd  Pd3  3  0.2022  0.4044  0.5000  1.0
  Pd  Pd4  3  0.5356  0.0712  0.0000  1.0
]