data_[Ta2Ge6Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.9020]
_cell_length_b [2.9273]
_cell_length_c [11.7970]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.2204]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [TaGe3Pd]
_chemical_formula_sum '[Ta2 Ge6 Pd2]'
_cell_volume [169.1554]
_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
[
  Ta  Ta0  2  0.2191  0.5000  0.6359  1
  Ge  Ge1  2  0.2327  0.0000  0.8320  1
  Ge  Ge2  2  0.2540  0.5000  0.0420  1
  Ge  Ge3  2  0.2648  0.0000  0.4374  1
  Pd  Pd4  2  0.2736  0.0000  0.2304  1
]