data_[Y4Ag4Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ag  1.9300  1.6000  1.0867
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.4924]
_cell_length_b [4.2946]
_cell_length_c [7.1984]
_cell_angle_alpha [90.0000]
_cell_angle_beta [128.0794]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [YAgGe]
_chemical_formula_sum '[Y4 Ag4 Ge4]'
_cell_volume [255.3256]
_cell_formula_units_Z [4]
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
[
  Y  Y0  4  0.0580  0.5000  0.3085  1
  Ag  Ag1  4  0.1673  0.0000  0.0834  1
  Ge  Ge2  4  0.1525  0.0000  0.6679  1
]