data_[Fe13Ge2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Fe  1.8300  1.4000  0.8525
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.7351]
_cell_length_b [6.4090]
_cell_length_c [6.4601]
_cell_angle_alpha [66.9009]
_cell_angle_beta [81.7650]
_cell_angle_gamma [82.2290]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Fe13Ge2]
_chemical_formula_sum '[Fe13 Ge2]'
_cell_volume [177.7968]
_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
[
  Fe  Fe0  2  0.1349  0.8038  0.4654  1.0
  Fe  Fe1  2  0.1982  0.2019  0.2005  1.0
  Fe  Fe2  2  0.2760  0.6057  0.9280  1.0
  Fe  Fe3  2  0.3332  0.0028  0.6648  1.0
  Fe  Fe4  2  0.4052  0.3984  0.3985  1.0
  Fe  Fe5  2  0.4575  0.8040  0.1302  1.0
  Fe  Fe6  1  0.0000  0.0000  0.0000  1.0
  Ge  Ge7  2  0.0709  0.3973  0.7441  1.0
]