data_[Gd1Ni4Ge3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Gd  1.2000  1.8000  1.0750
  Ni  1.9100  1.3500  0.7400
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [5.0790]
_cell_length_b [3.9889]
_cell_length_c [6.0028]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.9392]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [GdNi4Ge3]
_chemical_formula_sum '[Gd1 Ni4 Ge3]'
_cell_volume [120.4461]
_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
[
  Gd  Gd0  1  0.6825  0.0000  0.6905  1
  Ni  Ni1  1  0.1746  0.0000  0.4824  1
  Ni  Ni2  1  0.2857  0.0000  0.0494  1
  Ni  Ni3  1  0.6052  0.5000  0.0323  1
  Ni  Ni4  1  0.8814  0.5000  0.4184  1
  Ge  Ge5  1  0.1612  0.5000  0.8019  1
  Ge  Ge6  1  0.3758  0.5000  0.3513  1
  Ge  Ge7  1  0.8337  0.0000  0.1737  1
]