data_[Ga6Ni14Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Ni  1.9100  1.3500  0.7400
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [4.1314]
_cell_length_b [18.5993]
_cell_length_c [4.1361]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Ga3Ni7Ge2]
_chemical_formula_sum '[Ga6 Ni14 Ge4]'
_cell_volume [317.8177]
_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
[
  Ga  Ga0  4  0.0000  0.3430  0.5000  1
  Ga  Ga1  2  0.0000  0.5000  0.5000  1
  Ni  Ni2  4  0.0000  0.0756  0.5000  1
  Ni  Ni3  4  0.0000  0.2835  0.0000  1
  Ni  Ni4  4  0.0000  0.4239  0.0000  1
  Ni  Ni5  2  0.0000  0.0000  0.0000  1
  Ge  Ge6  4  0.0000  0.1499  0.0000  1
]