data_[La3Ga4Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ga  1.8100  1.3000  0.7600
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.4762]
_cell_length_b [4.2326]
_cell_length_c [13.8705]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.2770]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [La3(GaGe)4]
_chemical_formula_sum '[La3 Ga4 Ge4]'
_cell_volume [260.0552]
_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
[
  La  La0  2  0.1374  0.5000  0.2819  1.0
  La  La1  1  0.0000  0.0000  0.0000  1.0
  Ga  Ga2  2  0.2680  0.5000  0.5417  1.0
  Ga  Ga3  2  0.3266  0.0000  0.8209  1.0
  Ge  Ge4  2  0.3633  0.0000  0.6448  1.0
  Ge  Ge5  2  0.4723  0.5000  0.0908  1.0
]