data_[Li4Ga4Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.0395]
_cell_length_b [7.0404]
_cell_length_c [7.2700]
_cell_angle_alpha [116.1607]
_cell_angle_beta [98.6010]
_cell_angle_gamma [112.7509]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [LiGaPb]
_chemical_formula_sum '[Li4 Ga4 Pb4]'
_cell_volume [275.0363]
_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
[
  Li  Li0  1  0.1701  0.3521  0.4711  1
  Li  Li1  1  0.2433  0.8699  0.6974  1
  Li  Li2  1  0.6752  0.7556  0.6183  1
  Li  Li3  1  0.8291  0.2700  0.0173  1
  Ga  Ga4  1  0.0093  0.9809  0.0013  1
  Ga  Ga5  1  0.0389  0.5704  0.8307  1
  Ga  Ga6  1  0.1057  0.2094  0.7845  1
  Ga  Ga7  1  0.5163  0.7836  0.9418  1
  Pb  Pb8  1  0.3402  0.6935  0.2684  1
  Pb  Pb9  1  0.4943  0.2514  0.2197  1
  Pb  Pb10  1  0.5452  0.3194  0.7100  1
  Pb  Pb11  1  0.8693  0.7819  0.2764  1
]