data_[La2Ni2Ge1P1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ni  1.9100  1.3500  0.7400
  Ge  2.0100  1.2500  0.7700
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [4.1041]
_cell_length_b [4.1041]
_cell_length_c [8.3341]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [La2Ni2GeP]
_chemical_formula_sum '[La2 Ni2 Ge1 P1]'
_cell_volume [121.5720]
_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  0.3333  0.6667  0.2584  1
  Ni  Ni1  1  0.0000  0.0000  0.5000  1
  Ni  Ni2  1  0.6667  0.3333  0.0000  1
  Ge  Ge3  1  0.0000  0.0000  0.0000  1
  P  P4  1  0.6667  0.3333  0.5000  1
]