data_[Nd6Ge2C2Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ge  2.0100  1.2500  0.7700
  C  2.5500  0.7000  0.3000
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.3987]
_cell_length_b [3.8324]
_cell_length_c [11.1675]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.2628]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Nd3GeCCl]
_chemical_formula_sum '[Nd6 Ge2 C2 Cl2]'
_cell_volume [298.9227]
_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
[
  Nd  Nd0  2  0.1768  0.7500  0.1314  1
  Nd  Nd1  2  0.2137  0.7500  0.4930  1
  Nd  Nd2  2  0.3542  0.2500  0.8621  1
  Ge  Ge3  2  0.0242  0.7500  0.7039  1
  C  C4  2  0.3525  0.2500  0.0791  1
  Cl  Cl5  2  0.4971  0.2500  0.6347  1
]