data_[Cs6Nd14N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Nd  1.1400  1.8500  1.2765
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [5.2541]
_cell_length_b [34.9445]
_cell_length_c [5.2016]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Cs3Nd7N2]
_chemical_formula_sum '[Cs6 Nd14 N4]'
_cell_volume [955.0209]
_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
[
  Cs  Cs0  4  0.0000  0.3052  0.5000  1
  Cs  Cs1  2  0.0000  0.5000  0.5000  1
  Nd  Nd2  4  0.0000  0.0739  0.5000  1
  Nd  Nd3  4  0.0000  0.1402  0.0000  1
  Nd  Nd4  4  0.0000  0.4255  0.0000  1
  Nd  Nd5  2  0.0000  0.0000  0.0000  1
  N  N6  4  0.0000  0.0774  0.0000  1
]