data_[Nd2Bi4As4Pd14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Bi  2.0200  1.6000  1.0350
  As  2.1800  1.1500  0.6600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.8535]
_cell_length_b [5.8182]
_cell_length_c [14.4335]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.3341]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NdBi2As2Pd7]
_chemical_formula_sum '[Nd2 Bi4 As4 Pd14]'
_cell_volume [488.5624]
_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  0.0000  0.0000  0.0000  1
  Bi  Bi1  4  0.1240  0.0000  0.3963  1
  As  As2  4  0.0704  0.5000  0.2514  1
  Pd  Pd3  8  0.2074  0.2503  0.8469  1
  Pd  Pd4  4  0.1418  0.5000  0.4245  1
  Pd  Pd5  2  0.0000  0.5000  0.0000  1
]