data_[Nd12Sb6As4P2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Sb  2.0500  1.4500  0.8300
  As  2.1800  1.1500  0.6600
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.1466]
_cell_length_b [4.3642]
_cell_length_c [8.7959]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.0260]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd6Sb3As2P]
_chemical_formula_sum '[Nd12 Sb6 As4 P2]'
_cell_volume [713.0772]
_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  4  0.0029  0.0000  0.2360  1
  Nd  Nd1  4  0.1606  0.5000  0.0908  1
  Nd  Nd2  4  0.1701  0.5000  0.5744  1
  Sb  Sb3  4  0.1676  0.0000  0.8340  1
  Sb  Sb4  2  0.0000  0.5000  0.5000  1
  As  As5  4  0.1661  0.0000  0.3327  1
  P  P6  2  0.0000  0.5000  0.0000  1
]