data_[Dy2Np2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Np  1.3600  1.7500  1.0000
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.8124]
_cell_length_b [12.3966]
_cell_length_c [6.7021]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.7631]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [DyNpCl6]
_chemical_formula_sum '[Dy2 Np2 Cl12]'
_cell_volume [544.7131]
_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
[
  Dy  Dy0  2  0.0000  0.5000  0.5000  1
  Np  Np1  2  0.0000  0.0000  0.0000  1
  Cl  Cl2  8  0.2411  0.3566  0.7440  1
  Cl  Cl3  4  0.2451  0.5000  0.2527  1
]