data_[Ho2Th1Np1As4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Th  1.3000  1.8000  1.0800
  Np  1.3600  1.7500  1.0000
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.1790]
_cell_length_b [4.1469]
_cell_length_c [7.1793]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4949]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Ho2ThNpAs4]
_chemical_formula_sum '[Ho2 Th1 Np1 As4]'
_cell_volume [201.4783]
_cell_formula_units_Z [1]
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
[
  Ho  Ho0  1  0.5000  0.0000  0.5000  1
  Ho  Ho1  1  0.5000  0.5000  0.0000  1
  Th  Th2  1  0.0000  0.5000  0.5000  1
  Np  Np3  1  0.0000  0.0000  0.0000  1
  As  As4  2  0.2532  0.5000  0.2467  1
  As  As5  2  0.2569  0.0000  0.7561  1
]