data_[Ba2Np1Ag1Te4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Np  1.3600  1.7500  1.0000
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [8.1217]
_cell_length_b [4.7085]
_cell_length_c [8.2511]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.7407]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Ba2NpAgTe4]
_chemical_formula_sum '[Ba2 Np1 Ag1 Te4]'
_cell_volume [295.0859]
_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
[
  Ba  Ba0  1  0.5000  0.0000  0.5000  1
  Ba  Ba1  1  0.5000  0.5000  0.0000  1
  Np  Np2  1  0.0000  0.0000  0.0000  1
  Ag  Ag3  1  0.0000  0.5000  0.5000  1
  Te  Te4  2  0.2068  0.0000  0.7361  1
  Te  Te5  2  0.2219  0.5000  0.2313  1
]