data_[Pa4Cr4Te16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  Cr  1.6600  1.4000  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.7975]
_cell_length_b [14.5933]
_cell_length_c [6.9285]
_cell_angle_alpha [90.0000]
_cell_angle_beta [127.0942]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [PaCrTe4]
_chemical_formula_sum '[Pa4 Cr4 Te16]'
_cell_volume [709.5114]
_cell_formula_units_Z [4]
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
[
  Pa  Pa0  4  0.0000  0.1343  0.7500  1
  Cr  Cr1  4  0.0000  0.4253  0.2500  1
  Te  Te2  8  0.1381  0.2860  0.1362  1
  Te  Te3  8  0.2497  0.4642  0.7348  1
]