data_[Pr2V2Sb6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  V  1.6300  1.3500  0.7775
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Pmma]
_cell_length_a [10.6842]
_cell_length_b [3.4746]
_cell_length_c [8.1452]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [51]
_chemical_formula_structural [PrVSb3]
_chemical_formula_sum '[Pr2 V2 Sb6]'
_cell_volume [302.3804]
_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
[
  Pr  Pr0  2  0.2500  0.5000  0.1499  1
  V  V1  2  0.2500  0.0000  0.8020  1
  Sb  Sb2  4  0.0549  0.5000  0.8271  1
  Sb  Sb3  2  0.2500  0.0000  0.4841  1
]