data_[Pa2V2Cr2C6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  V  1.6300  1.3500  0.7775
  Cr  1.6600  1.4000  0.9400
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.6927]
_cell_length_b [3.0979]
_cell_length_c [8.1756]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.7850]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [PaVCrC3]
_chemical_formula_sum '[Pa2 V2 Cr2 C6]'
_cell_volume [136.5004]
_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
[
  Pa  Pa0  2  0.0208  0.7500  0.7115  1
  V  V1  2  0.3711  0.2500  0.0812  1
  Cr  Cr2  2  0.4777  0.2500  0.6222  1
  C  C3  2  0.1940  0.7500  0.1561  1
  C  C4  2  0.2705  0.7500  0.5089  1
  C  C5  2  0.3630  0.2500  0.8345  1
]