data_[Pa4Nb8Co4C16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  Nb  1.6000  1.4500  0.8200
  Co  1.8800  1.3500  0.7683
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.2300]
_cell_length_b [10.9631]
_cell_length_c [10.7798]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [PaNb2CoC4]
_chemical_formula_sum '[Pa4 Nb8 Co4 C16]'
_cell_volume [381.7220]
_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  0.1031  0.7500  1
  Nb  Nb1  8  0.0000  0.3691  0.5480  1
  Co  Co2  4  0.0000  0.1572  0.2500  1
  C  C3  8  0.0000  0.2707  0.1224  1
  C  C4  4  0.0000  0.0000  0.0000  1
  C  C5  4  0.0000  0.4369  0.7500  1
]