data_[U1P1Cl1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  P  2.1900  1.0000  0.5500
  Cl  3.1600  1.0000  0.7800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.2352]
_cell_length_b [5.4923]
_cell_length_c [6.1707]
_cell_angle_alpha [78.1382]
_cell_angle_beta [69.6827]
_cell_angle_gamma [72.5911]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [UPClO6]
_chemical_formula_sum '[U1 P1 Cl1 O6]'
_cell_volume [157.7387]
_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
[
  U  U0  1  0.1735  0.7015  0.5039  1
  P  P1  1  0.6807  0.3286  0.5766  1
  Cl  Cl2  1  0.9489  0.9033  0.9798  1
  O  O3  1  0.1054  0.7788  0.1805  1
  O  O4  1  0.3716  0.9398  0.4473  1
  O  O5  1  0.4031  0.4415  0.7610  1
  O  O6  1  0.6103  0.4245  0.3457  1
  O  O7  1  0.7876  0.0347  0.6184  1
  O  O8  1  0.9188  0.4471  0.5870  1
]