data_[U8Mn20P12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Mn  1.5500  1.4000  0.6483
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.8463]
_cell_length_b [23.0648]
_cell_length_c [6.1687]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [U2Mn5P3]
_chemical_formula_sum '[U8 Mn20 P12]'
_cell_volume [547.2479]
_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
[
  U  U0  4  0.0000  0.1771  0.2496  1
  U  U1  4  0.0000  0.4874  0.2508  1
  Mn  Mn2  4  0.0000  0.0568  0.0952  1
  Mn  Mn3  4  0.0000  0.1289  0.7380  1
  Mn  Mn4  4  0.0000  0.2914  0.4181  1
  Mn  Mn5  4  0.0000  0.2950  0.0169  1
  Mn  Mn6  4  0.0000  0.3950  0.8982  1
  P  P7  4  0.0000  0.0550  0.4706  1
  P  P8  4  0.0000  0.2298  0.7198  1
  P  P9  4  0.0000  0.3885  0.5077  1
]