data_[U6P8Ru14]
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
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.0183]
_cell_length_b [3.9217]
_cell_length_c [9.1136]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.3620]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [U3P4Ru7]
_chemical_formula_sum '[U6 P8 Ru14]'
_cell_volume [437.7413]
_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
[
  U  U0  4  0.1748  0.5000  0.1727  1
  U  U1  2  0.0000  0.0000  0.5000  1
  P  P2  4  0.1105  0.0000  0.3374  1
  P  P3  4  0.1614  0.5000  0.7731  1
  Ru  Ru4  4  0.0042  0.5000  0.7798  1
  Ru  Ru5  4  0.1651  0.0000  0.9310  1
  Ru  Ru6  4  0.2015  0.5000  0.5543  1
  Ru  Ru7  2  0.0000  0.0000  0.0000  1
]