data_[Pa8Ni4Rh4S20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  Ni  1.9100  1.3500  0.7400
  Rh  2.2800  1.3500  0.7450
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.7751]
_cell_length_b [16.3554]
_cell_length_c [10.7895]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Pa2NiRhS5]
_chemical_formula_sum '[Pa8 Ni4 Rh4 S20]'
_cell_volume [666.1795]
_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  0.1130  0.3254  1
  Pa  Pa1  4  0.0000  0.1211  0.6947  1
  Ni  Ni2  4  0.0000  0.4328  0.4348  1
  Rh  Rh3  4  0.0000  0.1395  0.0820  1
  S  S4  4  0.0000  0.0048  0.0129  1
  S  S5  4  0.0000  0.2989  0.6727  1
  S  S6  4  0.0000  0.3088  0.3426  1
  S  S7  4  0.0000  0.3419  0.0068  1
  S  S8  4  0.0000  0.4978  0.2521  1
]