data_[Sr3Ir9Pd6S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ir  2.2000  1.3500  0.7650
  Pd  2.2000  1.4000  0.8462
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [7.3198]
_cell_length_b [7.3198]
_cell_length_c [18.4033]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [SrIr3(PdS4)2]
_chemical_formula_sum '[Sr3 Ir9 Pd6 S24]'
_cell_volume [853.9361]
_cell_formula_units_Z [3]
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
[
  Sr  Sr0  3  0.0000  0.0000  0.1270  1
  Ir  Ir1  9  0.1672  0.3343  0.3328  1
  Pd  Pd2  3  0.0000  0.0000  0.5014  1
  Pd  Pd3  3  0.0000  0.0000  0.8854  1
  S  S4  9  0.0379  0.5190  0.2584  1
  S  S5  9  0.1972  0.3943  0.0717  1
  S  S6  3  0.0000  0.0000  0.2733  1
  S  S7  3  0.0000  0.0000  0.7316  1
]