data_[Sr3V6Ir3S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  V  1.6300  1.3500  0.7775
  Ir  2.2000  1.3500  0.7650
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [6.0319]
_cell_length_b [6.0319]
_cell_length_c [24.4894]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [SrV2IrS8]
_chemical_formula_sum '[Sr3 V6 Ir3 S24]'
_cell_volume [771.6404]
_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  0.5000  1
  V  V1  6  0.0000  0.0000  0.2542  1
  Ir  Ir2  3  0.0000  0.0000  0.0000  1
  S  S3  18  0.0077  0.6537  0.7230  1
  S  S4  6  0.0000  0.0000  0.1678  1
]