data_[Rb6Zr9Mn3S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Zr  1.3300  1.5500  0.8600
  Mn  1.5500  1.4000  0.6483
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [7.4755]
_cell_length_b [7.4755]
_cell_length_c [24.8232]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Rb2Zr3MnS8]
_chemical_formula_sum '[Rb6 Zr9 Mn3 S24]'
_cell_volume [1201.3544]
_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
[
  Rb  Rb0  3  0.0000  0.0000  0.1404  1.0
  Rb  Rb1  3  0.0000  0.0000  0.4887  1.0
  Zr  Zr2  9  0.1688  0.3376  0.3224  1.0
  Mn  Mn3  3  0.0000  0.0000  0.9846  1.0
  S  S4  9  0.0041  0.5020  0.2640  1.0
  S  S5  9  0.1680  0.3361  0.0461  1.0
  S  S6  3  0.0000  0.0000  0.2657  1.0
  S  S7  3  0.0000  0.0000  0.7157  1.0
]