data_[Rb2Sc2Mn4S14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Sc  1.3600  1.6000  0.8850
  Mn  1.5500  1.4000  0.6483
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [8.8248]
_cell_length_b [9.7704]
_cell_length_c [6.6093]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.2803]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [RbScMn2S7]
_chemical_formula_sum '[Rb2 Sc2 Mn4 S14]'
_cell_volume [563.9319]
_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
[
  Rb  Rb0  2  0.0000  0.8985  0.0000  1
  Sc  Sc1  2  0.0000  0.4861  0.5000  1
  Mn  Mn2  4  0.1924  0.1375  0.5801  1
  S  S3  4  0.1433  0.3095  0.7483  1
  S  S4  4  0.1608  0.5190  0.2122  1
  S  S5  4  0.1933  0.6664  0.6711  1
  S  S6  2  0.0000  0.0002  0.5000  1
]