data_[Rb4Ba4Sc4Si12O36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Ba  0.8900  2.1500  1.4900
  Sc  1.3600  1.6000  0.8850
  Si  1.9000  1.1000  0.5400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.9413]
_cell_length_b [10.2169]
_cell_length_c [13.6948]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.3573]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [RbBaSc(SiO3)3]
_chemical_formula_sum '[Rb4 Ba4 Sc4 Si12 O36]'
_cell_volume [838.0504]
_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
[
  Rb  Rb0  4  0.1644  0.0533  0.9202  1
  Ba  Ba1  4  0.1726  0.0601  0.4121  1
  Sc  Sc2  4  0.4769  0.5038  0.2341  1
  Si  Si3  4  0.1163  0.2481  0.1224  1
  Si  Si4  4  0.2501  0.7467  0.3151  1
  Si  Si5  4  0.3720  0.7357  0.5588  1
  O  O6  4  0.0132  0.2490  0.7087  1
  O  O7  4  0.1006  0.7129  0.5068  1
  O  O8  4  0.1922  0.1060  0.6090  1
  O  O9  4  0.2393  0.6303  0.2338  1
  O  O10  4  0.2822  0.1270  0.1519  1
  O  O11  4  0.2979  0.6052  0.7936  1
  O  O12  4  0.4129  0.7045  0.4497  1
  O  O13  4  0.4408  0.6117  0.0889  1
  O  O14  4  0.4869  0.1261  0.8498  1
]