data_[Rb1Tm2Cu1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Tm  1.2500  1.7500  1.0950
  Cu  1.9000  1.3500  0.8200
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.2452]
_cell_length_b [7.9940]
_cell_length_c [8.2427]
_cell_angle_alpha [98.5855]
_cell_angle_beta [115.7154]
_cell_angle_gamma [93.0628]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [RbTm2CuCl8]
_chemical_formula_sum '[Rb1 Tm2 Cu1 Cl8]'
_cell_volume [421.5382]
_cell_formula_units_Z [1]
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  1  0.0000  0.5000  0.0000  1.0
  Tm  Tm1  2  0.4918  0.7581  0.5280  1.0
  Cu  Cu2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  2  0.0953  0.1888  0.2417  1.0
  Cl  Cl4  2  0.1094  0.7217  0.3899  1.0
  Cl  Cl5  2  0.4885  0.5028  0.7049  1.0
  Cl  Cl6  2  0.4892  0.0618  0.7084  1.0
]