data_[Rb1V1Cu2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  V  1.6300  1.3500  0.7775
  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 [6.8186]
_cell_length_b [7.1217]
_cell_length_c [8.2204]
_cell_angle_alpha [98.8179]
_cell_angle_beta [90.4490]
_cell_angle_gamma [118.4240]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [RbV(CuCl4)2]
_chemical_formula_sum '[Rb1 V1 Cu2 Cl8]'
_cell_volume [345.4065]
_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  0.0000  0.5000  1.0
  V  V1  1  0.0000  0.0000  0.0000  1.0
  Cu  Cu2  2  0.4773  0.9494  0.6813  1.0
  Cl  Cl3  2  0.1414  0.2912  0.8770  1.0
  Cl  Cl4  2  0.1615  0.8372  0.8209  1.0
  Cl  Cl5  2  0.3204  0.1735  0.1866  1.0
  Cl  Cl6  2  0.3551  0.7320  0.4148  1.0
]