data_[Rb2Te4As2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Te  2.1000  1.4000  1.2933
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.6605]
_cell_length_b [5.6777]
_cell_length_c [9.9960]
_cell_angle_alpha [85.8128]
_cell_angle_beta [84.3534]
_cell_angle_gamma [89.2089]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [RbTe2As]
_chemical_formula_sum '[Rb2 Te4 As2]'
_cell_volume [318.8388]
_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  1  0.1247  0.4023  0.2015  1
  Rb  Rb1  1  0.4118  0.8382  0.8261  1
  Te  Te2  1  0.0244  0.8099  0.5176  1
  Te  Te3  1  0.5111  0.3178  0.5105  1
  Te  Te4  1  0.6580  0.9264  0.1678  1
  Te  Te5  1  0.8793  0.3048  0.8599  1
  As  As6  1  0.5817  0.8613  0.4286  1
  As  As7  1  0.9548  0.3339  0.5988  1
]