data_[Sr6Tl2Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Tl  1.6200  1.9000  1.3325
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.2486]
_cell_length_b [5.3309]
_cell_length_c [9.4647]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.0619]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Sr3TlRh]
_chemical_formula_sum '[Sr6 Tl2 Rh2]'
_cell_volume [354.7702]
_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
[
  Sr  Sr0  2  0.0376  0.7500  0.3469  1.0
  Sr  Sr1  2  0.2462  0.7500  0.9444  1.0
  Sr  Sr2  2  0.4336  0.2500  0.6057  1.0
  Tl  Tl3  2  0.3082  0.2500  0.2017  1.0
  Rh  Rh4  2  0.2928  0.7500  0.6470  1.0
]