data_[Sm2Y4In6Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Y  1.2200  1.8000  1.0400
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.6959]
_cell_length_b [13.3343]
_cell_length_c [8.5185]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.5421]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SmY2(InTe2)3]
_chemical_formula_sum '[Sm2 Y4 In6 Te12]'
_cell_volume [833.5065]
_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
[
  Sm  Sm0  2  0.0000  0.0000  0.0000  1.0
  Y  Y1  4  0.0000  0.3332  0.0000  1.0
  In  In2  4  0.0000  0.1653  0.5000  1.0
  In  In3  2  0.0000  0.5000  0.5000  1.0
  Te  Te4  8  0.2428  0.1688  0.2215  1.0
  Te  Te5  4  0.2357  0.5000  0.2201  1.0
]