data_InSnTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.85
_cell_length_b   6.85
_cell_length_c   6.85
_cell_angle_alpha   141.85
_cell_angle_beta   141.85
_cell_angle_gamma   55.05
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InSnTe2
_chemical_formula_sum   'In1 Sn1 Te2'
_cell_volume   122.0
_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
  In  In0  1  0.0  0.0  0.0  1.0
  Sn  Sn1  1  0.24  0.0  0.04  1.0
  Te  Te2  1  0.0  0.0  0.08  1.0
  Te  Te3  1  0.0  0.24  0.04  1.0

data_InSnTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.48
_cell_length_b   4.48
_cell_length_c   6.85
_cell_angle_alpha   109.07
_cell_angle_beta   109.07
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InSnTe2
_chemical_formula_sum   'In1 Sn1 Te2'
_cell_volume   122.0
_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
  In  In0  1  0.0  0.0  0.0  1.0
  Sn  Sn1  1  0.04  0.8  0.8  1.0
  Te  Te2  1  0.08  0.08  0.08  1.0
  Te  Te3  1  0.8  0.04  0.8  1.0

In Sn Te Te
In Sn Te Te 0 2 o o o 0 1 o o o 0 3 o o o 1 3 o o o 