data_SrIn2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.09
_cell_length_b   4.09
_cell_length_c   7.4
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   95.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrIn2Te
_chemical_formula_sum   'Sr1 In2 Te1'
_cell_volume   123.12
_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
  Sr  Sr2  1  0.0  0.0  0.0  1.0
  In  In0  1  0.76  0.0  0.3  1.0
  In  In1  1  0.76  0.0  0.1  1.0
  Te  Te3  1  0.0  0.0  0.7  1.0

data_SrIn2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.09
_cell_length_b   4.09
_cell_length_c   7.4
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   95.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrIn2Te
_chemical_formula_sum   'Sr1 In2 Te1'
_cell_volume   123.12
_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
  Sr  Sr0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.76  0.0  0.1  1.0
  In  In2  1  0.76  0.0  0.3  1.0
  Te  Te3  1  0.0  0.0  0.7  1.0

Sr In In Te
Sr In In Te 0 2 - o o 0 3 o o - 1 2 o o o 