data_Y2ReTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01
_cell_length_b   5.01
_cell_length_c   3.72
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   91.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2ReTe
_chemical_formula_sum   'Y2 Re1 Te1'
_cell_volume   93.56
_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
  Y  Y2  1  0.75  0.79  0.86  1.0
  Y  Y3  1  0.75  0.21  0.86  1.0
  Re  Re0  1  0.51  0.0  0.0  1.0
  Te  Te1  1  0.0  0.0  0.0  1.0

data_Y2ReTe
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.72
_cell_length_b   5.01
_cell_length_c   5.01
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Y2ReTe
_chemical_formula_sum   'Y2 Re1 Te1'
_cell_volume   93.58
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Y  Y0  2  0.86  0.21  0.75  1.0
  Re  Re1  1  0.0  0.0  0.51  1.0
  Te  Te2  1  0.0  0.0  0.0  1.0

Y Y Re Te
Y Y Re Te 0 2 o + + 0 3 + + + 1 2 o o + 1 3 + o + 