data_KReTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56
_cell_length_b   7.39
_cell_length_c   7.39
_cell_angle_alpha   34.8
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KReTe2
_chemical_formula_sum   'K1 Re1 Te2'
_cell_volume   142.05
_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
  K  K0  1  0.0  0.0  0.51  1.0
  Re  Re1  1  0.28  0.0  0.57  1.0
  Te  Te2  1  0.0  0.0  0.34  1.0
  Te  Te3  1  0.28  0.0  0.86  1.0

data_KReTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.42
_cell_length_b   4.56
_cell_length_c   7.39
_cell_angle_alpha   90.0
_cell_angle_beta   107.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KReTe2
_chemical_formula_sum   'K1 Re1 Te2'
_cell_volume   142.05
_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
  K  K0  1  0.49  0.0  0.49  1.0
  Re  Re1  1  0.43  0.28  0.43  1.0
  Te  Te2  1  0.14  0.28  0.14  1.0
  Te  Te3  1  0.66  0.0  0.66  1.0

K Re Te Te
K Re Te Te 0 2 o o o 0 1 o o o 1 3 o o o 