data_TaCuRe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.67
_cell_length_b   4.46
_cell_length_c   5.17
_cell_angle_alpha   90.0
_cell_angle_beta   98.6
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaCuRe2
_chemical_formula_sum   'Ta1 Cu1 Re2'
_cell_volume   61.02
_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
  Ta  Ta3  1  0.95  0.0  0.56  1.0
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Re  Re1  1  0.82  0.23  0.23  1.0
  Re  Re2  1  0.08  0.23  0.89  1.0

data_TaCuRe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.67
_cell_length_b   4.46
_cell_length_c   5.17
_cell_angle_alpha   90.0
_cell_angle_beta   98.6
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaCuRe2
_chemical_formula_sum   'Ta1 Cu1 Re2'
_cell_volume   61.02
_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
  Ta  Ta0  1  0.95  0.0  0.56  1.0
  Cu  Cu1  1  0.0  0.0  0.0  1.0
  Re  Re2  1  0.08  0.23  0.89  1.0
  Re  Re3  1  0.82  0.23  0.23  1.0

Ta Cu Re Re