data_CuRe2Ag
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02
_cell_length_b   5.02
_cell_length_c   4.65
_cell_angle_alpha   101.44
_cell_angle_beta   101.44
_cell_angle_gamma   31.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuRe2Ag
_chemical_formula_sum   'Cu1 Re2 Ag1'
_cell_volume   60.04
_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
  Cu  Cu1  1  0.0  0.0  0.0  1.0
  Re  Re2  1  0.92  0.0  0.1  1.0
  Re  Re3  1  0.8  0.0  0.46  1.0
  Ag  Ag0  1  0.36  0.0  0.28  1.0

data_CuRe2Ag
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   4.65
_cell_length_c   5.02
_cell_angle_alpha   101.44
_cell_angle_beta   105.75
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuRe2Ag
_chemical_formula_sum   'Cu1 Re2 Ag1'
_cell_volume   60.04
_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
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Re  Re1  1  0.0  0.1  0.92  1.0
  Re  Re2  1  0.0  0.46  0.8  1.0
  Ag  Ag3  1  0.0  0.28  0.36  1.0

Cu Re Re Ag