data_TaCuRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.16
_cell_length_b   5.16
_cell_length_c   2.75
_cell_angle_alpha   103.77
_cell_angle_beta   103.77
_cell_angle_gamma   115.56
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaCuRh2
_chemical_formula_sum   'Ta1 Cu1 Rh2'
_cell_volume   59.19
_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  0.75  0.0  0.0  1.0
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.76  0.18  0.23  1.0
  Rh  Rh2  1  0.76  0.82  0.23  1.0

data_TaCuRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.75
_cell_length_b   4.93
_cell_length_c   5.16
_cell_angle_alpha   117.51
_cell_angle_beta   103.77
_cell_angle_gamma   93.44
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaCuRh2
_chemical_formula_sum   'Ta1 Cu1 Rh2'
_cell_volume   59.19
_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  -0.0  0.0  0.75  1.0
  Cu  Cu1  1  0.0  0.0  0.0  1.0
  Rh  Rh2  1  0.05  0.82  0.58  1.0
  Rh  Rh3  1  0.41  0.18  0.94  1.0

Ta Cu Rh Rh
Ta Cu Rh Rh 0 2 o o o 0 1 + o o 0 3 o - o 