data_Zr2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.55
_cell_length_b   5.55
_cell_length_c   17.9
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Rh
_chemical_formula_sum   'Zr16 Rh8'
_cell_volume   477.24
_cell_formula_units_Z   8
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
  Zr  Zr8  1  0.77  0.6  0.21  1.0
  Zr  Zr9  1  0.0  0.2  0.69  1.0
  Zr  Zr10  1  0.0  0.2  0.26  1.0
  Zr  Zr11  1  0.77  0.6  0.64  1.0
  Zr  Zr12  1  0.61  0.4  0.95  1.0
  Zr  Zr13  1  0.39  0.4  0.95  1.0
  Zr  Zr14  1  0.77  0.0  0.95  1.0
  Zr  Zr15  1  0.61  0.4  0.0  1.0
  Zr  Zr16  1  0.39  0.4  0.0  1.0
  Zr  Zr17  1  0.77  0.0  0.0  1.0
  Zr  Zr18  1  0.33  0.77  0.42  1.0
  Zr  Zr19  1  0.22  0.77  0.42  1.0
  Zr  Zr20  1  0.77  0.27  0.42  1.0
  Zr  Zr21  1  0.45  0.04  0.47  1.0
  Zr  Zr22  1  0.55  0.04  0.47  1.0
  Zr  Zr23  1  0.0  0.53  0.47  1.0
  Rh  Rh0  1  0.0  0.0  0.76  1.0
  Rh  Rh1  1  0.0  0.0  0.13  1.0
  Rh  Rh2  1  0.0  0.0  0.81  1.0
  Rh  Rh3  1  0.0  0.0  0.08  1.0
  Rh  Rh4  1  0.77  0.6  0.13  1.0
  Rh  Rh5  1  0.0  0.2  0.76  1.0
  Rh  Rh6  1  0.0  0.2  0.08  1.0
  Rh  Rh7  1  0.77  0.6  0.82  1.0

data_Zr2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.55
_cell_length_b   5.55
_cell_length_c   17.9
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Rh
_chemical_formula_sum   'Zr16 Rh8'
_cell_volume   477.24
_cell_formula_units_Z   8
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
  Zr  Zr0  1  -0.0  0.2  0.26  1.0
  Zr  Zr1  1  -0.0  0.2  0.69  1.0
  Zr  Zr2  1  -0.0  0.53  0.47  1.0
  Zr  Zr3  1  0.22  0.77  0.42  1.0
  Zr  Zr4  1  0.33  0.77  0.42  1.0
  Zr  Zr5  1  0.39  0.4  0.0  1.0
  Zr  Zr6  1  0.39  0.4  0.95  1.0
  Zr  Zr7  1  0.45  0.04  0.47  1.0
  Zr  Zr8  1  0.55  0.04  0.47  1.0
  Zr  Zr9  1  0.61  0.4  0.0  1.0
  Zr  Zr10  1  0.61  0.4  0.95  1.0
  Zr  Zr11  1  0.77  0.0  0.0  1.0
  Zr  Zr12  1  0.77  0.0  0.95  1.0
  Zr  Zr13  1  0.77  0.27  0.42  1.0
  Zr  Zr14  1  0.77  0.6  0.21  1.0
  Zr  Zr15  1  0.77  0.6  0.64  1.0
  Rh  Rh16  1  -0.0  0.2  0.08  1.0
  Rh  Rh17  1  -0.0  0.2  0.76  1.0
  Rh  Rh18  1  0.0  0.0  0.08  1.0
  Rh  Rh19  1  0.0  0.0  0.13  1.0
  Rh  Rh20  1  0.0  0.0  0.76  1.0
  Rh  Rh21  1  0.0  0.0  0.81  1.0
  Rh  Rh22  1  0.77  0.6  0.13  1.0
  Rh  Rh23  1  0.77  0.6  0.82  1.0

Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Zr Rh Rh Rh Rh Rh Rh Rh Rh