data_MgZrRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.79
_cell_length_b   5.79
_cell_length_c   5.79
_cell_angle_alpha   147.82
_cell_angle_beta   146.7
_cell_angle_gamma   46.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgZrRh
_chemical_formula_sum   'Mg1 Zr1 Rh1'
_cell_volume   56.69
_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
  Mg  Mg0  1  0.0  0.0  0.21  1.0
  Zr  Zr2  1  0.0  0.0  0.3  1.0
  Rh  Rh1  1  0.0  0.0  0.12  1.0

data_MgZrRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.21
_cell_length_b   3.32
_cell_length_c   5.79
_cell_angle_alpha   106.65
_cell_angle_beta   106.09
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgZrRh
_chemical_formula_sum   'Mg1 Zr1 Rh1'
_cell_volume   56.69
_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
  Mg  Mg0  1  0.0  0.21  0.21  1.0
  Zr  Zr1  1  0.0  0.3  0.3  1.0
  Rh  Rh2  1  0.0  0.12  0.12  1.0

Mg Zr Rh