data_Ba2MgRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.75
_cell_length_b   4.75
_cell_length_c   8.92
_cell_angle_alpha   104.02
_cell_angle_beta   104.02
_cell_angle_gamma   55.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2MgRh
_chemical_formula_sum   'Ba2 Mg1 Rh1'
_cell_volume   159.14
_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
  Ba  Ba0  1  0.27  0.0  0.02  1.0
  Ba  Ba1  1  0.26  0.0  0.42  1.0
  Mg  Mg2  1  0.89  0.0  0.22  1.0
  Rh  Rh3  1  0.56  0.0  0.22  1.0

data_Ba2MgRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.4
_cell_length_b   4.75
_cell_length_c   8.92
_cell_angle_alpha   104.02
_cell_angle_beta   90.0
_cell_angle_gamma   117.59
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2MgRh
_chemical_formula_sum   'Ba2 Mg1 Rh1'
_cell_volume   159.14
_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
  Ba  Ba0  1  0.0  0.73  0.98  1.0
  Ba  Ba1  1  0.0  0.74  0.58  1.0
  Mg  Mg2  1  0.0  0.11  0.78  1.0
  Rh  Rh3  1  0.0  0.44  0.78  1.0

Ba Ba Mg Rh