data_Ba2TeRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81
_cell_length_b   5.81
_cell_length_c   5.81
_cell_angle_alpha   123.4
_cell_angle_beta   121.64
_cell_angle_gamma   85.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2TeRh
_chemical_formula_sum   'Ba2 Te1 Rh1'
_cell_volume   133.28
_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  0.84  0.16  1.0
  Ba  Ba1  1  0.76  0.0  0.1  1.0
  Te  Te3  1  0.0  0.0  0.26  1.0
  Rh  Rh2  1  0.0  0.0  0.0  1.0

data_Ba2TeRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.51
_cell_length_b   5.67
_cell_length_c   5.81
_cell_angle_alpha   119.18
_cell_angle_beta   118.3
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2TeRh
_chemical_formula_sum   'Ba2 Te1 Rh1'
_cell_volume   133.28
_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  0.1  0.34  1.0
  Ba  Ba1  1  0.16  0.33  0.33  1.0
  Te  Te2  1  0.0  0.26  0.26  1.0
  Rh  Rh3  1  0.0  0.0  0.0  1.0

Ba Ba Te Rh