data_BeTl2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.86
_cell_length_b   5.35
_cell_length_c   5.35
_cell_angle_alpha   43.96
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeTl2Rh
_chemical_formula_sum   'Be1 Tl2 Rh1'
_cell_volume   76.76
_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
  Be  Be0  1  0.0  0.0  0.03  1.0
  Tl  Tl2  1  0.0  0.0  0.96  1.0
  Tl  Tl3  1  0.93  0.0  0.99  1.0
  Rh  Rh1  1  0.93  0.0  0.9  1.0

data_BeTl2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.86
_cell_length_b   4.01
_cell_length_c   5.35
_cell_angle_alpha   111.98
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeTl2Rh
_chemical_formula_sum   'Be1 Tl2 Rh1'
_cell_volume   76.76
_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
  Be  Be0  1  0.0  0.03  0.03  1.0
  Tl  Tl1  1  0.0  0.96  0.96  1.0
  Tl  Tl2  1  0.07  0.99  0.99  1.0
  Rh  Rh3  1  0.07  0.9  0.9  1.0

Be Tl Tl Rh
Be Tl Tl Rh 0 2 - o - 0 1 o o - 1 2 - o o 1 3 - o o 2 3 o o o 