data_Be2CuRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.54
_cell_length_b   2.54
_cell_length_c   7.6
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   113.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2CuRh
_chemical_formula_sum   'Be2 Cu1 Rh1'
_cell_volume   45.09
_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  0.56  1.0
  Be  Be1  1  0.39  0.0  0.75  1.0
  Cu  Cu2  1  0.0  0.0  0.97  1.0
  Rh  Rh3  1  0.39  0.0  0.73  1.0

data_Be2CuRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.54
_cell_length_b   2.54
_cell_length_c   7.6
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   113.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2CuRh
_chemical_formula_sum   'Be2 Cu1 Rh1'
_cell_volume   45.09
_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  0.56  1.0
  Be  Be1  1  0.39  0.0  0.75  1.0
  Cu  Cu2  1  0.0  0.0  0.97  1.0
  Rh  Rh3  1  0.39  0.0  0.73  1.0

Be Be Cu Rh
Be Be Cu Rh 0 3 - o o 0 3 o o o 0 1 o o o 1 3 o o o 1 2 + o o 1 2 o o o 2 3 - o o 2 3 o o o 2 2 o + o 2 2 + o o 