data_BeV2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95
_cell_length_b   4.95
_cell_length_c   4.95
_cell_angle_alpha   145.63
_cell_angle_beta   134.44
_cell_angle_gamma   58.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeV2Rh
_chemical_formula_sum   'Be1 V2 Rh1'
_cell_volume   48.54
_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  0.0  1.0
  V  V2  1  0.46  0.0  0.15  1.0
  V  V3  1  0.0  0.92  0.17  1.0
  Rh  Rh1  1  0.0  0.0  0.33  1.0

data_BeV2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.93
_cell_length_b   3.83
_cell_length_c   4.95
_cell_angle_alpha   112.78
_cell_angle_beta   107.18
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeV2Rh
_chemical_formula_sum   'Be1 V2 Rh1'
_cell_volume   48.54
_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  0.0  1.0
  V  V1  1  0.0  0.15  0.69  1.0
  V  V2  1  0.08  0.25  0.25  1.0
  Rh  Rh3  1  0.0  0.33  0.33  1.0

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