data_BeVBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.77
_cell_length_b   7.77
_cell_length_c   7.77
_cell_angle_alpha   26.63
_cell_angle_beta   26.63
_cell_angle_gamma   26.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeVBi2
_chemical_formula_sum   'Be1 V1 Bi2'
_cell_volume   83.2
_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  V3  1  0.0  0.0  0.24  1.0
  Bi  Bi1  1  0.0  0.0  0.76  1.0
  Bi  Bi2  1  0.0  0.0  0.72  1.0

data_BeVBi2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.2
_cell_length_b   3.58
_cell_length_c   7.77
_cell_angle_alpha   90.0
_cell_angle_beta   105.42
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BeVBi2
_chemical_formula_sum   'Be2 V2 Bi4'
_cell_volume   166.4
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.0  1.0
  V  V1  2  0.0  0.0  0.76  1.0
  Bi  Bi2  2  0.0  0.0  0.28  1.0
  Bi  Bi3  2  0.0  0.0  0.24  1.0

Be V Bi Bi
Be V Bi Bi 0 3 o o - 0 2 o o - 0 1 o o o 2 3 o o o 