data_BeAl2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.06
_cell_length_b   6.06
_cell_length_c   3.37
_cell_angle_alpha   106.12
_cell_angle_beta   106.12
_cell_angle_gamma   126.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeAl2Pb
_chemical_formula_sum   'Be1 Al2 Pb1'
_cell_volume   78.52
_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  Be2  1  0.0  0.0  0.0  1.0
  Al  Al0  1  0.37  0.3  0.0  1.0
  Al  Al1  1  0.37  0.7  0.0  1.0
  Pb  Pb3  1  0.74  0.0  0.0  1.0

data_BeAl2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.37
_cell_length_b   4.32
_cell_length_c   6.06
_cell_angle_alpha   110.87
_cell_angle_beta   106.12
_cell_angle_gamma   90.01
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeAl2Pb
_chemical_formula_sum   'Be1 Al2 Pb1'
_cell_volume   78.52
_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
  Al  Al1  1  0.3  0.3  0.67  1.0
  Al  Al2  1  0.7  0.7  0.07  1.0
  Pb  Pb3  1  -0.0  0.0  0.74  1.0

Be Al Al Pb