data_Be2AlIn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.12
_cell_length_b   6.12
_cell_length_c   6.12
_cell_angle_alpha   153.19
_cell_angle_beta   142.8
_cell_angle_gamma   46.44
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2AlIn
_chemical_formula_sum   'Be2 Al1 In1'
_cell_volume   62.37
_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  Be1  1  0.42  0.0  0.91  1.0
  Be  Be2  1  0.0  0.0  0.7  1.0
  Al  Al0  1  0.0  0.0  0.16  1.0
  In  In3  1  0.42  0.0  0.1  1.0

data_Be2AlIn
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.84
_cell_length_b   3.91
_cell_length_c   6.12
_cell_angle_alpha   108.6
_cell_angle_beta   103.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2AlIn
_chemical_formula_sum   'Be2 Al1 In1'
_cell_volume   62.37
_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  0.3  0.3  0.3  1.0
  Be  Be1  1  0.5  0.09  0.5  1.0
  Al  Al2  1  0.84  0.84  0.84  1.0
  In  In3  1  0.31  0.9  0.31  1.0

Be Be Al In