data_Be2CdGa
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.02
_cell_length_b   4.02
_cell_length_c   5.74
_cell_angle_alpha   101.19
_cell_angle_beta   101.19
_cell_angle_gamma   41.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2CdGa
_chemical_formula_sum   'Be2 Cd1 Ga1'
_cell_volume   60.15
_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  0.33  0.0  0.24  1.0
  Be  Be1  1  0.96  0.0  0.76  1.0
  Cd  Cd2  1  0.22  0.0  0.05  1.0
  Ga  Ga3  1  0.33  0.0  0.99  1.0

data_Be2CdGa
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.85
_cell_length_b   4.02
_cell_length_c   5.74
_cell_angle_alpha   101.19
_cell_angle_beta   90.0
_cell_angle_gamma   110.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2CdGa
_chemical_formula_sum   'Be2 Cd1 Ga1'
_cell_volume   60.15
_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  0.04  0.24  1.0
  Be  Be1  1  0.0  0.67  0.76  1.0
  Cd  Cd2  1  0.0  0.78  0.95  1.0
  Ga  Ga3  1  0.0  0.67  0.01  1.0

Be Be Cd Ga