data_Be2GaW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.6
_cell_length_b   4.6
_cell_length_c   4.5
_cell_angle_alpha   104.27
_cell_angle_beta   104.27
_cell_angle_gamma   34.74
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2GaW
_chemical_formula_sum   'Be2 Ga1 W1'
_cell_volume   52.31
_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  0.27  0.0  0.31  1.0
  Be  Be1  1  0.34  0.0  0.03  1.0
  Ga  Ga2  1  0.0  0.0  0.0  1.0
  W  W3  1  0.81  0.0  0.17  1.0

data_Be2GaW
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.74
_cell_length_b   4.5
_cell_length_c   4.6
_cell_angle_alpha   104.27
_cell_angle_beta   107.37
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2GaW
_chemical_formula_sum   'Be2 Ga1 W1'
_cell_volume   52.31
_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  0.03  0.34  1.0
  Be  Be1  1  0.0  0.31  0.27  1.0
  Ga  Ga2  1  0.0  0.0  0.0  1.0
  W  W3  1  0.0  0.17  0.81  1.0

Be Be Ga W
Be Be Ga W 0 2 o o o 0 1 o o o 1 2 o o o 2 3 - o o 