data_BaBe2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.73
_cell_length_b   4.73
_cell_length_c   4.26
_cell_angle_alpha   108.71
_cell_angle_beta   108.71
_cell_angle_gamma   104.4
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaBe2Pt
_chemical_formula_sum   'Ba1 Be2 Pt1'
_cell_volume   78.85
_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
  Ba  Ba0  1  0.0  0.0  0.0  1.0
  Be  Be1  1  0.34  0.87  0.82  1.0
  Be  Be2  1  0.34  0.13  0.82  1.0
  Pt  Pt3  1  0.9  0.0  0.0  1.0

data_BaBe2Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.26
_cell_length_b   4.73
_cell_length_c   4.73
_cell_angle_alpha   104.4
_cell_angle_beta   108.71
_cell_angle_gamma   108.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaBe2Pt
_chemical_formula_sum   'Ba1 Be2 Pt1'
_cell_volume   78.85
_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
  Ba  Ba0  1  0.0  0.0  0.0  1.0
  Be  Be1  1  0.82  0.34  0.87  1.0
  Be  Be2  1  0.82  0.34  0.13  1.0
  Pt  Pt3  1  -0.0  0.9  0.0  1.0

Ba Be Be Pt
Ba Be Be Pt 0 3 - o o 1 2 o + o 