data_BaBe2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.05
_cell_length_b   4.05
_cell_length_c   6.29
_cell_angle_alpha   109.11
_cell_angle_beta   109.11
_cell_angle_gamma   59.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaBe2Pt
_chemical_formula_sum   'Ba1 Be2 Pt1'
_cell_volume   82.66
_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  0.75  0.0  0.52  1.0
  Be  Be1  1  0.63  0.0  0.57  1.0
  Be  Be2  1  0.96  0.0  0.32  1.0
  Pt  Pt3  1  0.3  0.0  0.15  1.0

data_BaBe2Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.04
_cell_length_b   4.05
_cell_length_c   6.27
_cell_angle_alpha   71.46
_cell_angle_beta   71.23
_cell_angle_gamma   60.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaBe2Pt
_chemical_formula_sum   'Ba1 Be2 Pt1'
_cell_volume   82.66
_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  0.23  0.52  1.0
  Be  Be1  1  0.0  0.06  0.57  1.0
  Be  Be2  1  0.0  0.64  0.32  1.0
  Pt  Pt3  1  0.0  0.15  0.15  1.0

Ba Be Be Pt