data_BePd2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02
_cell_length_b   5.02
_cell_length_c   2.73
_cell_angle_alpha   100.19
_cell_angle_beta   100.19
_cell_angle_gamma   117.49
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BePd2Pt
_chemical_formula_sum   'Be1 Pd2 Pt1'
_cell_volume   57.43
_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  0.0  0.0  1.0
  Pd  Pd1  1  0.84  0.14  0.29  1.0
  Pd  Pd2  1  0.84  0.86  0.29  1.0
  Pt  Pt3  1  0.6  0.0  0.0  1.0

data_BePd2Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   4.99
_cell_length_c   5.02
_cell_angle_alpha   116.4
_cell_angle_beta   100.19
_cell_angle_gamma   101.09
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BePd2Pt
_chemical_formula_sum   'Be1 Pd2 Pt1'
_cell_volume   57.43
_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  0.0  0.0  1.0
  Pd  Pd1  1  0.14  0.86  0.69  1.0
  Pd  Pd2  1  0.43  0.14  0.98  1.0
  Pt  Pt3  1  0.0  0.0  0.6  1.0

Be Pd Pd Pt