data_TaBePt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.82
_cell_length_b   3.75
_cell_length_c   5.73
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaBePt2
_chemical_formula_sum   'Ta1 Be1 Pt2'
_cell_volume   60.48
_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
  Ta  Ta3  1  0.41  0.88  0.8  1.0
  Be  Be0  1  0.0  0.0  0.7  1.0
  Pt  Pt1  1  0.41  0.88  0.35  1.0
  Pt  Pt2  1  0.0  0.0  0.47  1.0

data_TaBePt2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   3.75
_cell_length_c   5.73
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaBePt2
_chemical_formula_sum   'Ta1 Be1 Pt2'
_cell_volume   60.48
_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
  Ta  Ta0  1  0.41  0.88  0.8  1.0
  Be  Be1  1  0.0  0.0  0.7  1.0
  Pt  Pt2  1  0.0  0.0  0.47  1.0
  Pt  Pt3  1  0.41  0.88  0.35  1.0

Ta Be Pt Pt
Ta Be Pt Pt 0 1 o + o 1 3 o o o 2 3 o + o 