data_TaB2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.16
_cell_length_b   4.16
_cell_length_c   4.16
_cell_angle_alpha   131.78
_cell_angle_beta   108.28
_cell_angle_gamma   91.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaB2Pt
_chemical_formula_sum   'Ta1 B2 Pt1'
_cell_volume   48.32
_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  0.0  0.0  0.0  1.0
  B  B0  1  0.0  0.44  0.33  1.0
  B  B1  1  0.7  0.0  0.58  1.0
  Pt  Pt2  1  0.0  0.0  0.91  1.0

data_TaB2Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.4
_cell_length_b   4.16
_cell_length_c   4.16
_cell_angle_alpha   71.72
_cell_angle_beta   65.89
_cell_angle_gamma   65.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaB2Pt
_chemical_formula_sum   'Ta1 B2 Pt1'
_cell_volume   48.32
_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  0.0  0.0  0.0  1.0
  B  B1  1  0.33  0.0  0.11  1.0
  B  B2  1  0.88  0.7  0.42  1.0
  Pt  Pt3  1  0.91  0.0  0.09  1.0

Ta B B Pt
Ta B B Pt 0 3 o o - 0 1 o o o 0 2 - o - 1 3 o o - 2 3 + o o 