data_Ti2VPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13
_cell_length_b   5.13
_cell_length_c   5.13
_cell_angle_alpha   137.08
_cell_angle_beta   137.08
_cell_angle_gamma   62.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2VPt
_chemical_formula_sum   'Ti2 V1 Pt1'
_cell_volume   61.93
_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
  Ti  Ti1  1  0.0  0.0  0.0  1.0
  Ti  Ti2  1  0.88  0.0  0.2  1.0
  V  V3  1  0.0  0.0  0.39  1.0
  Pt  Pt0  1  0.0  0.88  0.2  1.0

data_Ti2VPt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.76
_cell_length_b   3.76
_cell_length_c   5.13
_cell_angle_alpha   111.46
_cell_angle_beta   111.46
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2VPt
_chemical_formula_sum   'Ti2 V1 Pt1'
_cell_volume   61.93
_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
  Ti  Ti0  1  0.0  0.0  0.0  1.0
  Ti  Ti1  1  0.2  0.32  0.32  1.0
  V  V2  1  0.39  0.39  0.39  1.0
  Pt  Pt3  1  0.32  0.2  0.32  1.0

Ti Ti V Pt