data_VAg2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45
_cell_length_b   5.45
_cell_length_c   5.45
_cell_angle_alpha   146.01
_cell_angle_beta   131.9
_cell_angle_gamma   60.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VAg2Pt
_chemical_formula_sum   'V1 Ag2 Pt1'
_cell_volume   66.58
_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
  V  V3  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.0  0.22  0.37  1.0
  Ag  Ag1  1  0.59  0.0  0.34  1.0
  Pt  Pt2  1  0.0  0.0  0.71  1.0

data_VAg2Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.18
_cell_length_b   4.44
_cell_length_c   5.45
_cell_angle_alpha   114.05
_cell_angle_beta   106.99
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VAg2Pt
_chemical_formula_sum   'V1 Ag2 Pt1'
_cell_volume   66.58
_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
  V  V0  1  0.0  0.0  0.0  1.0
  Ag  Ag1  1  0.0  0.34  0.75  1.0
  Ag  Ag2  1  0.78  0.16  0.16  1.0
  Pt  Pt3  1  0.0  0.71  0.71  1.0

V Ag Ag Pt
V Ag Ag Pt 0 1 o o o 0 3 o o - 2 3 + o o 