data_V2PPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.68
_cell_length_b   4.68
_cell_length_c   2.73
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   115.7
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2PPt
_chemical_formula_sum   'V2 P1 Pt1'
_cell_volume   53.88
_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  V2  1  0.25  0.02  0.36  1.0
  V  V3  1  0.25  0.98  0.36  1.0
  P  P0  1  0.0  0.0  0.0  1.0
  Pt  Pt1  1  0.49  0.0  0.0  1.0

data_V2PPt
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   4.68
_cell_length_c   4.68
_cell_angle_alpha   115.7
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2PPt
_chemical_formula_sum   'V2 P1 Pt1'
_cell_volume   53.88
_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  0.36  0.25  0.02  1.0
  V  V1  1  0.36  0.25  0.98  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  Pt  Pt3  1  0.0  0.49  0.0  1.0

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