data_VPOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38
_cell_length_b   4.38
_cell_length_c   4.72
_cell_angle_alpha   95.33
_cell_angle_beta   95.33
_cell_angle_gamma   37.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VPOs2
_chemical_formula_sum   'V1 P1 Os2'
_cell_volume   55.01
_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  0.91  0.0  0.35  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  Os  Os0  1  0.18  0.0  0.15  1.0
  Os  Os1  1  0.64  0.0  0.55  1.0

data_VPOs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   4.38
_cell_length_c   4.72
_cell_angle_alpha   95.33
_cell_angle_beta   90.0
_cell_angle_gamma   108.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VPOs2
_chemical_formula_sum   'V1 P1 Os2'
_cell_volume   55.01
_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  0.09  0.65  1.0
  P  P1  1  0.0  0.0  0.0  1.0
  Os  Os2  1  0.0  0.36  0.45  1.0
  Os  Os3  1  0.0  0.82  0.85  1.0

V P Os Os