data_VCoOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.68
_cell_length_b   8.68
_cell_length_c   8.68
_cell_angle_alpha   17.81
_cell_angle_beta   17.81
_cell_angle_gamma   17.81
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCoOs2
_chemical_formula_sum   'V1 Co1 Os2'
_cell_volume   53.35
_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
  Co  Co0  1  0.0  0.0  0.81  1.0
  Os  Os1  1  0.0  0.0  0.26  1.0
  Os  Os2  1  0.0  0.0  0.35  1.0

data_VCoOs2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.65
_cell_length_b   2.69
_cell_length_c   8.68
_cell_angle_alpha   90.0
_cell_angle_beta   100.3
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   VCoOs2
_chemical_formula_sum   'V2 Co2 Os4'
_cell_volume   106.71
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.0  1.0
  Co  Co1  2  0.0  0.0  0.19  1.0
  Os  Os2  2  0.0  0.0  0.65  1.0
  Os  Os3  2  0.0  0.0  0.74  1.0

V Co Os Os
V Co Os Os 0 1 o o - 2 3 o o o 