data_V2CoO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03
_cell_length_b   5.03
_cell_length_c   6.73
_cell_angle_alpha   109.86
_cell_angle_beta   109.86
_cell_angle_gamma   41.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2CoO6
_chemical_formula_sum   'V2 Co1 O6'
_cell_volume   104.54
_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  0.75  0.95  0.16  1.0
  V  V1  1  0.22  0.95  0.11  1.0
  Co  Co2  1  0.71  0.77  0.0  1.0
  O  O3  1  0.14  0.95  0.54  1.0
  O  O4  1  0.56  0.95  0.55  1.0
  O  O5  1  0.41  0.95  0.73  1.0
  O  O6  1  0.83  0.95  0.73  1.0
  O  O7  1  0.09  0.94  0.58  1.0
  O  O8  1  0.88  0.94  0.7  1.0

data_V2CoO6
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   5.03
_cell_length_c   6.73
_cell_angle_alpha   109.86
_cell_angle_beta   90.0
_cell_angle_gamma   110.61
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2CoO6
_chemical_formula_sum   'V2 Co1 O6'
_cell_volume   104.54
_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  0.05  0.3  0.84  1.0
  V  V1  1  0.05  0.83  0.89  1.0
  Co  Co2  1  0.23  0.53  0.0  1.0
  O  O3  1  0.05  0.22  0.27  1.0
  O  O4  1  0.05  0.9  0.46  1.0
  O  O5  1  0.05  0.48  0.45  1.0
  O  O6  1  0.05  0.64  0.27  1.0
  O  O7  1  0.06  0.18  0.3  1.0
  O  O8  1  0.06  0.97  0.42  1.0

V V Co O O O O O O