data_Co(ClO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.77
_cell_length_b   4.77
_cell_length_c   26.36
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co(ClO4)2
_chemical_formula_sum   'Co1 Cl2 O8'
_cell_volume   519.74
_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
  Co  Co0  1  0.67  0.33  0.5  1.0
  Cl  Cl1  1  0.33  0.67  0.57  1.0
  Cl  Cl2  1  0.0  0.0  0.43  1.0
  O  O3  1  0.62  0.96  0.55  1.0
  O  O4  1  0.35  0.38  0.55  1.0
  O  O5  1  0.04  0.65  0.55  1.0
  O  O6  1  0.3  0.01  0.45  1.0
  O  O7  1  0.72  0.7  0.45  1.0
  O  O8  1  0.99  0.28  0.45  1.0
  O  O9  1  0.33  0.67  0.62  1.0
  O  O10  1  0.0  0.0  0.38  1.0

Co Cl Cl O O O O O O O O 0 6 o o o 0 7 o o o 0 4 o o o 0 8 o o o 0 3 o - o 0 5 + o o 1 5 o o o 1 4 o o o 1 3 o o o 1 9 o o o 2 7 - - o 2 8 - o o 2 10 o o o 2 6 o o o 
data_Co(ClO4)2
_symmetry_space_group_name_H-M   P-3
_cell_length_a   4.77
_cell_length_b   4.77
_cell_length_c   26.36
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   147
_chemical_formula_structural   Co(ClO4)2
_chemical_formula_sum   'Co1 Cl2 O8'
_cell_volume   519.74
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, -y, -z'
  3  '-y, x-y, z'
  4  'y, -x+y, -z'
  5  '-x+y, -x, z'
  6  'x-y, x, -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
  Co  Co0  1  0.0  0.0  0.5  1.0
  Cl  Cl1  2  0.33  0.67  0.43  1.0
  O  O2  6  0.05  0.37  0.45  1.0
  O  O3  2  0.33  0.67  0.38  1.0
