data_CoSeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.87
_cell_length_b   4.87
_cell_length_c   6.48
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   111.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoSeO4
_chemical_formula_sum   'Co2 Se2 O8'
_cell_volume   142.43
_cell_formula_units_Z   2
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  0.0  0.0  0.24  1.0
  Co  Co1  1  0.0  0.0  0.0  1.0
  Se  Se10  1  0.72  0.18  0.62  1.0
  Se  Se11  1  0.72  0.82  0.86  1.0
  O  O2  1  0.72  0.04  0.04  1.0
  O  O3  1  0.09  0.17  0.62  1.0
  O  O4  1  0.36  0.17  0.62  1.0
  O  O5  1  0.72  0.04  0.2  1.0
  O  O6  1  0.72  0.96  0.28  1.0
  O  O7  1  0.09  0.83  0.86  1.0
  O  O8  1  0.36  0.83  0.86  1.0
  O  O9  1  0.72  0.96  0.45  1.0

data_CoSeO4
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.87
_cell_length_b   4.87
_cell_length_c   6.48
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   111.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoSeO4
_chemical_formula_sum   'Co2 Se2 O8'
_cell_volume   142.43
_cell_formula_units_Z   2
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  0.0  0.0  0.0  1.0
  Co  Co1  1  0.0  0.0  0.24  1.0
  Se  Se2  1  0.72  0.18  0.62  1.0
  Se  Se3  1  0.72  0.82  0.86  1.0
  O  O4  1  0.09  0.17  0.62  1.0
  O  O5  1  0.09  0.83  0.86  1.0
  O  O6  1  0.36  0.17  0.62  1.0
  O  O7  1  0.36  0.83  0.86  1.0
  O  O8  1  0.72  0.04  0.04  1.0
  O  O9  1  0.72  0.04  0.2  1.0
  O  O10  1  0.72  0.96  0.28  1.0
  O  O11  1  0.72  0.96  0.45  1.0

Co Co Se Se O O O O O O O O
Co Co Se Se O O O O O O O O 0 8 - - o 0 7 - o o 0 1 o o o 1 3 - - - 1 4 - o o 1 9 o - - 2 6 o o o 2 11 o - o 2 5 + o o 3 4 o + + 3 10 o o o 3 9 + o o 4 7 o o o 5 6 o o o 7 8 o - o 8 11 o o o 9 10 o o o 