data_Mn(CoO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.45
_cell_length_b   6.45
_cell_length_c   5.77
_cell_angle_alpha   103.7
_cell_angle_beta   103.7
_cell_angle_gamma   25.81
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn(CoO3)2
_chemical_formula_sum   'Mn1 Co2 O6'
_cell_volume   101.35
_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
  Mn  Mn0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.24  0.0  0.72  1.0
  Co  Co2  1  0.93  0.0  0.88  1.0
  O  O3  1  0.35  0.0  0.95  1.0
  O  O4  1  0.13  0.0  0.27  1.0
  O  O5  1  0.46  0.0  0.1  1.0
  O  O6  1  0.04  0.0  0.33  1.0
  O  O7  1  0.82  0.0  0.65  1.0
  O  O8  1  0.7  0.0  0.5  1.0

data_Mn(CoO3)2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.88
_cell_length_b   5.77
_cell_length_c   6.45
_cell_angle_alpha   103.7
_cell_angle_beta   102.91
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn(CoO3)2
_chemical_formula_sum   'Mn1 Co2 O6'
_cell_volume   101.35
_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
  Mn  Mn0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.0  0.72  0.24  1.0
  Co  Co2  1  0.0  0.88  0.93  1.0
  O  O3  1  0.0  0.1  0.46  1.0
  O  O4  1  0.0  0.27  0.13  1.0
  O  O5  1  0.0  0.33  0.04  1.0
  O  O6  1  0.0  0.5  0.7  1.0
  O  O7  1  0.0  0.65  0.82  1.0
  O  O8  1  0.0  0.95  0.35  1.0

Mn Co Co O O O O O O
Mn Co Co O O O O O O 0 2 - o - 1 3 o o o 3 5 o o + 4 6 o o o 7 8 o o o 