# generated using pymatgen
data_Ca8TiMn7O22
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.69951200
_cell_length_b   7.69951200
_cell_length_c   7.65153100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca8TiMn7O22
_chemical_formula_sum   'Ca8 Ti1 Mn7 O22'
_cell_volume   453.60177203
_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
  Ca  Ca0  1  0.25179300  0.25179300  0.25219400  1.0
  Ca  Ca1  1  0.25491400  0.25491400  0.74031800  1.0
  Ca  Ca2  1  0.25179300  0.74820700  0.25219400  1.0
  Ca  Ca3  1  0.25491400  0.74508600  0.74031800  1.0
  Ca  Ca4  1  0.74820700  0.25179300  0.25219400  1.0
  Ca  Ca5  1  0.74508600  0.25491400  0.74031800  1.0
  Ca  Ca6  1  0.74820700  0.74820700  0.25219400  1.0
  Ca  Ca7  1  0.74508600  0.74508600  0.74031800  1.0
  Ti  Ti8  1  0.00000000  0.00000000  0.98523800  1.0
  Mn  Mn9  1  0.00000000  0.00000000  0.49526000  1.0
  Mn  Mn10  1  0.00000000  0.50000000  0.00937000  1.0
  Mn  Mn11  1  0.00000000  0.50000000  0.49337900  1.0
  Mn  Mn12  1  0.50000000  0.00000000  0.00937000  1.0
  Mn  Mn13  1  0.50000000  0.00000000  0.49337900  1.0
  Mn  Mn14  1  0.50000000  0.50000000  0.99532500  1.0
  Mn  Mn15  1  0.50000000  0.50000000  0.50273200  1.0
  O  O16  1  0.00000000  0.00000000  0.75406200  1.0
  O  O17  1  0.00000000  0.50000000  0.25098900  1.0
  O  O18  1  0.00000000  0.50000000  0.75189800  1.0
  O  O19  1  0.50000000  0.00000000  0.25098900  1.0
  O  O20  1  0.50000000  0.00000000  0.75189800  1.0
  O  O21  1  0.50000000  0.50000000  0.74984700  1.0
  O  O22  1  0.24652900  0.00000000  0.02452400  1.0
  O  O23  1  0.24751400  0.00000000  0.48172900  1.0
  O  O24  1  0.25424000  0.50000000  0.02318400  1.0
  O  O25  1  0.25446000  0.50000000  0.47961800  1.0
  O  O26  1  0.75347100  0.00000000  0.02452400  1.0
  O  O27  1  0.75248600  0.00000000  0.48172900  1.0
  O  O28  1  0.74576000  0.50000000  0.02318400  1.0
  O  O29  1  0.74554000  0.50000000  0.47961800  1.0
  O  O30  1  0.00000000  0.24652900  0.02452400  1.0
  O  O31  1  0.00000000  0.24751400  0.48172900  1.0
  O  O32  1  0.00000000  0.75347100  0.02452400  1.0
  O  O33  1  0.00000000  0.75248600  0.48172900  1.0
  O  O34  1  0.50000000  0.25424000  0.02318400  1.0
  O  O35  1  0.50000000  0.25446000  0.47961800  1.0
  O  O36  1  0.50000000  0.74576000  0.02318400  1.0
  O  O37  1  0.50000000  0.74554000  0.47961800  1.0