# generated using pymatgen
data_Mn3O5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.54121602
_cell_length_b   4.54121602
_cell_length_c   9.00405169
_cell_angle_alpha   89.64699227
_cell_angle_beta   89.64699227
_cell_angle_gamma   88.25421871
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3O5F
_chemical_formula_sum   'Mn6 O10 F2'
_cell_volume   185.59431669
_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
  Mn  Mn0  1  0.99383700  0.99383700  0.84019300  1.0
  Mn  Mn1  1  0.00616300  0.00616300  0.15980700  1.0
  Mn  Mn2  1  0.00000000  0.00000000  0.50000000  1.0
  Mn  Mn3  1  0.52310400  0.52310400  0.66747300  1.0
  Mn  Mn4  1  0.50000000  0.50000000  0.00000000  1.0
  Mn  Mn5  1  0.47689600  0.47689600  0.33252700  1.0
  O  O6  1  0.80643500  0.80643500  0.00127600  1.0
  O  O7  1  0.81145800  0.81145800  0.67032800  1.0
  O  O8  1  0.69882600  0.30914900  0.83388500  1.0
  O  O9  1  0.69085100  0.30117400  0.16611500  1.0
  O  O10  1  0.69247100  0.30752900  0.50000000  1.0
  O  O11  1  0.30914900  0.69882600  0.83388500  1.0
  O  O12  1  0.30117400  0.69085100  0.16611500  1.0
  O  O13  1  0.30752900  0.69247100  0.50000000  1.0
  O  O14  1  0.19356500  0.19356500  0.99872400  1.0
  O  O15  1  0.18854200  0.18854200  0.32967200  1.0
  F  F16  1  0.78999700  0.78999700  0.32273800  1.0
  F  F17  1  0.21000300  0.21000300  0.67726200  1.0