# generated using pymatgen
data_Mn3O5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.00706500
_cell_length_b   4.54725200
_cell_length_c   13.64676039
_cell_angle_alpha   87.84658324
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3O5F
_chemical_formula_sum   'Mn6 O10 F2'
_cell_volume   186.47241530
_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  0.00000000  0.00000000  0.00000000  1.0
  Mn  Mn1  1  0.00000000  0.02052400  0.33968100  1.0
  Mn  Mn2  1  0.00000000  0.97947600  0.66031900  1.0
  Mn  Mn3  1  0.50000000  0.48046500  0.15986700  1.0
  Mn  Mn4  1  0.50000000  0.50000000  0.50000000  1.0
  Mn  Mn5  1  0.50000000  0.51953500  0.84013300  1.0
  O  O6  1  0.50000000  0.80006300  0.60032600  1.0
  O  O7  1  0.50000000  0.80961900  0.93614700  1.0
  O  O8  1  0.00000000  0.69468500  0.10280400  1.0
  O  O9  1  0.00000000  0.69571800  0.76878300  1.0
  O  O10  1  0.00000000  0.69407000  0.43400100  1.0
  O  O11  1  0.00000000  0.30428200  0.23121700  1.0
  O  O12  1  0.00000000  0.30593000  0.56599900  1.0
  O  O13  1  0.00000000  0.30531500  0.89719600  1.0
  O  O14  1  0.50000000  0.19038100  0.06385300  1.0
  O  O15  1  0.50000000  0.19993700  0.39967400  1.0
  F  F16  1  0.50000000  0.80158200  0.26727700  1.0
  F  F17  1  0.50000000  0.19841800  0.73272300  1.0