# generated using pymatgen
data_Mn3O5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.55515600
_cell_length_b   4.55673000
_cell_length_c   9.02897300
_cell_angle_alpha   90.00000000
_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   187.41092543
_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  0.01008100  0.74588100  0.67410900  1.0
  Mn  Mn1  1  0.98022500  0.73038900  0.00000000  1.0
  Mn  Mn2  1  0.01008100  0.74588100  0.32589100  1.0
  Mn  Mn3  1  0.48022500  0.26961100  0.50000000  1.0
  Mn  Mn4  1  0.51008100  0.25411900  0.82589100  1.0
  Mn  Mn5  1  0.51008100  0.25411900  0.17410900  1.0
  O  O6  1  0.19641700  0.55373000  0.83610100  1.0
  O  O7  1  0.19641700  0.55373000  0.16389900  1.0
  O  O8  1  0.18947600  0.56181200  0.50000000  1.0
  O  O9  1  0.69641700  0.44627000  0.66389900  1.0
  O  O10  1  0.68947600  0.43818800  0.00000000  1.0
  O  O11  1  0.69641700  0.44627000  0.33610100  1.0
  O  O12  1  0.30795400  0.05911100  0.66526200  1.0
  O  O13  1  0.30795400  0.05911100  0.33473800  1.0
  O  O14  1  0.80795400  0.94088900  0.83473800  1.0
  O  O15  1  0.80795400  0.94088900  0.16526200  1.0
  F  F16  1  0.30140200  0.04961400  0.00000000  1.0
  F  F17  1  0.80140200  0.95038600  0.50000000  1.0