# generated using pymatgen
data_MnOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.80265002
_cell_length_b   14.19443806
_cell_length_c   3.08233000
_cell_angle_alpha   90.00000404
_cell_angle_beta   89.99996948
_cell_angle_gamma   90.01026909
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnOF
_chemical_formula_sum   'Mn6 O6 F6'
_cell_volume   210.12526295
_cell_formula_units_Z   6
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  0.96668200  0.99914900  0.99999900  1.0
  Mn  Mn1  1  0.10467000  0.33146600  0.00000500  1.0
  Mn  Mn2  1  0.95764300  0.66695100  0.00000100  1.0
  Mn  Mn3  1  0.54247300  0.16719400  0.50000400  1.0
  Mn  Mn4  1  0.53346200  0.49885800  0.49999700  1.0
  Mn  Mn5  1  0.39535600  0.83153600  0.50000000  1.0
  O  O6  1  0.27011300  0.26780000  0.50000500  1.0
  O  O7  1  0.14122500  0.93537100  0.49999700  1.0
  O  O8  1  0.22987000  0.76778000  0.00000200  1.0
  O  O9  1  0.35844800  0.43522400  0.99999600  1.0
  O  O10  1  0.69536500  0.56592200  0.99999400  1.0
  O  O11  1  0.80442100  0.06614700  0.49999600  1.0
  F  F12  1  0.17006600  0.60576900  0.50000300  1.0
  F  F13  1  0.32986900  0.10600400  0.00000200  1.0
  F  F14  1  0.76221300  0.23440800  0.99999900  1.0
  F  F15  1  0.61867500  0.89312200  0.99999900  1.0
  F  F16  1  0.88144800  0.39308100  0.50000000  1.0
  F  F17  1  0.73800100  0.73421900  0.49999900  1.0