# generated using pymatgen
data_MnOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.82005446
_cell_length_b   14.32606312
_cell_length_c   3.06228500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.51111974
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnOF
_chemical_formula_sum   'Mn6 O6 F6'
_cell_volume   210.09420923
_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  0.05487800  0.99834300  0.00000000  1.0
  Mn  Mn1  1  0.00815700  0.33350900  0.00000000  1.0
  Mn  Mn2  1  0.96908200  0.66663600  0.00000000  1.0
  Mn  Mn3  1  0.52847700  0.16838100  0.50000000  1.0
  Mn  Mn4  1  0.49060400  0.49897300  0.50000000  1.0
  Mn  Mn5  1  0.45146700  0.83176200  0.50000000  1.0
  O  O6  1  0.20165000  0.93594100  0.50000000  1.0
  O  O7  1  0.33893100  0.10236600  0.00000000  1.0
  O  O8  1  0.26602400  0.76807900  0.00000000  1.0
  O  O9  1  0.30119600  0.43416600  0.00000000  1.0
  O  O10  1  0.71658700  0.23309100  0.00000000  1.0
  O  O11  1  0.67608100  0.56638000  0.00000000  1.0
  F  F12  1  0.19926800  0.27011300  0.50000000  1.0
  F  F13  1  0.16414600  0.60630500  0.50000000  1.0
  F  F14  1  0.69346200  0.89829000  0.00000000  1.0
  F  F15  1  0.85019800  0.05647300  0.50000000  1.0
  F  F16  1  0.81616200  0.39648400  0.50000000  1.0
  F  F17  1  0.77363100  0.73470700  0.50000000  1.0