# generated using pymatgen
data_MnOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.67066200
_cell_length_b   5.69541383
_cell_length_c   7.77939247
_cell_angle_alpha   85.41131093
_cell_angle_beta   88.01678690
_cell_angle_gamma   87.13600728
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnOF
_chemical_formula_sum   'Mn6 O6 F6'
_cell_volume   205.92399696
_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  0.50000000  0.50000000  0.00000000  1.0
  Mn  Mn1  1  0.51539600  0.83031500  0.65032100  1.0
  Mn  Mn2  1  0.48460400  0.16968500  0.34967900  1.0
  Mn  Mn3  1  0.01821200  0.33820400  0.68388900  1.0
  Mn  Mn4  1  0.98178800  0.66179600  0.31611100  1.0
  Mn  Mn5  1  0.00000000  0.00000000  0.00000000  1.0
  O  O6  1  0.81448200  0.71390200  0.09225000  1.0
  O  O7  1  0.68981200  0.53389700  0.76611900  1.0
  O  O8  1  0.69880600  0.87658900  0.42811800  1.0
  O  O9  1  0.30119400  0.12341100  0.57188200  1.0
  O  O10  1  0.31018800  0.46610300  0.23388100  1.0
  O  O11  1  0.18551800  0.28609800  0.90775000  1.0
  F  F12  1  0.81509300  0.36239800  0.45604100  1.0
  F  F13  1  0.79217000  0.03300500  0.78364700  1.0
  F  F14  1  0.70136100  0.19889500  0.12718200  1.0
  F  F15  1  0.29863900  0.80110500  0.87281800  1.0
  F  F16  1  0.18490700  0.63760200  0.54395900  1.0
  F  F17  1  0.20783000  0.96699500  0.21635300  1.0