# generated using pymatgen
data_Mn12O5F19
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.84215900
_cell_length_b   5.83931282
_cell_length_c   15.95600397
_cell_angle_alpha   89.52043335
_cell_angle_beta   89.98496148
_cell_angle_gamma   88.79852140
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn12O5F19
_chemical_formula_sum   'Mn12 O5 F19'
_cell_volume   451.03912428
_cell_formula_units_Z   1
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  0.96063000  0.81648000  0.42060900  1.0
  Mn  Mn1  1  0.02376400  0.18204600  0.24709800  1.0
  Mn  Mn2  1  0.01705200  0.83158100  0.07887300  1.0
  Mn  Mn3  1  0.01081300  0.83588800  0.74738900  1.0
  Mn  Mn4  1  0.00458600  0.15796900  0.58407000  1.0
  Mn  Mn5  1  0.97205100  0.16000500  0.90575500  1.0
  Mn  Mn6  1  0.49456600  0.64943000  0.58707500  1.0
  Mn  Mn7  1  0.48570300  0.65581500  0.92312300  1.0
  Mn  Mn8  1  0.49688300  0.65329100  0.24555300  1.0
  Mn  Mn9  1  0.47138500  0.35178100  0.08564300  1.0
  Mn  Mn10  1  0.50165900  0.35539900  0.42048000  1.0
  Mn  Mn11  1  0.51269400  0.34738700  0.75085900  1.0
  O  O12  1  0.77284100  0.12056700  0.79770700  1.0
  O  O13  1  0.69278000  0.60869500  0.48133400  1.0
  O  O14  1  0.28404400  0.60392800  0.03085600  1.0
  O  O15  1  0.29643500  0.39928000  0.19198200  1.0
  O  O16  1  0.29976700  0.60802600  0.69491800  1.0
  F  F17  1  0.76176600  0.88907700  0.30029200  1.0
  F  F18  1  0.77571000  0.87679500  0.63734200  1.0
  F  F19  1  0.76851200  0.88331200  0.96963000  1.0
  F  F20  1  0.76016100  0.12212900  0.13282100  1.0
  F  F21  1  0.76154500  0.10781500  0.47360200  1.0
  F  F22  1  0.75601900  0.62181900  0.14329100  1.0
  F  F23  1  0.74500600  0.39617100  0.31097900  1.0
  F  F24  1  0.73629600  0.38644100  0.64205100  1.0
  F  F25  1  0.73882300  0.60881300  0.81481700  1.0
  F  F26  1  0.71560800  0.37067000  0.97986100  1.0
  F  F27  1  0.25694700  0.61421700  0.35608700  1.0
  F  F28  1  0.25643000  0.39404000  0.52872800  1.0
  F  F29  1  0.27599900  0.38330800  0.85966300  1.0
  F  F30  1  0.23605500  0.90491200  0.19192800  1.0
  F  F31  1  0.22803300  0.88106800  0.52928700  1.0
  F  F32  1  0.23102300  0.11851300  0.36662900  1.0
  F  F33  1  0.21729300  0.10928100  0.01730400  1.0
  F  F34  1  0.22565800  0.88252400  0.85927900  1.0
  F  F35  1  0.25546200  0.11153000  0.69308900  1.0