# generated using pymatgen
data_Mn12O5F19
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.90827800
_cell_length_b   5.88737689
_cell_length_c   15.82534963
_cell_angle_alpha   91.79028746
_cell_angle_beta   90.21903393
_cell_angle_gamma   92.31040228
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn12O5F19
_chemical_formula_sum   'Mn12 O5 F19'
_cell_volume   456.70256790
_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  0.99487600  0.14279700  0.57687700  1.0
  Mn  Mn1  1  0.00667000  0.85339600  0.75550200  1.0
  Mn  Mn2  1  0.03095700  0.16915000  0.91844300  1.0
  Mn  Mn3  1  0.95417600  0.19980700  0.24379500  1.0
  Mn  Mn4  1  0.98165600  0.82547600  0.41272600  1.0
  Mn  Mn5  1  0.00826600  0.83607200  0.08589500  1.0
  Mn  Mn6  1  0.51000700  0.34682100  0.41493800  1.0
  Mn  Mn7  1  0.49762000  0.34799400  0.08215700  1.0
  Mn  Mn8  1  0.48185200  0.32051900  0.75033500  1.0
  Mn  Mn9  1  0.48989200  0.64480600  0.91699200  1.0
  Mn  Mn10  1  0.52269400  0.68041400  0.58186900  1.0
  Mn  Mn11  1  0.51451200  0.64608900  0.25400600  1.0
  O  O12  1  0.79341800  0.88663700  0.52041900  1.0
  O  O13  1  0.71748900  0.60695900  0.35794200  1.0
  O  O14  1  0.69738100  0.40818700  0.18829900  1.0
  O  O15  1  0.29284500  0.37425500  0.97704400  1.0
  O  O16  1  0.21541200  0.11682700  0.81358500  1.0
  F  F17  1  0.76385200  0.10259000  0.68951300  1.0
  F  F18  1  0.76370700  0.10974000  0.35739100  1.0
  F  F19  1  0.79621600  0.12584600  0.02493900  1.0
  F  F20  1  0.77014500  0.89624300  0.86986100  1.0
  F  F21  1  0.76011900  0.90137400  0.19161300  1.0
  F  F22  1  0.74035100  0.39194100  0.85888300  1.0
  F  F23  1  0.72954000  0.61322300  0.69877700  1.0
  F  F24  1  0.73404900  0.38401800  0.52976700  1.0
  F  F25  1  0.72816900  0.60598400  0.02984200  1.0
  F  F26  1  0.26758000  0.61136600  0.80229600  1.0
  F  F27  1  0.26323900  0.38126100  0.63308000  1.0
  F  F28  1  0.26915700  0.60673000  0.47435100  1.0
  F  F29  1  0.27466000  0.62561100  0.14873500  1.0
  F  F30  1  0.25367400  0.37608700  0.30945100  1.0
  F  F31  1  0.23581200  0.10485600  0.46538000  1.0
  F  F32  1  0.23710800  0.89798400  0.64157800  1.0
  F  F33  1  0.23724700  0.87670900  0.97657100  1.0
  F  F34  1  0.23649300  0.12781200  0.13938500  1.0
  F  F35  1  0.22915600  0.85441700  0.30775800  1.0