# generated using pymatgen
data_Mn12O5F19
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.88158100
_cell_length_b   5.84931752
_cell_length_c   15.93277723
_cell_angle_alpha   90.61927572
_cell_angle_beta   90.01206130
_cell_angle_gamma   93.32192642
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn12O5F19
_chemical_formula_sum   'Mn12 O5 F19'
_cell_volume   454.15208057
_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  0.98901800  0.14756800  0.57778200  1.0
  Mn  Mn1  1  0.00577600  0.85135800  0.75411800  1.0
  Mn  Mn2  1  0.02396000  0.16478700  0.91529900  1.0
  Mn  Mn3  1  0.98081100  0.15159500  0.24863100  1.0
  Mn  Mn4  1  0.97529600  0.83344100  0.41741100  1.0
  Mn  Mn5  1  0.99526700  0.82793900  0.09228600  1.0
  Mn  Mn6  1  0.50549600  0.35741200  0.41391400  1.0
  Mn  Mn7  1  0.49322600  0.32986700  0.07544400  1.0
  Mn  Mn8  1  0.48509400  0.32125500  0.75097600  1.0
  Mn  Mn9  1  0.47889500  0.64501100  0.91774300  1.0
  Mn  Mn10  1  0.51296500  0.67539500  0.58160800  1.0
  Mn  Mn11  1  0.52968500  0.66842100  0.25361800  1.0
  O  O12  1  0.78461500  0.88241600  0.52043100  1.0
  O  O13  1  0.77836200  0.88162300  0.19861800  1.0
  O  O14  1  0.71470000  0.62853000  0.35872300  1.0
  O  O15  1  0.27804700  0.38113300  0.96813500  1.0
  O  O16  1  0.20995600  0.11278700  0.81280500  1.0
  F  F17  1  0.76194300  0.10173400  0.69148000  1.0
  F  F18  1  0.76818900  0.13133100  0.35865300  1.0
  F  F19  1  0.79994000  0.12230400  0.02226000  1.0
  F  F20  1  0.75831600  0.88983600  0.86951100  1.0
  F  F21  1  0.73425800  0.39826400  0.85921700  1.0
  F  F22  1  0.73271100  0.61194200  0.69729100  1.0
  F  F23  1  0.72627500  0.38604100  0.52901700  1.0
  F  F24  1  0.73437500  0.38132500  0.18558700  1.0
  F  F25  1  0.72619500  0.61717200  0.02480700  1.0
  F  F26  1  0.27231400  0.61648000  0.80364300  1.0
  F  F27  1  0.26509100  0.38858700  0.63496800  1.0
  F  F28  1  0.25900600  0.60303600  0.47359700  1.0
  F  F29  1  0.29791700  0.62384900  0.14725900  1.0
  F  F30  1  0.27137800  0.39094900  0.29753300  1.0
  F  F31  1  0.23231500  0.10540200  0.46547900  1.0
  F  F32  1  0.23744400  0.89781100  0.64096900  1.0
  F  F33  1  0.23550400  0.87484300  0.98239300  1.0
  F  F34  1  0.23090600  0.11752900  0.14394100  1.0
  F  F35  1  0.21475300  0.88102800  0.31485300  1.0