# generated using pymatgen
data_Mn12O7F17
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.76830200
_cell_length_b   5.76432795
_cell_length_c   15.88855464
_cell_angle_alpha   89.80035208
_cell_angle_beta   89.47258543
_cell_angle_gamma   88.60397794
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn12O7F17
_chemical_formula_sum   'Mn12 O7 F17'
_cell_volume   436.56326805
_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  0.99200400  0.15585600  0.41511600  1.0
  Mn  Mn1  1  0.02846600  0.83876900  0.23804200  1.0
  Mn  Mn2  1  0.00966700  0.15996600  0.07556100  1.0
  Mn  Mn3  1  0.05222300  0.17136600  0.74924500  1.0
  Mn  Mn4  1  0.02243600  0.85351400  0.58064100  1.0
  Mn  Mn5  1  0.00093800  0.85758700  0.91845700  1.0
  Mn  Mn6  1  0.47342900  0.32111900  0.58505500  1.0
  Mn  Mn7  1  0.49058700  0.33068900  0.92359600  1.0
  Mn  Mn8  1  0.52990500  0.34083600  0.25936100  1.0
  Mn  Mn9  1  0.48676200  0.64949200  0.08240700  1.0
  Mn  Mn10  1  0.50319500  0.66554200  0.42041000  1.0
  Mn  Mn11  1  0.51012300  0.63083700  0.75506200  1.0
  O  O12  1  0.21124300  0.09699500  0.63990000  1.0
  O  O13  1  0.20636400  0.12173000  0.96892900  1.0
  O  O14  1  0.23027800  0.88858000  0.12725900  1.0
  O  O15  1  0.21611000  0.89927800  0.46859900  1.0
  O  O16  1  0.30569100  0.38797400  0.80984200  1.0
  O  O17  1  0.70082300  0.38260800  0.02948600  1.0
  O  O18  1  0.72737900  0.38706400  0.36885700  1.0
  F  F19  1  0.22497600  0.11840200  0.30591400  1.0
  F  F20  1  0.25002300  0.87642700  0.80711700  1.0
  F  F21  1  0.26713900  0.39608800  0.15093000  1.0
  F  F22  1  0.27778800  0.61859900  0.30968500  1.0
  F  F23  1  0.24515700  0.40060800  0.47359400  1.0
  F  F24  1  0.26466400  0.60259100  0.64521800  1.0
  F  F25  1  0.24948600  0.61457900  0.97644900  1.0
  F  F26  1  0.72375200  0.61880000  0.19267100  1.0
  F  F27  1  0.72600200  0.62576800  0.53319600  1.0
  F  F28  1  0.73871800  0.61422600  0.86723500  1.0
  F  F29  1  0.74078400  0.38001400  0.69288600  1.0
  F  F30  1  0.78827000  0.12569200  0.18634500  1.0
  F  F31  1  0.75363000  0.11434500  0.52065700  1.0
  F  F32  1  0.76392600  0.89195400  0.35072100  1.0
  F  F33  1  0.73756700  0.88230900  0.02380400  1.0
  F  F34  1  0.78390600  0.12028000  0.85102800  1.0
  F  F35  1  0.76658500  0.85951900  0.69672400  1.0