# generated using pymatgen
data_Mn12O7F17
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.79136100
_cell_length_b   5.81226785
_cell_length_c   15.86842575
_cell_angle_alpha   89.46092476
_cell_angle_beta   89.90579014
_cell_angle_gamma   85.84861943
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn12O7F17
_chemical_formula_sum   'Mn12 O7 F17'
_cell_volume   440.73542712
_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  0.00543600  0.85131500  0.41697800  1.0
  Mn  Mn1  1  0.97425000  0.16300400  0.23722000  1.0
  Mn  Mn2  1  0.98596700  0.84737000  0.07623400  1.0
  Mn  Mn3  1  0.98056800  0.85013800  0.75326900  1.0
  Mn  Mn4  1  0.96149400  0.16546900  0.57988600  1.0
  Mn  Mn5  1  0.99229200  0.14925500  0.91279800  1.0
  Mn  Mn6  1  0.50516300  0.64373500  0.58719700  1.0
  Mn  Mn7  1  0.51502000  0.68918300  0.93036400  1.0
  Mn  Mn8  1  0.47944000  0.66609900  0.25847500  1.0
  Mn  Mn9  1  0.50063800  0.35076700  0.08275700  1.0
  Mn  Mn10  1  0.49473500  0.34501400  0.41816800  1.0
  Mn  Mn11  1  0.51704200  0.33123800  0.75120500  1.0
  O  O12  1  0.80540500  0.89608800  0.96888700  1.0
  O  O13  1  0.76249400  0.11102600  0.12707100  1.0
  O  O14  1  0.77291200  0.11725100  0.46957900  1.0
  O  O15  1  0.78113200  0.11425900  0.80576700  1.0
  O  O16  1  0.70836200  0.37497700  0.64349100  1.0
  O  O17  1  0.28440000  0.62011200  0.03323200  1.0
  O  O18  1  0.27580400  0.61546600  0.36935700  1.0
  F  F19  1  0.77892400  0.88465800  0.30606400  1.0
  F  F20  1  0.76074800  0.87504100  0.64270800  1.0
  F  F21  1  0.73651400  0.60330000  0.14977600  1.0
  F  F22  1  0.72702100  0.38215700  0.31261700  1.0
  F  F23  1  0.74612700  0.61509700  0.47623600  1.0
  F  F24  1  0.72797100  0.61449200  0.81436700  1.0
  F  F25  1  0.74388300  0.39373400  0.97909100  1.0
  F  F26  1  0.28529700  0.37789400  0.19328100  1.0
  F  F27  1  0.26981300  0.38622800  0.52546100  1.0
  F  F28  1  0.27499000  0.36601300  0.85742300  1.0
  F  F29  1  0.25682300  0.60881600  0.70092900  1.0
  F  F30  1  0.21261600  0.87616500  0.18391600  1.0
  F  F31  1  0.22590800  0.88818200  0.53133200  1.0
  F  F32  1  0.23725700  0.10764800  0.35322200  1.0
  F  F33  1  0.25002700  0.12756200  0.01550800  1.0
  F  F34  1  0.24987400  0.87901700  0.85122600  1.0
  F  F35  1  0.21365200  0.11222700  0.68490300  1.0