# generated using pymatgen
data_Li3MnF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.61451700
_cell_length_b   7.97965100
_cell_length_c   8.25880800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3MnF5
_chemical_formula_sum   'Li12 Mn4 F20'
_cell_volume   435.91258163
_cell_formula_units_Z   4
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
  Li  Li0  1  0.98531800  0.57840500  0.27011200  1
  Li  Li1  1  0.98531800  0.92159500  0.27011200  1
  Li  Li2  1  0.21044500  0.75000000  0.03130000  1
  Li  Li3  1  0.28955500  0.25000000  0.53130000  1
  Li  Li4  1  0.51468200  0.07840500  0.77011200  1
  Li  Li5  1  0.51468200  0.42159500  0.77011200  1
  Li  Li6  1  0.48531800  0.92159500  0.22988800  1
  Li  Li7  1  0.48531800  0.57840500  0.22988800  1
  Li  Li8  1  0.71044500  0.75000000  0.46870000  1
  Li  Li9  1  0.78955500  0.25000000  0.96870000  1
  Li  Li10  1  0.01468200  0.07840500  0.72988800  1
  Li  Li11  1  0.01468200  0.42159500  0.72988800  1
  Mn  Mn12  1  0.27077800  0.75000000  0.60289700  1
  Mn  Mn13  1  0.22922200  0.25000000  0.10289700  1
  Mn  Mn14  1  0.77077800  0.75000000  0.89710300  1
  Mn  Mn15  1  0.72922200  0.25000000  0.39710300  1
  F  F16  1  0.99162200  0.25000000  0.55164600  1
  F  F17  1  0.08849400  0.75000000  0.81780400  1
  F  F18  1  0.07013200  0.25000000  0.88111400  1
  F  F19  1  0.22503400  0.98518200  0.15211200  1
  F  F20  1  0.22503400  0.51481800  0.15211200  1
  F  F21  1  0.27496600  0.48518200  0.65211200  1
  F  F22  1  0.27496600  0.01481800  0.65211200  1
  F  F23  1  0.42986800  0.75000000  0.38111400  1
  F  F24  1  0.41150600  0.25000000  0.31780400  1
  F  F25  1  0.50837800  0.75000000  0.05164600  1
  F  F26  1  0.49162200  0.25000000  0.94835400  1
  F  F27  1  0.58849400  0.75000000  0.68219600  1
  F  F28  1  0.57013200  0.25000000  0.61888600  1
  F  F29  1  0.72503400  0.98518200  0.34788800  1
  F  F30  1  0.72503400  0.51481800  0.34788800  1
  F  F31  1  0.77496600  0.01481800  0.84788800  1
  F  F32  1  0.77496600  0.48518200  0.84788800  1
  F  F33  1  0.92986800  0.75000000  0.11888600  1
  F  F34  1  0.91150600  0.25000000  0.18219600  1
  F  F35  1  0.00837800  0.75000000  0.44835400  1
