# generated using pymatgen
data_Li3Mn(OF)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05947213
_cell_length_b   7.86318138
_cell_length_c   7.86318276
_cell_angle_alpha   99.63012979
_cell_angle_beta   100.75279303
_cell_angle_gamma   100.75283520
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Mn(OF)2
_chemical_formula_sum   'Li12 Mn4 O8 F8'
_cell_volume   295.24316563
_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  0.24999400  0.30599000  0.19401700  1
  Li  Li1  1  0.25000500  0.80598300  0.69401000  1
  Li  Li2  1  0.74999500  0.69401800  0.80598900  1
  Li  Li3  1  0.75000500  0.19401100  0.30598200  1
  Li  Li4  1  0.25000300  0.56990800  0.93010600  1
  Li  Li5  1  0.24999500  0.06989300  0.43009300  1
  Li  Li6  1  0.75000400  0.43010700  0.06990700  1
  Li  Li7  1  0.74999600  0.93009300  0.56989200  1
  Li  Li8  1  0.25000000  0.18450600  0.81549200  1
  Li  Li9  1  0.24999800  0.68450200  0.31549600  1
  Li  Li10  1  0.75000000  0.31549100  0.68450600  1
  Li  Li11  1  0.74999900  0.81549600  0.18450200  1
  Mn  Mn12  1  0.25000200  0.94560100  0.05440300  1
  Mn  Mn13  1  0.75000300  0.55439400  0.44560100  1
  Mn  Mn14  1  0.25001300  0.44556100  0.55445100  1
  Mn  Mn15  1  0.75000100  0.05444500  0.94555800  1
  O  O16  1  0.01474400  0.55714200  0.67626900  1
  O  O17  1  0.01472000  0.05715400  0.17624100  1
  O  O18  1  0.48527500  0.82376400  0.94284900  1
  O  O19  1  0.48525600  0.32372900  0.44285800  1
  O  O20  1  0.51474300  0.17627000  0.05714200  1
  O  O21  1  0.51472100  0.67623900  0.55715300  1
  O  O22  1  0.98527800  0.44284700  0.32376300  1
  O  O23  1  0.98525700  0.94285900  0.82373200  1
  F  F24  1  0.00493700  0.68550100  0.06649700  1
  F  F25  1  0.00494300  0.18550300  0.56650100  1
  F  F26  1  0.50493600  0.56649800  0.18550000  1
  F  F27  1  0.50494100  0.06650000  0.68550100  1
  F  F28  1  0.49505700  0.43349900  0.81449500  1
  F  F29  1  0.49506200  0.93350100  0.31449700  1
  F  F30  1  0.99505400  0.31449500  0.93349600  1
  F  F31  1  0.99506200  0.81450000  0.43350000  1
