# generated using pymatgen
data_Li3Mn3(OF)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.80379245
_cell_length_b   6.04470894
_cell_length_c   6.07094529
_cell_angle_alpha   61.13841958
_cell_angle_beta   90.00006757
_cell_angle_gamma   118.69020598
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Mn3(OF)4
_chemical_formula_sum   'Li3 Mn3 O4 F4'
_cell_volume   156.00650693
_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
  Li  Li0  1  0.97274400  0.94548900  0.04132000  1
  Li  Li1  1  0.62499900  0.24999900  0.62500000  1
  Li  Li2  1  0.27725400  0.55451000  0.20868000  1
  Mn  Mn3  1  0.62500000  0.25000100  0.12499900  1
  Mn  Mn4  1  0.62500300  0.75000000  0.62500700  1
  Mn  Mn5  1  0.12500700  0.75000900  0.62499400  1
  O  O6  1  0.86434800  0.72869600  0.43040700  1
  O  O7  1  0.84036800  0.68073700  0.88029200  1
  O  O8  1  0.40963100  0.81926200  0.36970700  1
  O  O9  1  0.38565100  0.77130300  0.81959300  1
  F  F10  1  0.87719600  0.27230100  0.36304100  1
  F  F11  1  0.39510500  0.27230000  0.36304100  1
  F  F12  1  0.85489400  0.22769800  0.88695900  1
  F  F13  1  0.37280300  0.22769800  0.88695900  1
