# generated using pymatgen
data_LiFe6O7F5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85159500
_cell_length_b   6.03869647
_cell_length_c   6.09873625
_cell_angle_alpha   100.22656174
_cell_angle_beta   99.97609043
_cell_angle_gamma   98.77386637
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe6O7F5
_chemical_formula_sum   'Li1 Fe6 O7 F5'
_cell_volume   205.10574596
_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  0.99274200  0.98270700  0.99554300  1
  Fe  Fe1  1  0.29820100  0.61191600  0.13505900  1
  Fe  Fe2  1  0.85046700  0.65125400  0.37215900  1
  Fe  Fe3  1  0.60230700  0.15457800  0.34957900  1
  Fe  Fe4  1  0.40056000  0.85613100  0.65458400  1
  Fe  Fe5  1  0.14722200  0.34549200  0.60992700  1
  Fe  Fe6  1  0.67478200  0.41270400  0.87287800  1
  O  O7  1  0.92838500  0.65780500  0.06905000  1
  O  O8  1  0.57157000  0.40311900  0.17643700  1
  O  O9  1  0.59264700  0.82992700  0.41057100  1
  O  O10  1  0.18843000  0.57539900  0.41610400  1
  O  O11  1  0.82066100  0.41866700  0.59426500  1
  O  O12  1  0.40426700  0.17746600  0.59008500  1
  O  O13  1  0.41328700  0.60718700  0.83334200  1
  F  F14  1  0.31911400  0.95949400  0.11497600  1
  F  F15  1  0.94171200  0.11754300  0.31603800  1
  F  F16  1  0.05503700  0.88486700  0.67190600  1
  F  F17  1  0.68293200  0.05626800  0.88804700  1
  F  F18  1  0.11568000  0.29748000  0.92945300  1
