# generated using pymatgen
data_LiFeF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.98886600
_cell_length_b   8.44636199
_cell_length_c   9.76480611
_cell_angle_alpha   96.77227067
_cell_angle_beta   107.23370096
_cell_angle_gamma   101.37478843
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeF4
_chemical_formula_sum   'Li6 Fe6 F24'
_cell_volume   530.06918766
_cell_formula_units_Z   6
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  0.03878900  0.19202400  0.99176200  1
  Li  Li1  1  0.53240800  0.61449800  0.78135400  1
  Li  Li2  1  0.24925100  0.80290600  0.58864300  1
  Li  Li3  1  0.75074900  0.19709400  0.41135700  1
  Li  Li4  1  0.46759200  0.38550200  0.21864600  1
  Li  Li5  1  0.96121100  0.80797600  0.00823800  1
  Fe  Fe6  1  0.47613400  0.20328100  0.87510800  1
  Fe  Fe7  1  0.99411200  0.50389800  0.74153000  1
  Fe  Fe8  1  0.80317900  0.90097200  0.65714900  1
  Fe  Fe9  1  0.19682100  0.09902800  0.34285100  1
  Fe  Fe10  1  0.00588800  0.49610200  0.25847000  1
  Fe  Fe11  1  0.52386600  0.79671900  0.12489200  1
  F  F12  1  0.05241600  0.35080000  0.85649700  1
  F  F13  1  0.74441500  0.19442900  0.96281900  1
  F  F14  1  0.63603000  0.76642500  0.97525100  1
  F  F15  1  0.33606600  0.01330400  0.74154600  1
  F  F16  1  0.48050700  0.38312300  0.78381800  1
  F  F17  1  0.24280500  0.63310400  0.74336500  1
  F  F18  1  0.84996200  0.63554600  0.81942600  1
  F  F19  1  0.95809400  0.97993600  0.85313000  1
  F  F20  1  0.55105400  0.76846500  0.64811400  1
  F  F21  1  0.73950800  0.07298100  0.57051300  1
  F  F22  1  0.05608300  0.21128400  0.43581600  1
  F  F23  1  0.82329400  0.40381100  0.55886800  1
  F  F24  1  0.17670600  0.59618900  0.44113200  1
  F  F25  1  0.94391700  0.78871600  0.56418400  1
  F  F26  1  0.26049200  0.92701900  0.42948700  1
  F  F27  1  0.44894600  0.23153500  0.35188600  1
  F  F28  1  0.04190600  0.02006400  0.14687000  1
  F  F29  1  0.15003800  0.36445400  0.18057400  1
  F  F30  1  0.75719500  0.36689600  0.25663500  1
  F  F31  1  0.51949300  0.61687700  0.21618200  1
  F  F32  1  0.66393400  0.98669600  0.25845400  1
  F  F33  1  0.36397000  0.23357500  0.02474900  1
  F  F34  1  0.25558500  0.80557100  0.03718100  1
  F  F35  1  0.94758400  0.64920000  0.14350300  1
