# generated using pymatgen
data_LiFeF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.32823200
_cell_length_b   5.32939000
_cell_length_c   7.36962868
_cell_angle_alpha   88.02887917
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeF4
_chemical_formula_sum   'Li8 Fe8 F32'
_cell_volume   719.42683032
_cell_formula_units_Z   8
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  0.94611800  0.11308800  0.65053900  1
  Li  Li1  1  0.55388200  0.11308800  0.15053900  1
  Li  Li2  1  0.32085900  0.36626100  0.74714100  1
  Li  Li3  1  0.17914100  0.36626100  0.24714100  1
  Li  Li4  1  0.82085900  0.63373900  0.75285900  1
  Li  Li5  1  0.67914100  0.63373900  0.25285900  1
  Li  Li6  1  0.44611800  0.88691200  0.84946100  1
  Li  Li7  1  0.05388200  0.88691200  0.34946100  1
  Fe  Fe8  1  0.12965000  0.84358800  0.99428400  1
  Fe  Fe9  1  0.62842800  0.65019600  0.88485400  1
  Fe  Fe10  1  0.37035000  0.84358800  0.49428400  1
  Fe  Fe11  1  0.87157200  0.65019600  0.38485400  1
  Fe  Fe12  1  0.12842800  0.34980400  0.61514600  1
  Fe  Fe13  1  0.62965000  0.15641200  0.50571600  1
  Fe  Fe14  1  0.37157200  0.34980400  0.11514600  1
  Fe  Fe15  1  0.87035000  0.15641200  0.00571600  1
  F  F16  1  0.65286200  0.89129500  0.68194700  1
  F  F17  1  0.84713800  0.89129500  0.18194700  1
  F  F18  1  0.87399700  0.91933900  0.81308300  1
  F  F19  1  0.62600300  0.91933900  0.31308300  1
  F  F20  1  0.20327000  0.64898400  0.10254400  1
  F  F21  1  0.29673000  0.64898400  0.60254400  1
  F  F22  1  0.03827400  0.74400600  0.07322600  1
  F  F23  1  0.54797600  0.85473500  0.93835000  1
  F  F24  1  0.46172600  0.74400600  0.57322600  1
  F  F25  1  0.95202400  0.85473500  0.43835000  1
  F  F26  1  0.71026100  0.75314000  0.01221100  1
  F  F27  1  0.78973900  0.75314000  0.51221100  1
  F  F28  1  0.10677900  0.57882400  0.41699400  1
  F  F29  1  0.39322100  0.57882400  0.91699400  1
  F  F30  1  0.12803700  0.61271100  0.78469600  1
  F  F31  1  0.62803700  0.38728900  0.71530400  1
  F  F32  1  0.37196300  0.61271100  0.28469600  1
  F  F33  1  0.87196300  0.38728900  0.21530400  1
  F  F34  1  0.60677900  0.42117600  0.08300600  1
  F  F35  1  0.89322100  0.42117600  0.58300600  1
  F  F36  1  0.21026100  0.24686000  0.48778900  1
  F  F37  1  0.28973900  0.24686000  0.98778900  1
  F  F38  1  0.04797600  0.14526500  0.56165000  1
  F  F39  1  0.53827400  0.25599400  0.42677400  1
  F  F40  1  0.45202400  0.14526500  0.06165000  1
  F  F41  1  0.96172600  0.25599400  0.92677400  1
  F  F42  1  0.70327000  0.35101600  0.39745600  1
  F  F43  1  0.79673000  0.35101600  0.89745600  1
  F  F44  1  0.37399700  0.08066100  0.68691700  1
  F  F45  1  0.12600300  0.08066100  0.18691700  1
  F  F46  1  0.15286200  0.10870500  0.81805300  1
  F  F47  1  0.34713800  0.10870500  0.31805300  1
