# generated using pymatgen
data_Li4Fe7(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.96418820
_cell_length_b   8.96418820
_cell_length_c   6.57041619
_cell_angle_alpha   80.42937263
_cell_angle_beta   80.42937263
_cell_angle_gamma   105.57042344
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Fe7(PO4)6
_chemical_formula_sum   'Li4 Fe7 P6 O24'
_cell_volume   489.00514596
_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  0.00292600  0.00292600  0.49738400  1
  Li  Li1  1  0.62995500  0.62995500  0.58106800  1
  Li  Li2  1  0.33079100  0.56160000  0.49685400  1
  Li  Li3  1  0.56160000  0.33079100  0.49685400  1
  Fe  Fe4  1  0.35708500  0.99760700  0.18109100  1
  Fe  Fe5  1  0.99760700  0.35708500  0.18109100  1
  Fe  Fe6  1  0.99832600  0.99832600  0.99785100  1
  Fe  Fe7  1  0.66419800  0.32707200  0.00217800  1
  Fe  Fe8  1  0.32707200  0.66419800  0.00217800  1
  Fe  Fe9  1  0.63726700  0.99197800  0.82269400  1
  Fe  Fe10  1  0.99197800  0.63726700  0.82269400  1
  P  P11  1  0.27676200  0.90176800  0.69884000  1
  P  P12  1  0.90176800  0.27676200  0.69884000  1
  P  P13  1  0.67005700  0.67005700  0.09420900  1
  P  P14  1  0.32314800  0.32314800  0.91619300  1
  P  P15  1  0.71550700  0.07989800  0.30445900  1
  P  P16  1  0.07989800  0.71550700  0.30445900  1
  O  O17  1  0.65121800  0.96207900  0.51900700  1
  O  O18  1  0.96207900  0.65121800  0.51900700  1
  O  O19  1  0.94938700  0.37309600  0.86963000  1
  O  O20  1  0.37309600  0.94938700  0.86963000  1
  O  O21  1  0.80267800  0.80267800  0.12930200  1
  O  O22  1  0.74294800  0.56849100  0.95483100  1
  O  O23  1  0.56849100  0.74294800  0.95483100  1
  O  O24  1  0.09747500  0.89388300  0.75579700  1
  O  O25  1  0.89388300  0.09747500  0.75579700  1
  O  O26  1  0.26875900  0.72137500  0.71125900  1
  O  O27  1  0.72137500  0.26875900  0.71125900  1
  O  O28  1  0.56435000  0.56435000  0.30769200  1
  O  O29  1  0.43608700  0.43608700  0.71010700  1
  O  O30  1  0.70881500  0.25522000  0.29944500  1
  O  O31  1  0.25522000  0.70881500  0.29944500  1
  O  O32  1  0.89822200  0.10234300  0.24037800  1
  O  O33  1  0.10234300  0.89822200  0.24037800  1
  O  O34  1  0.19362500  0.19362500  0.86984000  1
  O  O35  1  0.61884400  0.02759500  0.13701600  1
  O  O36  1  0.02759500  0.61884400  0.13701600  1
  O  O37  1  0.24478800  0.42343300  0.04996900  1
  O  O38  1  0.42343300  0.24478800  0.04996900  1
  O  O39  1  0.01648800  0.35392500  0.48513300  1
  O  O40  1  0.35392500  0.01648800  0.48513300  1
