# generated using pymatgen
data_LiFeSi3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.78504548
_cell_length_b   7.78504548
_cell_length_c   7.29239635
_cell_angle_alpha   76.13845575
_cell_angle_beta   76.13845575
_cell_angle_gamma   116.38778674
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeSi3O8
_chemical_formula_sum   'Li2 Fe2 Si6 O16'
_cell_volume   352.65093188
_cell_formula_units_Z   2
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  0.63424500  0.75332800  0.16273000  1
  Li  Li1  1  0.24667200  0.36575500  0.83727000  1
  Fe  Fe2  1  0.56468800  0.78850400  0.66309800  1
  Fe  Fe3  1  0.21149600  0.43531200  0.33690200  1
  Si  Si4  1  0.80596700  0.56794600  0.66219000  1
  Si  Si5  1  0.16716900  0.81943400  0.78521500  1
  Si  Si6  1  0.84913800  0.18169800  0.77733900  1
  Si  Si7  1  0.81830200  0.15086200  0.22266100  1
  Si  Si8  1  0.18056600  0.83283100  0.21478500  1
  Si  Si9  1  0.43205400  0.19403300  0.33781000  1
  O  O10  1  0.93234600  0.69254700  0.78630400  1
  O  O11  1  0.69293300  0.95239600  0.79145900  1
  O  O12  1  0.69815800  0.90688600  0.37658400  1
  O  O13  1  0.95190900  0.69238100  0.41236100  1
  O  O14  1  0.57791700  0.54473200  0.72359000  1
  O  O15  1  0.27547500  0.68263200  0.76761400  1
  O  O16  1  0.75494800  0.32924100  0.73604700  1
  O  O17  1  0.67075900  0.24505200  0.26395300  1
  O  O18  1  0.31736800  0.72452500  0.23238600  1
  O  O19  1  0.86681700  0.13318300  0.00000000  1
  O  O20  1  0.14001500  0.85998500  0.00000000  1
  O  O21  1  0.45526800  0.42208300  0.27641000  1
  O  O22  1  0.09311400  0.30184200  0.62341600  1
  O  O23  1  0.30761900  0.04809100  0.58763900  1
  O  O24  1  0.04760400  0.30706700  0.20854100  1
  O  O25  1  0.30745300  0.06765400  0.21369600  1
