# generated using pymatgen
data_LiFe(SiO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.76939837
_cell_length_b   7.76939837
_cell_length_c   9.97611700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   93.25210943
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe(SiO3)2
_chemical_formula_sum   'Li4 Fe4 Si8 O24'
_cell_volume   601.22406370
_cell_formula_units_Z   4
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  0.89971500  0.10028500  0.25000000  1
  Li  Li1  1  0.39901900  0.39901900  0.00000000  1
  Li  Li2  1  0.60098100  0.60098100  0.50000000  1
  Li  Li3  1  0.10028500  0.89971500  0.75000000  1
  Fe  Fe4  1  0.66203400  0.15353600  0.54442100  1
  Fe  Fe5  1  0.84646400  0.33796600  0.95557900  1
  Fe  Fe6  1  0.15353600  0.66203400  0.45557900  1
  Fe  Fe7  1  0.33796600  0.84646400  0.04442100  1
  Si  Si8  1  0.07116000  0.07116000  0.50000000  1
  Si  Si9  1  0.36738900  0.14413900  0.29711400  1
  Si  Si10  1  0.14413900  0.36738900  0.70288600  1
  Si  Si11  1  0.54694200  0.45305800  0.75000000  1
  Si  Si12  1  0.45305800  0.54694200  0.25000000  1
  Si  Si13  1  0.85586100  0.63261100  0.20288600  1
  Si  Si14  1  0.63261100  0.85586100  0.79711400  1
  Si  Si15  1  0.92884000  0.92884000  0.00000000  1
  O  O16  1  0.62982600  0.99613700  0.67951800  1
  O  O17  1  0.87320400  0.10619200  0.45611900  1
  O  O18  1  0.50072500  0.10467100  0.41402700  1
  O  O19  1  0.16904200  0.13760500  0.36028900  1
  O  O20  1  0.13760500  0.16904200  0.63971100  1
  O  O21  1  0.89380800  0.12679600  0.04388100  1
  O  O22  1  0.41190700  0.33658900  0.22802500  1
  O  O23  1  0.62008000  0.38080300  0.60853800  1
  O  O24  1  0.61919700  0.37992000  0.89146200  1
  O  O25  1  0.00386300  0.37017400  0.82048200  1
  O  O26  1  0.33658900  0.41190700  0.77197500  1
  O  O27  1  0.10467100  0.50072500  0.58597300  1
  O  O28  1  0.89532900  0.49927500  0.08597300  1
  O  O29  1  0.66341100  0.58809300  0.27197500  1
  O  O30  1  0.99613700  0.62982600  0.32048200  1
  O  O31  1  0.38080300  0.62008000  0.39146200  1
  O  O32  1  0.37992000  0.61919700  0.10853800  1
  O  O33  1  0.58809300  0.66341100  0.72802500  1
  O  O34  1  0.10619200  0.87320400  0.54388100  1
  O  O35  1  0.86239500  0.83095800  0.13971100  1
  O  O36  1  0.83095800  0.86239500  0.86028900  1
  O  O37  1  0.49927500  0.89532900  0.91402700  1
  O  O38  1  0.12679600  0.89380800  0.95611900  1
  O  O39  1  0.37017400  0.00386300  0.17951800  1
