# generated using pymatgen
data_Li2Fe3(Si3O8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.02028300
_cell_length_b   9.75345096
_cell_length_c   10.29413348
_cell_angle_alpha   80.00302142
_cell_angle_beta   70.32554078
_cell_angle_gamma   82.50027738
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe3(Si3O8)2
_chemical_formula_sum   'Li4 Fe6 Si12 O32'
_cell_volume   651.65605729
_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  0.85866300  0.88822000  0.46890000  1
  Li  Li1  1  0.83634800  0.57866600  0.81461400  1
  Li  Li2  1  0.16365200  0.42133400  0.18538600  1
  Li  Li3  1  0.14133700  0.11178000  0.53110000  1
  Fe  Fe4  1  0.42047600  0.85782100  0.47372100  1
  Fe  Fe5  1  0.84941400  0.89262500  0.09045300  1
  Fe  Fe6  1  0.34763100  0.87649500  0.11061800  1
  Fe  Fe7  1  0.65236900  0.12350500  0.88938200  1
  Fe  Fe8  1  0.15058600  0.10737500  0.90954700  1
  Fe  Fe9  1  0.57952400  0.14217900  0.52627900  1
  Si  Si10  1  0.99454600  0.86100700  0.75816300  1
  Si  Si11  1  0.54869900  0.86703400  0.76699000  1
  Si  Si12  1  0.21731700  0.67965400  0.93329300  1
  Si  Si13  1  0.25271500  0.61713800  0.34983800  1
  Si  Si14  1  0.64474600  0.59995800  0.13440800  1
  Si  Si15  1  0.79225100  0.59886300  0.38681000  1
  Si  Si16  1  0.20774900  0.40113700  0.61319000  1
  Si  Si17  1  0.35525400  0.40004200  0.86559200  1
  Si  Si18  1  0.74728500  0.38286200  0.65016200  1
  Si  Si19  1  0.78268300  0.32034600  0.06670700  1
  Si  Si20  1  0.45130100  0.13296600  0.23301000  1
  Si  Si21  1  0.00545400  0.13899300  0.24183700  1
  O  O22  1  0.94571400  0.97732600  0.86647500  1
  O  O23  1  0.45105800  0.97502300  0.88283200  1
  O  O24  1  0.13460500  0.91240300  0.60264900  1
  O  O25  1  0.54146800  0.93376000  0.61434400  1
  O  O26  1  0.78735300  0.80832400  0.74671400  1
  O  O27  1  0.07123400  0.70835400  0.83355100  1
  O  O28  1  0.26865800  0.78242000  0.34146100  1
  O  O29  1  0.44241200  0.71851600  0.82939800  1
  O  O30  1  0.65183000  0.76165200  0.07033200  1
  O  O31  1  0.71475000  0.75882900  0.40755600  1
  O  O32  1  0.13251200  0.76742400  0.06272000  1
  O  O33  1  0.24097100  0.50773100  0.98319200  1
  O  O34  1  0.24244900  0.44305500  0.74911100  1
  O  O35  1  0.03955700  0.56679500  0.34882800  1
  O  O36  1  0.40742400  0.56086700  0.20495000  1
  O  O37  1  0.30501300  0.52132000  0.48243900  1
  O  O38  1  0.69498700  0.47868000  0.51756100  1
  O  O39  1  0.59257600  0.43913300  0.79505000  1
  O  O40  1  0.96044300  0.43320500  0.65117200  1
  O  O41  1  0.75755100  0.55694500  0.25088900  1
  O  O42  1  0.75902900  0.49226900  0.01680800  1
  O  O43  1  0.86748800  0.23257600  0.93728000  1
  O  O44  1  0.28525000  0.24117100  0.59244400  1
  O  O45  1  0.34817000  0.23834800  0.92966800  1
  O  O46  1  0.55758800  0.28148400  0.17060200  1
  O  O47  1  0.73134200  0.21758000  0.65853900  1
  O  O48  1  0.92876600  0.29164600  0.16644900  1
  O  O49  1  0.21264700  0.19167600  0.25328600  1
  O  O50  1  0.45853200  0.06624000  0.38565600  1
  O  O51  1  0.86539500  0.08759700  0.39735100  1
  O  O52  1  0.54894200  0.02497700  0.11716800  1
  O  O53  1  0.05428600  0.02267400  0.13352500  1
