# generated using pymatgen
data_Li3(FeO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.86809004
_cell_length_b   8.86809004
_cell_length_c   9.66897011
_cell_angle_alpha   82.86596578
_cell_angle_beta   82.86596578
_cell_angle_gamma   59.18574936
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3(FeO3)2
_chemical_formula_sum   'Li18 Fe12 O36'
_cell_volume   646.35892657
_cell_formula_units_Z   6
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  0.50000000  0.00000000  0.50000000  1
  Li  Li1  1  0.36345000  0.16286700  0.98569400  1
  Li  Li2  1  0.19469300  0.99550900  0.48691700  1
  Li  Li3  1  0.16286700  0.36345000  0.48569400  1
  Li  Li4  1  0.00000000  0.50000000  0.00000000  1
  Li  Li5  1  0.99550900  0.19469300  0.98691700  1
  Li  Li6  1  0.83713300  0.63655000  0.51430600  1
  Li  Li7  1  0.84450300  0.32298600  0.50123700  1
  Li  Li8  1  0.80530700  0.00449100  0.51308300  1
  Li  Li9  1  0.67701400  0.15549700  0.99876300  1
  Li  Li10  1  0.67341300  0.46988300  0.01392400  1
  Li  Li11  1  0.63655000  0.83713300  0.01430600  1
  Li  Li12  1  0.53011700  0.32658700  0.48607600  1
  Li  Li13  1  0.46988300  0.67341300  0.51392400  1
  Li  Li14  1  0.32298600  0.84450300  0.00123700  1
  Li  Li15  1  0.32658700  0.53011700  0.98607600  1
  Li  Li16  1  0.15549700  0.67701400  0.49876300  1
  Li  Li17  1  0.00449100  0.80530700  0.01308300  1
  Fe  Fe18  1  0.25039400  0.08433200  0.74704800  1
  Fe  Fe19  1  0.08433200  0.25039400  0.24704800  1
  Fe  Fe20  1  0.07764700  0.92235300  0.25000000  1
  Fe  Fe21  1  0.92235300  0.07764700  0.75000000  1
  Fe  Fe22  1  0.74734300  0.58459600  0.25350000  1
  Fe  Fe23  1  0.74960600  0.91566800  0.25295200  1
  Fe  Fe24  1  0.58459600  0.74734300  0.75350000  1
  Fe  Fe25  1  0.58665000  0.41335000  0.75000000  1
  Fe  Fe26  1  0.41335000  0.58665000  0.25000000  1
  Fe  Fe27  1  0.41540400  0.25265700  0.24650000  1
  Fe  Fe28  1  0.25265700  0.41540400  0.74650000  1
  Fe  Fe29  1  0.91566800  0.74960600  0.75295200  1
  O  O30  1  0.72390800  0.83755800  0.63627800  1
  O  O31  1  0.55724300  0.05466000  0.12928500  1
  O  O32  1  0.44275700  0.94534000  0.87071500  1
  O  O33  1  0.38880600  0.88963500  0.62980100  1
  O  O34  1  0.33769800  0.21669100  0.63136400  1
  O  O35  1  0.27609200  0.16244200  0.36372200  1
  O  O36  1  0.21669100  0.33769800  0.13136400  1
  O  O37  1  0.16244200  0.27609200  0.86372200  1
  O  O38  1  0.16802900  0.05393400  0.13387700  1
  O  O39  1  0.11749800  0.99426600  0.86303700  1
  O  O40  1  0.05466000  0.55724300  0.62928500  1
  O  O41  1  0.05393400  0.16802900  0.63387700  1
  O  O42  1  0.00573400  0.88250200  0.63696300  1
  O  O43  1  0.99426600  0.11749800  0.36303700  1
  O  O44  1  0.94534000  0.44275700  0.37071500  1
  O  O45  1  0.88963500  0.38880600  0.12980100  1
  O  O46  1  0.83755800  0.72390800  0.13627800  1
  O  O47  1  0.88250200  0.00573400  0.13696300  1
  O  O48  1  0.78330900  0.66230200  0.86863600  1
  O  O49  1  0.83197100  0.94606600  0.86612300  1
  O  O50  1  0.78245300  0.27242100  0.87008600  1
  O  O51  1  0.72757900  0.21754700  0.62991400  1
  O  O52  1  0.67400600  0.55285700  0.63479000  1
  O  O53  1  0.66230200  0.78330900  0.36863600  1
  O  O54  1  0.60692200  0.49717000  0.36880800  1
  O  O55  1  0.61119400  0.11036500  0.37019900  1
  O  O56  1  0.55285700  0.67400600  0.13479000  1
  O  O57  1  0.49717000  0.60692200  0.86880800  1
  O  O58  1  0.50283000  0.39307800  0.13119200  1
  O  O59  1  0.44714300  0.32599400  0.86521000  1
  O  O60  1  0.39307800  0.50283000  0.63119200  1
  O  O61  1  0.32599400  0.44714300  0.36521000  1
  O  O62  1  0.27242100  0.78245300  0.37008600  1
  O  O63  1  0.21754700  0.72757900  0.12991400  1
  O  O64  1  0.11036500  0.61119400  0.87019900  1
  O  O65  1  0.94606600  0.83197100  0.36612300  1
