# generated using pymatgen
data_LiFeSiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.95667175
_cell_length_b   10.95667175
_cell_length_c   11.66484400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999847
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeSiO4
_chemical_formula_sum   'Li12 Fe12 Si12 O48'
_cell_volume   1212.73768989
_cell_formula_units_Z   12
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  0.00000000  0.50000000  0.00915400  1
  Li  Li1  1  0.00000000  0.50000000  0.65751300  1
  Li  Li2  1  0.00000000  0.50000000  0.33333300  1
  Li  Li3  1  0.00000000  0.00000000  0.16666700  1
  Li  Li4  1  0.00000000  0.00000000  0.50000000  1
  Li  Li5  1  0.00000000  0.00000000  0.83333300  1
  Li  Li6  1  0.50000000  0.50000000  0.34248700  1
  Li  Li7  1  0.50000000  0.50000000  0.66666700  1
  Li  Li8  1  0.50000000  0.50000000  0.99084600  1
  Li  Li9  1  0.50000000  0.00000000  0.32418000  1
  Li  Li10  1  0.50000000  0.00000000  0.00000000  1
  Li  Li11  1  0.50000000  0.00000000  0.67582000  1
  Fe  Fe12  1  0.00000000  0.75026100  0.33333300  1
  Fe  Fe13  1  0.24683900  0.75316100  0.66666700  1
  Fe  Fe14  1  0.00000000  0.24973900  0.33333300  1
  Fe  Fe15  1  0.24683900  0.49367800  0.00000000  1
  Fe  Fe16  1  0.24973900  0.24973900  0.66666700  1
  Fe  Fe17  1  0.50632200  0.75316100  0.33333300  1
  Fe  Fe18  1  0.24973900  0.00000000  0.00000000  1
  Fe  Fe19  1  0.49367800  0.24683900  0.33333300  1
  Fe  Fe20  1  0.75026100  0.75026100  0.66666700  1
  Fe  Fe21  1  0.75316100  0.50632200  0.00000000  1
  Fe  Fe22  1  0.75316100  0.24683900  0.66666700  1
  Fe  Fe23  1  0.75026100  0.00000000  0.00000000  1
  Si  Si24  1  0.00000000  0.74810200  0.83333300  1
  Si  Si25  1  0.00000000  0.25189800  0.83333300  1
  Si  Si26  1  0.25235500  0.74764500  0.16666700  1
  Si  Si27  1  0.25235500  0.50470900  0.50000000  1
  Si  Si28  1  0.49529100  0.74764500  0.83333300  1
  Si  Si29  1  0.25189800  0.25189800  0.16666700  1
  Si  Si30  1  0.25189800  0.00000000  0.50000000  1
  Si  Si31  1  0.74810200  0.74810200  0.16666700  1
  Si  Si32  1  0.50470900  0.25235500  0.83333300  1
  Si  Si33  1  0.74764500  0.49529100  0.50000000  1
  Si  Si34  1  0.74764500  0.25235500  0.16666700  1
  Si  Si35  1  0.74810200  0.00000000  0.50000000  1
  O  O36  1  0.10027000  0.89664200  0.43683100  1
  O  O37  1  0.10335800  0.89973000  0.89650200  1
  O  O38  1  0.07308600  0.69103000  0.74036900  1
  O  O39  1  0.11937500  0.70151300  0.25519600  1
  O  O40  1  0.29848700  0.88062500  0.07813700  1
  O  O41  1  0.30897000  0.92691400  0.59296500  1
  O  O42  1  0.19654500  0.59405000  0.57611100  1
  O  O43  1  0.07308600  0.38205600  0.92629800  1
  O  O44  1  0.19654500  0.60249500  0.09055600  1
  O  O45  1  0.11937500  0.41786200  0.41147100  1
  O  O46  1  0.10027000  0.20362800  0.22983500  1
  O  O47  1  0.40595000  0.80345500  0.75722300  1
  O  O48  1  0.39750500  0.80345500  0.24277700  1
  O  O49  1  0.10335800  0.20362800  0.77016500  1
  O  O50  1  0.29848700  0.41786200  0.58852900  1
  O  O51  1  0.40595000  0.60249500  0.90944400  1
  O  O52  1  0.30897000  0.38205600  0.07370200  1
  O  O53  1  0.39750500  0.59405000  0.42388900  1
  O  O54  1  0.20362800  0.10335800  0.56316900  1
  O  O55  1  0.20362800  0.10027000  0.10349800  1
  O  O56  1  0.61794400  0.92691400  0.40703500  1
  O  O57  1  0.58213800  0.88062500  0.92186300  1
  O  O58  1  0.58213800  0.70151300  0.74480400  1
  O  O59  1  0.38205600  0.30897000  0.25963100  1
  O  O60  1  0.61794400  0.69103000  0.25963100  1
  O  O61  1  0.41786200  0.29848700  0.74480400  1
  O  O62  1  0.41786200  0.11937500  0.92186300  1
  O  O63  1  0.38205600  0.07308600  0.40703500  1
  O  O64  1  0.79637200  0.89973000  0.10349800  1
  O  O65  1  0.79637200  0.89664200  0.56316900  1
  O  O66  1  0.60249500  0.40595000  0.42388900  1
  O  O67  1  0.69103000  0.61794400  0.07370200  1
  O  O68  1  0.59405000  0.39750500  0.90944400  1
  O  O69  1  0.70151300  0.58213800  0.58852900  1
  O  O70  1  0.89664200  0.79637200  0.77016500  1
  O  O71  1  0.60249500  0.19654500  0.24277700  1
  O  O72  1  0.59405000  0.19654500  0.75722300  1
  O  O73  1  0.89973000  0.79637200  0.22983500  1
  O  O74  1  0.88062500  0.58213800  0.41147100  1
  O  O75  1  0.80345500  0.39750500  0.09055600  1
  O  O76  1  0.92691400  0.61794400  0.92629800  1
  O  O77  1  0.80345500  0.40595000  0.57611100  1
  O  O78  1  0.69103000  0.07308600  0.59296500  1
  O  O79  1  0.70151300  0.11937500  0.07813700  1
  O  O80  1  0.88062500  0.29848700  0.25519600  1
  O  O81  1  0.92691400  0.30897000  0.74036900  1
  O  O82  1  0.89664200  0.10027000  0.89650200  1
  O  O83  1  0.89973000  0.10335800  0.43683100  1
