# generated using pymatgen
data_Li3Fe(Si2O5)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.97666100
_cell_length_b   9.86328200
_cell_length_c   14.97598000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe(Si2O5)3
_chemical_formula_sum   'Li12 Fe4 Si24 O60'
_cell_volume   1178.25105404
_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  0.75000000  0.08458600  0.93626100  1
  Li  Li1  1  0.75000000  0.41541400  0.43626100  1
  Li  Li2  1  0.00054300  0.50192300  0.75613200  1
  Li  Li3  1  0.49945700  0.50192300  0.75613200  1
  Li  Li4  1  0.99945700  0.49807700  0.24386800  1
  Li  Li5  1  0.50054300  0.49807700  0.24386800  1
  Li  Li6  1  0.25000000  0.58458600  0.56373900  1
  Li  Li7  1  0.25000000  0.91541400  0.06373900  1
  Li  Li8  1  0.99945700  0.00192300  0.74386800  1
  Li  Li9  1  0.50054300  0.00192300  0.74386800  1
  Li  Li10  1  0.00054300  0.99807700  0.25613200  1
  Li  Li11  1  0.49945700  0.99807700  0.25613200  1
  Fe  Fe12  1  0.75000000  0.25392500  0.74808500  1
  Fe  Fe13  1  0.75000000  0.24607500  0.24808500  1
  Fe  Fe14  1  0.25000000  0.75392500  0.75191500  1
  Fe  Fe15  1  0.25000000  0.74607500  0.25191500  1
  Si  Si16  1  0.25000000  0.02644700  0.59832900  1
  Si  Si17  1  0.25000000  0.02470100  0.40065400  1
  Si  Si18  1  0.43877000  0.20791700  0.89949200  1
  Si  Si19  1  0.06123000  0.20791700  0.89949200  1
  Si  Si20  1  0.05936800  0.20583600  0.10030200  1
  Si  Si21  1  0.44063200  0.20583600  0.10030200  1
  Si  Si22  1  0.05936800  0.29416400  0.60030200  1
  Si  Si23  1  0.44063200  0.29416400  0.60030200  1
  Si  Si24  1  0.43877000  0.29208300  0.39949200  1
  Si  Si25  1  0.06123000  0.29208300  0.39949200  1
  Si  Si26  1  0.25000000  0.47529900  0.90065400  1
  Si  Si27  1  0.25000000  0.47355300  0.09832900  1
  Si  Si28  1  0.75000000  0.52470100  0.09934600  1
  Si  Si29  1  0.75000000  0.52644700  0.90167100  1
  Si  Si30  1  0.56123000  0.70791700  0.60050800  1
  Si  Si31  1  0.93877000  0.70791700  0.60050800  1
  Si  Si32  1  0.94063200  0.70583600  0.39969800  1
  Si  Si33  1  0.55936800  0.70583600  0.39969800  1
  Si  Si34  1  0.94063200  0.79416400  0.89969800  1
  Si  Si35  1  0.56123000  0.79208300  0.10050800  1
  Si  Si36  1  0.93877000  0.79208300  0.10050800  1
  Si  Si37  1  0.55936800  0.79416400  0.89969800  1
  Si  Si38  1  0.75000000  0.97355300  0.40167100  1
  Si  Si39  1  0.75000000  0.97529900  0.59934600  1
  O  O40  1  0.75000000  0.04510400  0.50023300  1
  O  O41  1  0.75000000  0.07852800  0.68165900  1
  O  O42  1  0.75000000  0.07524600  0.31867000  1
  O  O43  1  0.41252900  0.12949200  0.60669200  1
  O  O44  1  0.08747100  0.12949200  0.60669200  1
  O  O45  1  0.41389400  0.12698500  0.39172500  1
  O  O46  1  0.08610600  0.12698500  0.39172500  1
  O  O47  1  0.25000000  0.14012500  0.89067400  1
  O  O48  1  0.25000000  0.13302700  0.10214000  1
  O  O49  1  0.92638800  0.14954600  0.82997900  1
  O  O50  1  0.57361200  0.14954600  0.82997900  1
  O  O51  1  0.94069600  0.15479400  0.17928800  1
  O  O52  1  0.55930400  0.15479400  0.17928800  1
  O  O53  1  0.51691100  0.16859000  0.99979900  1
  O  O54  1  0.98308900  0.16859000  0.99979900  1
  O  O55  1  0.51691100  0.33141000  0.49979900  1
  O  O56  1  0.98308900  0.33141000  0.49979900  1
  O  O57  1  0.92638800  0.35045400  0.32997900  1
  O  O58  1  0.94069600  0.34520600  0.67928800  1
  O  O59  1  0.55930400  0.34520600  0.67928800  1
  O  O60  1  0.57361200  0.35045400  0.32997900  1
  O  O61  1  0.25000000  0.36697300  0.60214000  1
  O  O62  1  0.25000000  0.35987500  0.39067400  1
  O  O63  1  0.08610600  0.37301500  0.89172500  1
  O  O64  1  0.41389400  0.37301500  0.89172500  1
  O  O65  1  0.41252900  0.37050800  0.10669200  1
  O  O66  1  0.08747100  0.37050800  0.10669200  1
  O  O67  1  0.75000000  0.42475400  0.81867000  1
  O  O68  1  0.75000000  0.42147200  0.18165900  1
  O  O69  1  0.75000000  0.45489600  0.00023300  1
  O  O70  1  0.25000000  0.54510400  0.99976700  1
  O  O71  1  0.25000000  0.57852800  0.81834100  1
  O  O72  1  0.25000000  0.57524600  0.18133000  1
  O  O73  1  0.91389400  0.62698500  0.10827500  1
  O  O74  1  0.58610600  0.62698500  0.10827500  1
  O  O75  1  0.91252900  0.62949200  0.89330800  1
  O  O76  1  0.58747100  0.62949200  0.89330800  1
  O  O77  1  0.75000000  0.63302700  0.39786000  1
  O  O78  1  0.75000000  0.64012500  0.60932600  1
  O  O79  1  0.44069600  0.65479400  0.32071200  1
  O  O80  1  0.05930400  0.65479400  0.32071200  1
  O  O81  1  0.42638800  0.64954600  0.67002100  1
  O  O82  1  0.07361200  0.64954600  0.67002100  1
  O  O83  1  0.01691100  0.66859000  0.50020100  1
  O  O84  1  0.48308900  0.66859000  0.50020100  1
  O  O85  1  0.01691100  0.83141000  0.00020100  1
  O  O86  1  0.48308900  0.83141000  0.00020100  1
  O  O87  1  0.44069600  0.84520600  0.82071200  1
  O  O88  1  0.05930400  0.84520600  0.82071200  1
  O  O89  1  0.42638800  0.85045400  0.17002100  1
  O  O90  1  0.07361200  0.85045400  0.17002100  1
  O  O91  1  0.75000000  0.86697300  0.89786000  1
  O  O92  1  0.75000000  0.85987500  0.10932600  1
  O  O93  1  0.58747100  0.87050800  0.39330800  1
  O  O94  1  0.58610600  0.87301500  0.60827500  1
  O  O95  1  0.91389400  0.87301500  0.60827500  1
  O  O96  1  0.91252900  0.87050800  0.39330800  1
  O  O97  1  0.25000000  0.92475400  0.68133000  1
  O  O98  1  0.25000000  0.92147200  0.31834100  1
  O  O99  1  0.25000000  0.95489600  0.49976700  1
