# generated using pymatgen
data_Li3Ti3Fe(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.69550521
_cell_length_b   8.69115590
_cell_length_c   17.45040733
_cell_angle_alpha   59.80590756
_cell_angle_beta   59.88872755
_cell_angle_gamma   59.94844841
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti3Fe(PO4)6
_chemical_formula_sum   'Li6 Ti6 Fe2 P12 O48'
_cell_volume   930.01006170
_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  0.64003500  0.23966600  0.41188300  1
  Li  Li1  1  0.63492100  0.54139900  0.17901600  1
  Li  Li2  1  0.97093000  0.88590900  0.05581300  1
  Li  Li3  1  0.39942100  0.47152800  0.80352600  1
  Li  Li4  1  0.74485800  0.56314000  0.64299500  1
  Li  Li5  1  0.96416200  0.88297000  0.56352600  1
  Ti  Ti6  1  0.14192800  0.14088500  0.06749700  1
  Ti  Ti7  1  0.36112100  0.35971000  0.17835100  1
  Ti  Ti8  1  0.14769400  0.13682500  0.56751900  1
  Ti  Ti9  1  0.35750700  0.34559600  0.68496300  1
  Ti  Ti10  1  0.64137900  0.64836700  0.32217800  1
  Ti  Ti11  1  0.85953300  0.85868200  0.92674700  1
  Fe  Fe12  1  0.86805700  0.85509800  0.42505900  1
  Fe  Fe13  1  0.64358400  0.63808600  0.82138900  1
  P  P14  1  0.04441500  0.74401300  0.23084000  1
  P  P15  1  0.46502400  0.04376200  0.37592900  1
  P  P16  1  0.24874200  0.53615400  0.48632000  1
  P  P17  1  0.75653900  0.45542400  0.01661400  1
  P  P18  1  0.04591500  0.74132100  0.73100200  1
  P  P19  1  0.53652600  0.96270500  0.12514700  1
  P  P20  1  0.46380900  0.03140800  0.87603700  1
  P  P21  1  0.96144400  0.25166900  0.26380000  1
  P  P22  1  0.25106800  0.53976700  0.98178000  1
  P  P23  1  0.75111600  0.45039700  0.52000200  1
  P  P24  1  0.53848000  0.95702200  0.62609400  1
  P  P25  1  0.96233700  0.24610600  0.76772900  1
  O  O26  1  0.99068100  0.19993300  0.18403700  1
  O  O27  1  0.19988000  0.37050700  0.00438100  1
  O  O28  1  0.37157300  0.99501400  0.10256100  1
  O  O29  1  0.12558300  0.30945900  0.23853500  1
  O  O30  1  0.31026100  0.50572000  0.06005300  1
  O  O31  1  0.05655800  0.90986200  0.13618400  1
  O  O32  1  0.50467900  0.12854700  0.14673700  1
  O  O33  1  0.22939100  0.57732300  0.21902100  1
  O  O34  1  0.27844900  0.05647400  0.45830000  1
  O  O35  1  0.01478600  0.19335500  0.68305100  1
  O  O36  1  0.43482300  0.21719400  0.28929500  1
  O  O37  1  0.21130600  0.36879900  0.49814900  1
  O  O38  1  0.07386000  0.71735300  0.48463100  1
  O  O39  1  0.59409600  0.43310200  0.11345900  1
  O  O40  1  0.38047200  0.00014100  0.59485400  1
  O  O41  1  0.12257700  0.29810400  0.75393800  1
  O  O42  1  0.41945500  0.56067400  0.39453900  1
  O  O43  1  0.92700300  0.27072800  0.02609600  1
  O  O44  1  0.29884800  0.48958700  0.57064100  1
  O  O45  1  0.07599100  0.90592800  0.63556000  1
  O  O46  1  0.55821900  0.77441400  0.21071000  1
  O  O47  1  0.48620100  0.11109000  0.66326200  1
  O  O48  1  0.23360800  0.57279600  0.72740700  1
  O  O49  1  0.72808900  0.93081900  0.04440500  1
  O  O50  1  0.28282200  0.05079600  0.96189400  1
  O  O51  1  0.76668200  0.41825700  0.27598400  1
  O  O52  1  0.52504000  0.86164500  0.35613800  1
  O  O53  1  0.43934100  0.22746300  0.79687000  1
  O  O54  1  0.93536100  0.09326400  0.36020200  1
  O  O55  1  0.71036500  0.47861900  0.43621700  1
  O  O56  1  0.07734200  0.72373000  0.97756800  1
  O  O57  1  0.58812400  0.41850200  0.61421100  1
  O  O58  1  0.87747400  0.69138100  0.25062200  1
  O  O59  1  0.62167400  0.03327400  0.39776100  1
  O  O60  1  0.40824600  0.55842600  0.88505500  1
  O  O61  1  0.92579800  0.27167000  0.52976100  1
  O  O62  1  0.78276300  0.62335100  0.50795800  1
  O  O63  1  0.56963200  0.75868000  0.70096200  1
  O  O64  1  0.00893500  0.79402300  0.31192000  1
  O  O65  1  0.72456600  0.96266400  0.54042800  1
  O  O66  1  0.77711500  0.41584500  0.76885400  1
  O  O67  1  0.49903300  0.87624700  0.84648700  1
  O  O68  1  0.93680600  0.07941300  0.86060600  1
  O  O69  1  0.70473000  0.49102800  0.93647000  1
  O  O70  1  0.88639200  0.69989800  0.73824600  1
  O  O71  1  0.63294800  0.98951000  0.90044200  1
  O  O72  1  0.80321400  0.62028300  0.00270200  1
  O  O73  1  0.00046200  0.79229900  0.81498400  1
