# generated using pymatgen
data_Li3Ti2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.84571507
_cell_length_b   9.84571507
_cell_length_c   9.87484140
_cell_angle_alpha   85.68291970
_cell_angle_beta   85.68291970
_cell_angle_gamma   85.68558366
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti2(PO4)3
_chemical_formula_sum   'Li12 Ti8 P12 O48'
_cell_volume   949.49205792
_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  0.53316100  0.73050200  0.91048300  1
  Li  Li1  1  0.31649200  0.98878800  0.02110700  1
  Li  Li2  1  0.26949800  0.46683900  0.08951700  1
  Li  Li3  1  0.01121200  0.68350800  0.97889300  1
  Li  Li4  1  0.02057100  0.46418800  0.24365700  1
  Li  Li5  1  0.53581200  0.97942900  0.75634300  1
  Li  Li6  1  0.83288500  0.76227400  0.23601300  1
  Li  Li7  1  0.23772600  0.16711500  0.76398700  1
  Li  Li8  1  0.01034800  0.32764200  0.49686000  1
  Li  Li9  1  0.74929500  0.49784000  0.41155300  1
  Li  Li10  1  0.67235800  0.98965200  0.50314000  1
  Li  Li11  1  0.50216000  0.25070500  0.58844700  1
  Ti  Ti12  1  0.46114800  0.75027900  0.28904200  1
  Ti  Ti13  1  0.75296600  0.46764600  0.78673200  1
  Ti  Ti14  1  0.95988000  0.04012000  0.00000000  1
  Ti  Ti15  1  0.74913300  0.25086700  0.00000000  1
  Ti  Ti16  1  0.24956100  0.75043900  0.50000000  1
  Ti  Ti17  1  0.24972100  0.53885200  0.71095800  1
  Ti  Ti18  1  0.03641900  0.96358100  0.50000000  1
  Ti  Ti19  1  0.53235400  0.24703400  0.21326800  1
  P  P20  1  0.44676000  0.32850300  0.90050900  1
  P  P21  1  0.17372100  0.84968700  0.80442500  1
  P  P22  1  0.05443200  0.35001200  0.92158700  1
  P  P23  1  0.15031300  0.82627900  0.19557500  1
  P  P24  1  0.31846600  0.44632700  0.40275200  1
  P  P25  1  0.34835000  0.05339900  0.42811400  1
  P  P26  1  0.64998800  0.94556800  0.07841300  1
  P  P27  1  0.67149700  0.55324000  0.09949100  1
  P  P28  1  0.84173800  0.18052100  0.30433600  1
  P  P29  1  0.94660100  0.65165000  0.57188600  1
  P  P30  1  0.81947900  0.15826200  0.69566400  1
  P  P31  1  0.55367300  0.68153400  0.59724800  1
  O  O32  1  0.40403600  0.20821900  0.82823200  1
  O  O33  1  0.37894100  0.46844700  0.85314200  1
  O  O34  1  0.29192600  0.92720200  0.84494800  1
  O  O35  1  0.18765600  0.69136800  0.83763700  1
  O  O36  1  0.41342500  0.31592200  0.05850300  1
  O  O37  1  0.12248000  0.39250200  0.78013300  1
  O  O38  1  0.03412600  0.89559100  0.87445700  1
  O  O39  1  0.30863200  0.81234400  0.16236300  1
  O  O40  1  0.08720300  0.19177100  0.93678300  1
  O  O41  1  0.45586900  0.37798000  0.34796500  1
  O  O42  1  0.39990200  0.11575000  0.28760200  1
  O  O43  1  0.09605600  0.43139300  0.03633600  1
  O  O44  1  0.10440900  0.96587400  0.12554300  1
  O  O45  1  0.82573000  0.12293600  0.85383000  1
  O  O46  1  0.89450000  0.37923300  0.91913100  1
  O  O47  1  0.37818500  0.89321700  0.42090000  1
  O  O48  1  0.33055600  0.60591800  0.37322400  1
  O  O49  1  0.07279800  0.70807400  0.15505200  1
  O  O50  1  0.19287800  0.41018100  0.33495900  1
  O  O51  1  0.42508200  0.09345600  0.54639100  1
  O  O52  1  0.12311500  0.83373200  0.35436000  1
  O  O53  1  0.39408200  0.66944400  0.62677600  1
  O  O54  1  0.80822900  0.91279700  0.06321700  1
  O  O55  1  0.68407800  0.58657500  0.94149700  1
  O  O56  1  0.31226600  0.41146100  0.56030100  1
  O  O57  1  0.19117200  0.08367400  0.45064300  1
  O  O58  1  0.60593000  0.33351200  0.87045800  1
  O  O59  1  0.87706400  0.17427000  0.14617000  1
  O  O60  1  0.56860700  0.90394400  0.96366400  1
  O  O61  1  0.79178100  0.59596400  0.17176800  1
  O  O62  1  0.89755100  0.31025500  0.34949800  1
  O  O63  1  0.62076700  0.10550000  0.08086900  1
  O  O64  1  0.66648800  0.39407000  0.12954200  1
  O  O65  1  0.10678300  0.62181500  0.57910000  1
  O  O66  1  0.16626800  0.87688500  0.64564000  1
  O  O67  1  0.89796700  0.04397800  0.37238300  1
  O  O68  1  0.90654400  0.57491800  0.45360900  1
  O  O69  1  0.53155300  0.62105900  0.14685800  1
  O  O70  1  0.60749800  0.87752000  0.21986700  1
  O  O71  1  0.91632600  0.80882800  0.54935700  1
  O  O72  1  0.68325300  0.18308200  0.33511400  1
  O  O73  1  0.95602200  0.10203300  0.62761700  1
  O  O74  1  0.88425000  0.60009800  0.71239800  1
  O  O75  1  0.58853900  0.68773400  0.43969900  1
  O  O76  1  0.81691800  0.31674700  0.66488600  1
  O  O77  1  0.68974500  0.10244900  0.65050200  1
  O  O78  1  0.62202000  0.54413100  0.65203500  1
  O  O79  1  0.58981900  0.80712200  0.66504100  1
