# generated using pymatgen
data_Li6Ti3P8O29
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.84016400
_cell_length_b   9.84339469
_cell_length_c   13.89600715
_cell_angle_alpha   89.57860535
_cell_angle_beta   89.65853658
_cell_angle_gamma   60.28263094
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Ti3P8O29
_chemical_formula_sum   'Li12 Ti6 P16 O58'
_cell_volume   1168.91905438
_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  0.01444700  0.03154900  0.50305200  1
  Li  Li1  1  0.00030700  0.99992200  0.99991200  1
  Li  Li2  1  0.08846200  0.67603600  0.06237800  1
  Li  Li3  1  0.32894000  0.32841600  0.88616400  1
  Li  Li4  1  0.23637300  0.66396800  0.55994100  1
  Li  Li5  1  0.66162100  0.10015000  0.56128400  1
  Li  Li6  1  0.33757200  0.76584400  0.94176500  1
  Li  Li7  1  0.67288600  0.23346800  0.06233800  1
  Li  Li8  1  0.33553800  0.90636400  0.43647800  1
  Li  Li9  1  0.76580200  0.33635200  0.43911800  1
  Li  Li10  1  0.90209500  0.33614100  0.93802600  1
  Li  Li11  1  0.90057800  0.76645500  0.43968000  1
  Ti  Ti12  1  0.00332800  0.42994800  0.74439400  1
  Ti  Ti13  1  0.99631000  0.56105600  0.24981300  1
  Ti  Ti14  1  0.43475700  0.00421200  0.24367600  1
  Ti  Ti15  1  0.56811900  0.99303400  0.75342000  1
  Ti  Ti16  1  0.43523200  0.56731800  0.74841100  1
  Ti  Ti17  1  0.56333500  0.43719000  0.25159100  1
  P  P18  1  0.08420000  0.21876500  0.33943500  1
  P  P19  1  0.21972300  0.08500800  0.84060900  1
  P  P20  1  0.09103500  0.68477200  0.84640400  1
  P  P21  1  0.33296400  0.33784600  0.12724600  1
  P  P22  1  0.33787800  0.33297800  0.62678600  1
  P  P23  1  0.22369800  0.68666300  0.34308900  1
  P  P24  1  0.31230300  0.77496700  0.15842800  1
  P  P25  1  0.68790700  0.08405300  0.34555900  1
  P  P26  1  0.30858900  0.91771200  0.65300100  1
  P  P27  1  0.68238700  0.22467900  0.84277500  1
  P  P28  1  0.77425500  0.31119300  0.65776900  1
  P  P29  1  0.66984700  0.66035600  0.87291900  1
  P  P30  1  0.66382900  0.66954500  0.37257700  1
  P  P31  1  0.91347200  0.30929300  0.15306700  1
  P  P32  1  0.77984600  0.91709500  0.15828500  1
  P  P33  1  0.91659500  0.77441800  0.66015600  1
  O  O34  1  0.00990600  0.19645800  0.24100400  1
  O  O35  1  0.98631700  0.22937100  0.06013200  1
  O  O36  1  0.08021900  0.25405100  0.84273900  1
  O  O37  1  0.19661200  0.01395900  0.74122200  1
  O  O38  1  0.22503700  0.99032000  0.56032700  1
  O  O39  1  0.25358400  0.08250000  0.34047100  1
  O  O40  1  0.07941300  0.37758700  0.32949600  1
  O  O41  1  0.19366700  0.33062400  0.67538900  1
  O  O42  1  0.10248200  0.52374300  0.83271400  1
  O  O43  1  0.00522300  0.77326600  0.57032500  1
  O  O44  1  0.00215000  0.79280200  0.75346300  1
  O  O45  1  0.08121200  0.66151500  0.34296000  1
  O  O46  1  0.32918100  0.19402200  0.17170700  1
  O  O47  1  0.37184800  0.09570400  0.83212800  1
  O  O48  1  0.18630100  0.48956600  0.16605200  1
  O  O49  1  0.33584400  0.33937800  0.01885300  1
  O  O50  1  0.33640200  0.34078500  0.51954300  1
  O  O51  1  0.32987800  0.48672200  0.66871700  1
  O  O52  1  0.53364400  0.08522600  0.32959700  1
  O  O53  1  0.48878800  0.18720800  0.66760500  1
  O  O54  1  0.25883100  0.66201200  0.84129600  1
  O  O55  1  0.20141100  0.79456000  0.24995000  1
  O  O56  1  0.22538600  0.77384400  0.06896400  1
  O  O57  1  0.22627600  0.77402300  0.43182600  1
  O  O58  1  0.37678100  0.53126400  0.32903300  1
  O  O59  1  0.48599600  0.33108500  0.16607400  1
  O  O60  1  0.33440600  0.74880900  0.66106000  1
  O  O61  1  0.52116300  0.37392000  0.83029400  1
  O  O62  1  0.65754900  0.08303100  0.84045200  1
  O  O63  1  0.21430200  0.98682600  0.92194800  1
  O  O64  1  0.79173800  0.01088800  0.07625100  1
  O  O65  1  0.80208600  0.99186800  0.25709500  1
  O  O66  1  0.34041600  0.91395600  0.16200000  1
  O  O67  1  0.46690700  0.62060400  0.17274800  1
  O  O68  1  0.66299200  0.25199200  0.34295500  1
  O  O69  1  0.51902700  0.66358900  0.83028000  1
  O  O70  1  0.62074500  0.46543000  0.67111100  1
  O  O71  1  0.77571900  0.22281700  0.56829400  1
  O  O72  1  0.76954300  0.22956000  0.93092600  1
  O  O73  1  0.79124300  0.20458100  0.75049700  1
  O  O74  1  0.74483200  0.33658900  0.16226600  1
  O  O75  1  0.51322400  0.81318600  0.33123000  1
  O  O76  1  0.46233100  0.91806700  0.66970900  1
  O  O77  1  0.67293900  0.51482400  0.33206700  1
  O  O78  1  0.66284700  0.65945900  0.98007200  1
  O  O79  1  0.66736200  0.66618000  0.48023600  1
  O  O80  1  0.81754600  0.51185200  0.83250300  1
  O  O81  1  0.62258600  0.91940300  0.16811500  1
  O  O82  1  0.66660000  0.80789600  0.82548200  1
  O  O83  1  0.91519200  0.33724000  0.66110000  1
  O  O84  1  0.98883400  0.20937900  0.42168300  1
  O  O85  1  0.91201700  0.46548700  0.16976900  1
  O  O86  1  0.81063400  0.67590500  0.32992000  1
  O  O87  1  0.91288100  0.62122800  0.67397200  1
  O  O88  1  0.74989700  0.91724000  0.66032400  1
  O  O89  1  0.77258600  0.99922400  0.43686500  1
  O  O90  1  0.91700400  0.74692900  0.15908600  1
  O  O91  1  0.01080500  0.77147600  0.93628900  1
