# generated using pymatgen
data_Li3Ti2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.79149100
_cell_length_b   8.82884800
_cell_length_c   14.96876231
_cell_angle_alpha   54.74356514
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti2(PO4)3
_chemical_formula_sum   'Li12 Ti8 P12 O48'
_cell_volume   948.74493078
_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  0.42042700  0.38065600  0.19659200  1
  Li  Li1  1  0.22416500  0.97183100  0.82194600  1
  Li  Li2  1  0.72416500  0.02816900  0.67805400  1
  Li  Li3  1  0.79875100  0.32714700  0.25846100  1
  Li  Li4  1  0.77583500  0.02816900  0.17805400  1
  Li  Li5  1  0.07957300  0.38065600  0.69659200  1
  Li  Li6  1  0.92042700  0.61934400  0.30340800  1
  Li  Li7  1  0.29875100  0.67285300  0.24153900  1
  Li  Li8  1  0.57957300  0.61934400  0.80340800  1
  Li  Li9  1  0.20124900  0.67285300  0.74153900  1
  Li  Li10  1  0.70124900  0.32714700  0.75846100  1
  Li  Li11  1  0.27583500  0.97183100  0.32194600  1
  Ti  Ti12  1  0.03985900  0.13734000  0.60797200  1
  Ti  Ti13  1  0.96014100  0.86266000  0.39202800  1
  Ti  Ti14  1  0.02617000  0.36312000  0.89220300  1
  Ti  Ti15  1  0.97383000  0.63688000  0.10779700  1
  Ti  Ti16  1  0.46014100  0.13734000  0.10797200  1
  Ti  Ti17  1  0.52617000  0.63688000  0.60779700  1
  Ti  Ti18  1  0.53985900  0.86266000  0.89202800  1
  Ti  Ti19  1  0.47383000  0.36312000  0.39220300  1
  P  P20  1  0.88325600  0.74650600  0.64985200  1
  P  P21  1  0.75342300  0.45594900  0.50793100  1
  P  P22  1  0.25342300  0.54405100  0.99206900  1
  P  P23  1  0.24657700  0.54405100  0.49206900  1
  P  P24  1  0.39668300  0.95485800  0.64968500  1
  P  P25  1  0.61674400  0.74650600  0.14985200  1
  P  P26  1  0.38325600  0.25349400  0.85014800  1
  P  P27  1  0.89668300  0.04514200  0.85031500  1
  P  P28  1  0.60331700  0.04514200  0.35031500  1
  P  P29  1  0.10331700  0.95485800  0.14968500  1
  P  P30  1  0.74657700  0.45594900  0.00793100  1
  P  P31  1  0.11674400  0.25349400  0.35014800  1
  O  O32  1  0.40611000  0.09904800  0.83262500  1
  O  O33  1  0.68674500  0.47353900  0.59692400  1
  O  O34  1  0.61071600  0.22379500  0.34854200  1
  O  O35  1  0.58928000  0.82343100  0.02842200  1
  O  O36  1  0.81325500  0.47353900  0.09692400  1
  O  O37  1  0.55657300  0.87244300  0.46010600  1
  O  O38  1  0.63352800  0.61309200  0.93211700  1
  O  O39  1  0.33025400  0.73723800  0.93358800  1
  O  O40  1  0.37230300  0.53509500  0.56773400  1
  O  O41  1  0.94342700  0.87244300  0.96010600  1
  O  O42  1  0.08928000  0.17656900  0.47157800  1
  O  O43  1  0.09389000  0.09904800  0.33262500  1
  O  O44  1  0.31325500  0.52646100  0.40307600  1
  O  O45  1  0.41072000  0.17656900  0.97157800  1
  O  O46  1  0.50265900  0.41157700  0.78153300  1
  O  O47  1  0.88928400  0.22379500  0.84854200  1
  O  O48  1  0.49734100  0.58842300  0.21846700  1
  O  O49  1  0.01966800  0.08891500  0.76237200  1
  O  O50  1  0.59389000  0.90095200  0.16737500  1
  O  O51  1  0.98033200  0.91108500  0.23762800  1
  O  O52  1  0.13352800  0.38690800  0.56788300  1
  O  O53  1  0.00265900  0.58842300  0.71846700  1
  O  O54  1  0.44342700  0.12755700  0.53989400  1
  O  O55  1  0.87230300  0.46490500  0.93226600  1
  O  O56  1  0.16974600  0.73723800  0.43358800  1
  O  O57  1  0.11071600  0.77620500  0.15145800  1
  O  O58  1  0.91072000  0.82343100  0.52842200  1
  O  O59  1  0.78282900  0.67405100  0.18317400  1
  O  O60  1  0.21717100  0.32594900  0.81682600  1
  O  O61  1  0.90611000  0.90095200  0.66737500  1
  O  O62  1  0.66974600  0.26276200  0.06641200  1
  O  O63  1  0.48033200  0.08891500  0.26237200  1
  O  O64  1  0.18674500  0.52646100  0.90307600  1
  O  O65  1  0.36647200  0.38690800  0.06788300  1
  O  O66  1  0.71717100  0.67405100  0.68317400  1
  O  O67  1  0.05657300  0.12755700  0.03989400  1
  O  O68  1  0.28282900  0.32594900  0.31682600  1
  O  O69  1  0.76288600  0.02971000  0.31159000  1
  O  O70  1  0.51966800  0.91108500  0.73762800  1
  O  O71  1  0.12769700  0.53509500  0.06773400  1
  O  O72  1  0.62769700  0.46490500  0.43226600  1
  O  O73  1  0.83025400  0.26276200  0.56641200  1
  O  O74  1  0.99734100  0.41157700  0.28153300  1
  O  O75  1  0.38928400  0.77620500  0.65145800  1
  O  O76  1  0.26288600  0.97029000  0.18841000  1
  O  O77  1  0.23711400  0.97029000  0.68841000  1
  O  O78  1  0.86647200  0.61309200  0.43211700  1
  O  O79  1  0.73711400  0.02971000  0.81159000  1
