# generated using pymatgen
data_Li3Ti2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.32539919
_cell_length_b   10.32539919
_cell_length_c   10.32539919
_cell_angle_alpha   109.47122063
_cell_angle_beta   109.47122063
_cell_angle_gamma   109.47122063
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti2(PO4)3
_chemical_formula_sum   'Li12 Ti8 P12 O48'
_cell_volume   847.41990626
_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  0.12500000  0.37500000  1
  Li  Li1  1  0.87500000  0.62500000  0.25000000  1
  Li  Li2  1  0.37500000  0.12500000  0.25000000  1
  Li  Li3  1  0.25000000  0.37500000  0.12500000  1
  Li  Li4  1  0.87500000  0.75000000  0.62500000  1
  Li  Li5  1  0.37500000  0.75000000  0.12500000  1
  Li  Li6  1  0.62500000  0.25000000  0.87500000  1
  Li  Li7  1  0.12500000  0.25000000  0.37500000  1
  Li  Li8  1  0.75000000  0.62500000  0.87500000  1
  Li  Li9  1  0.12500000  0.37500000  0.75000000  1
  Li  Li10  1  0.62500000  0.87500000  0.75000000  1
  Li  Li11  1  0.25000000  0.87500000  0.62500000  1
  Ti  Ti12  1  0.50000000  0.00000000  0.00000000  1
  Ti  Ti13  1  0.00000000  0.00000000  0.00000000  1
  Ti  Ti14  1  0.50000000  0.00000000  0.50000000  1
  Ti  Ti15  1  0.50000000  0.50000000  0.00000000  1
  Ti  Ti16  1  0.50000000  0.50000000  0.50000000  1
  Ti  Ti17  1  0.00000000  0.50000000  0.00000000  1
  Ti  Ti18  1  0.00000000  0.00000000  0.50000000  1
  Ti  Ti19  1  0.00000000  0.50000000  0.50000000  1
  P  P20  1  0.87500000  0.25000000  0.12500000  1
  P  P21  1  0.62500000  0.37500000  0.25000000  1
  P  P22  1  0.87500000  0.12500000  0.75000000  1
  P  P23  1  0.75000000  0.87500000  0.12500000  1
  P  P24  1  0.75000000  0.37500000  0.62500000  1
  P  P25  1  0.62500000  0.75000000  0.37500000  1
  P  P26  1  0.37500000  0.25000000  0.62500000  1
  P  P27  1  0.25000000  0.62500000  0.37500000  1
  P  P28  1  0.25000000  0.12500000  0.87500000  1
  P  P29  1  0.12500000  0.87500000  0.25000000  1
  P  P30  1  0.37500000  0.62500000  0.75000000  1
  P  P31  1  0.12500000  0.75000000  0.87500000  1
  O  O32  1  0.88690400  0.00302800  0.29775400  1
  O  O33  1  0.88387600  0.38690400  0.08915000  1
  O  O34  1  0.91085000  0.29472600  0.29775400  1
  O  O35  1  0.91085000  0.11612400  0.61309600  1
  O  O36  1  0.99697200  0.70224600  0.11309600  1
  O  O37  1  0.58915000  0.20224600  0.20527400  1
  O  O38  1  0.61612400  0.41085000  0.11309600  1
  O  O39  1  0.20527400  0.11612400  0.00302800  1
  O  O40  1  0.70527400  0.70224600  0.08915000  1
  O  O41  1  0.88690400  0.38387600  0.58915000  1
  O  O42  1  0.61309600  0.20224600  0.49697200  1
  O  O43  1  0.70224600  0.08915000  0.70527400  1
  O  O44  1  0.11612400  0.00302800  0.20527400  1
  O  O45  1  0.79775400  0.50302800  0.38690400  1
  O  O46  1  0.49697200  0.38387600  0.29472600  1
  O  O47  1  0.49697200  0.61309600  0.20224600  1
  O  O48  1  0.41085000  0.11309600  0.61612400  1
  O  O49  1  0.00302800  0.20527400  0.11612400  1
  O  O50  1  0.70224600  0.11309600  0.99697200  1
  O  O51  1  0.38387600  0.29472600  0.49697200  1
  O  O52  1  0.79775400  0.79472600  0.41085000  1
  O  O53  1  0.70527400  0.50302800  0.61612400  1
  O  O54  1  0.61309600  0.91085000  0.11612400  1
  O  O55  1  0.79472600  0.41085000  0.79775400  1
  O  O56  1  0.38690400  0.08915000  0.88387600  1
  O  O57  1  0.20527400  0.58915000  0.20224600  1
  O  O58  1  0.29472600  0.49697200  0.38387600  1
  O  O59  1  0.20224600  0.20527400  0.58915000  1
  O  O60  1  0.29775400  0.88690400  0.00302800  1
  O  O61  1  0.61612400  0.70527400  0.50302800  1
  O  O62  1  0.58915000  0.88690400  0.38387600  1
  O  O63  1  0.99697200  0.79472600  0.88387600  1
  O  O64  1  0.50302800  0.38690400  0.79775400  1
  O  O65  1  0.50302800  0.61612400  0.70527400  1
  O  O66  1  0.88387600  0.99697200  0.79472600  1
  O  O67  1  0.29775400  0.91085000  0.29472600  1
  O  O68  1  0.20224600  0.49697200  0.61309600  1
  O  O69  1  0.11309600  0.61612400  0.41085000  1
  O  O70  1  0.38690400  0.79775400  0.50302800  1
  O  O71  1  0.29472600  0.29775400  0.91085000  1
  O  O72  1  0.79472600  0.88387600  0.99697200  1
  O  O73  1  0.38387600  0.58915000  0.88690400  1
  O  O74  1  0.08915000  0.88387600  0.38690400  1
  O  O75  1  0.41085000  0.79775400  0.79472600  1
  O  O76  1  0.00302800  0.29775400  0.88690400  1
  O  O77  1  0.08915000  0.70527400  0.70224600  1
  O  O78  1  0.11612400  0.61309600  0.91085000  1
  O  O79  1  0.11309600  0.99697200  0.70224600  1
