# generated using pymatgen
data_Li3Ti3(PO4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.17459550
_cell_length_b   10.17459550
_cell_length_c   10.71357675
_cell_angle_alpha   88.74783526
_cell_angle_beta   88.74783526
_cell_angle_gamma   36.99462569
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti3(PO4)4
_chemical_formula_sum   'Li6 Ti6 P8 O32'
_cell_volume   667.20980245
_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  0.79173000  0.07059100  0.47113500  1
  Li  Li1  1  0.07059100  0.79173000  0.97113500  1
  Li  Li2  1  0.92940900  0.20827000  0.02886500  1
  Li  Li3  1  0.20827000  0.92940900  0.52886500  1
  Li  Li4  1  0.40937200  0.59062800  0.25000000  1
  Li  Li5  1  0.59062800  0.40937200  0.75000000  1
  Ti  Ti6  1  0.36583700  0.32499100  0.24848100  1
  Ti  Ti7  1  0.32499100  0.36583700  0.74848100  1
  Ti  Ti8  1  0.50000000  0.00000000  0.00000000  1
  Ti  Ti9  1  0.00000000  0.50000000  0.50000000  1
  Ti  Ti10  1  0.67500900  0.63416300  0.25151900  1
  Ti  Ti11  1  0.63416300  0.67500900  0.75151900  1
  P  P12  1  0.25597900  0.58361600  0.49172300  1
  P  P13  1  0.58361600  0.25597900  0.99172300  1
  P  P14  1  0.81909800  0.78329000  0.24358500  1
  P  P15  1  0.78329000  0.81909800  0.74358500  1
  P  P16  1  0.21671000  0.18090200  0.25641500  1
  P  P17  1  0.18090200  0.21671000  0.75641500  1
  P  P18  1  0.41638400  0.74402100  0.00827700  1
  P  P19  1  0.74402100  0.41638400  0.50827700  1
  O  O20  1  0.18442200  0.78045500  0.46157300  1
  O  O21  1  0.78045500  0.18442200  0.96157300  1
  O  O22  1  0.47046200  0.37557300  0.12007900  1
  O  O23  1  0.42129500  0.40707100  0.38666200  1
  O  O24  1  0.37557300  0.47046200  0.62007900  1
  O  O25  1  0.40707100  0.42129500  0.88666200  1
  O  O26  1  0.05157300  0.65585600  0.49261000  1
  O  O27  1  0.05371700  0.63709200  0.21190000  1
  O  O28  1  0.65585600  0.05157300  0.99261000  1
  O  O29  1  0.67930800  0.01324600  0.27747300  1
  O  O30  1  0.63709200  0.05371700  0.71190000  1
  O  O31  1  0.01324600  0.67930800  0.77747300  1
  O  O32  1  0.22872100  0.27724700  0.36249200  1
  O  O33  1  0.30873800  0.19982400  0.14665000  1
  O  O34  1  0.27724700  0.22872100  0.86249200  1
  O  O35  1  0.19982400  0.30873800  0.64665000  1
  O  O36  1  0.80017600  0.69126200  0.35335000  1
  O  O37  1  0.72275300  0.77127900  0.13750800  1
  O  O38  1  0.69126200  0.80017600  0.85335000  1
  O  O39  1  0.77127900  0.72275300  0.63750800  1
  O  O40  1  0.98675400  0.32069200  0.22252700  1
  O  O41  1  0.36290800  0.94628300  0.28810000  1
  O  O42  1  0.32069200  0.98675400  0.72252700  1
  O  O43  1  0.34414400  0.94842700  0.00739000  1
  O  O44  1  0.94628300  0.36290800  0.78810000  1
  O  O45  1  0.94842700  0.34414400  0.50739000  1
  O  O46  1  0.59292900  0.57870500  0.11333800  1
  O  O47  1  0.62442700  0.52953800  0.37992100  1
  O  O48  1  0.57870500  0.59292900  0.61333800  1
  O  O49  1  0.52953800  0.62442700  0.87992100  1
  O  O50  1  0.21954500  0.81557800  0.03842700  1
  O  O51  1  0.81557800  0.21954500  0.53842700  1
