# generated using pymatgen
data_Li6TiCr3(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.48846556
_cell_length_b   8.56970548
_cell_length_c   8.55075336
_cell_angle_alpha   61.47945348
_cell_angle_beta   61.62668648
_cell_angle_gamma   61.73587734
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6TiCr3(PO4)6
_chemical_formula_sum   'Li6 Ti1 Cr3 P6 O24'
_cell_volume   455.74761445
_cell_formula_units_Z   1
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  0.02709000  0.00555200  0.99731400  1
  Li  Li1  1  0.74923900  0.15255300  0.34931300  1
  Li  Li2  1  0.47434400  0.50359000  0.49639800  1
  Li  Li3  1  0.26504800  0.84555000  0.65799700  1
  Li  Li4  1  0.65838000  0.26419500  0.83991200  1
  Li  Li5  1  0.84226500  0.65936700  0.26193000  1
  Ti  Ti6  1  0.85362900  0.85271300  0.85160700  1
  Cr  Cr7  1  0.14225800  0.14531300  0.13913100  1
  Cr  Cr8  1  0.35832700  0.36129600  0.35541100  1
  Cr  Cr9  1  0.64430900  0.64699200  0.64625600  1
  P  P10  1  0.04959000  0.74930300  0.44699300  1
  P  P11  1  0.44586500  0.05097300  0.74835500  1
  P  P12  1  0.74981400  0.45044300  0.04598400  1
  P  P13  1  0.25082000  0.53905000  0.96048000  1
  P  P14  1  0.54119300  0.96415400  0.25111500  1
  P  P15  1  0.95839300  0.24954700  0.53477800  1
  O  O16  1  0.13180800  0.28678300  0.49828700  1
  O  O17  1  0.29595000  0.51320100  0.12422300  1
  O  O18  1  0.05237600  0.92101800  0.26529800  1
  O  O19  1  0.53170700  0.12430100  0.29315500  1
  O  O20  1  0.23888400  0.59015900  0.43311000  1
  O  O21  1  0.01004600  0.80672400  0.61323800  1
  O  O22  1  0.25762900  0.07620700  0.90753200  1
  O  O23  1  0.45502200  0.23320200  0.57689100  1
  O  O24  1  0.59196300  0.43354800  0.23963000  1
  O  O25  1  0.19978800  0.37865500  0.98985600  1
  O  O26  1  0.08925300  0.73420700  0.93046500  1
  O  O27  1  0.37074900  0.00493500  0.20769400  1
  O  O28  1  0.61322100  0.00639500  0.80912700  1
  O  O29  1  0.90630700  0.25739800  0.07287700  1
  O  O30  1  0.81061500  0.61233600  0.00812600  1
  O  O31  1  0.41301700  0.56290000  0.76838900  1
  O  O32  1  0.56129000  0.77272600  0.41304700  1
  O  O33  1  0.73305900  0.93041200  0.08717200  1
  O  O34  1  0.97232700  0.20071600  0.37736300  1
  O  O35  1  0.76877900  0.41265500  0.56220100  1
  O  O36  1  0.47047200  0.89218500  0.69439000  1
  O  O37  1  0.93262300  0.08727100  0.72974100  1
  O  O38  1  0.69363300  0.47787400  0.88830600  1
  O  O39  1  0.88891700  0.69260400  0.47790900  1
