# generated using pymatgen
data_Li7TiCr3(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.81259552
_cell_length_b   8.81259552
_cell_length_c   8.81259622
_cell_angle_alpha   60.45690458
_cell_angle_beta   60.45690458
_cell_angle_gamma   60.45690413
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li7TiCr3(PO4)6
_chemical_formula_sum   'Li7 Ti1 Cr3 P6 O24'
_cell_volume   488.94422506
_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  0.79847300  0.62875200  0.24834000  1
  Li  Li1  1  0.62875200  0.24834000  0.79847300  1
  Li  Li2  1  0.24834000  0.79847300  0.62875200  1
  Li  Li3  1  0.47457500  0.47457500  0.47457500  1
  Li  Li4  1  0.80079100  0.05908600  0.23597900  1
  Li  Li5  1  0.23597900  0.80079100  0.05908600  1
  Li  Li6  1  0.05908600  0.23597900  0.80079100  1
  Ti  Ti7  1  0.14364900  0.14364900  0.14364900  1
  Cr  Cr8  1  0.85429500  0.85429500  0.85429500  1
  Cr  Cr9  1  0.35266900  0.35266900  0.35266900  1
  Cr  Cr10  1  0.64448700  0.64448700  0.64448700  1
  P  P11  1  0.95436800  0.25381500  0.53786500  1
  P  P12  1  0.53786500  0.95436800  0.25381500  1
  P  P13  1  0.25381500  0.53786500  0.95436800  1
  P  P14  1  0.74824400  0.45598600  0.04543600  1
  P  P15  1  0.45598600  0.04543600  0.74824400  1
  P  P16  1  0.04543600  0.74824400  0.45598600  1
  O  O17  1  0.91172300  0.10234000  0.72866600  1
  O  O18  1  0.00046900  0.20428700  0.37296800  1
  O  O19  1  0.77263300  0.42518300  0.53988600  1
  O  O20  1  0.52773300  0.11413200  0.29019400  1
  O  O21  1  0.72866600  0.91172300  0.10234000  1
  O  O22  1  0.53988600  0.77263300  0.42518300  1
  O  O23  1  0.29019400  0.52773300  0.11413200  1
  O  O24  1  0.42518300  0.53988600  0.77263300  1
  O  O25  1  0.80023700  0.60912000  0.02709500  1
  O  O26  1  0.91309800  0.26554100  0.06270400  1
  O  O27  1  0.11413200  0.29019400  0.52773300  1
  O  O28  1  0.60912000  0.02709500  0.80023700  1
  O  O29  1  0.37296800  0.00046900  0.20428700  1
  O  O30  1  0.87425300  0.71581900  0.48811600  1
  O  O31  1  0.10234000  0.72866600  0.91172300  1
  O  O32  1  0.20428700  0.37296800  0.00046900  1
  O  O33  1  0.58588000  0.43042900  0.22848700  1
  O  O34  1  0.71581900  0.48811600  0.87425300  1
  O  O35  1  0.43042900  0.22848700  0.58588000  1
  O  O36  1  0.26554100  0.06270400  0.91309800  1
  O  O37  1  0.48811600  0.87425300  0.71581900  1
  O  O38  1  0.02709500  0.80023700  0.60912000  1
  O  O39  1  0.22848700  0.58588000  0.43042900  1
  O  O40  1  0.06270400  0.91309800  0.26554100  1
