# generated using pymatgen
data_LiCrP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.07913200
_cell_length_b   6.75252600
_cell_length_c   9.35655471
_cell_angle_alpha   72.30732744
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCrP2O7
_chemical_formula_sum   'Li4 Cr4 P8 O28'
_cell_volume   486.29886690
_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  0.88600500  0.78459000  0.54479700  1
  Li  Li1  1  0.11399500  0.21541000  0.45520300  1
  Li  Li2  1  0.38600500  0.21541000  0.95520300  1
  Li  Li3  1  0.61399500  0.78459000  0.04479700  1
  Cr  Cr4  1  0.77436700  0.28059200  0.00436700  1
  Cr  Cr5  1  0.72563300  0.28059200  0.50436700  1
  Cr  Cr6  1  0.27436700  0.71940800  0.49563300  1
  Cr  Cr7  1  0.22563300  0.71940800  0.99563300  1
  P  P8  1  0.08505500  0.46364000  0.79681700  1
  P  P9  1  0.91494500  0.53636000  0.20318300  1
  P  P10  1  0.41494500  0.46364000  0.29681700  1
  P  P11  1  0.96301400  0.05365400  0.79335300  1
  P  P12  1  0.46301400  0.94634600  0.70664700  1
  P  P13  1  0.03698600  0.94634600  0.20664700  1
  P  P14  1  0.53698600  0.05365400  0.29335300  1
  P  P15  1  0.58505500  0.53636000  0.70318300  1
  O  O16  1  0.41410600  0.60526900  0.13313900  1
  O  O17  1  0.68076200  0.07146100  0.39612400  1
  O  O18  1  0.94539100  0.15111100  0.15138800  1
  O  O19  1  0.59020500  0.09077000  0.12780400  1
  O  O20  1  0.40979500  0.90923000  0.87219600  1
  O  O21  1  0.05460900  0.84888900  0.84861200  1
  O  O22  1  0.31923800  0.92853900  0.60387600  1
  O  O23  1  0.60585600  0.77351300  0.70955100  1
  O  O24  1  0.09020500  0.90923000  0.37219600  1
  O  O25  1  0.44539100  0.84888900  0.34861200  1
  O  O26  1  0.18076200  0.92853900  0.10387600  1
  O  O27  1  0.08589400  0.60526900  0.63313900  1
  O  O28  1  0.23416500  0.48987900  0.89225100  1
  O  O29  1  0.89414400  0.77351300  0.20955100  1
  O  O30  1  0.91653200  0.47451800  0.86533900  1
  O  O31  1  0.90979500  0.09077000  0.62780400  1
  O  O32  1  0.73416500  0.51012100  0.60774900  1
  O  O33  1  0.58589400  0.39473100  0.86686100  1
  O  O34  1  0.41653200  0.52548200  0.63466100  1
  O  O35  1  0.26583500  0.48987900  0.39225100  1
  O  O36  1  0.58346800  0.47451800  0.36533900  1
  O  O37  1  0.08346800  0.52548200  0.13466100  1
  O  O38  1  0.10585600  0.22648700  0.79044900  1
  O  O39  1  0.76583500  0.51012100  0.10774900  1
  O  O40  1  0.91410600  0.39473100  0.36686100  1
  O  O41  1  0.81923800  0.07146100  0.89612400  1
  O  O42  1  0.55460900  0.15111100  0.65138800  1
  O  O43  1  0.39414400  0.22648700  0.29044900  1
