# generated using pymatgen
data_LiCrP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.95038200
_cell_length_b   7.18109100
_cell_length_c   9.52197391
_cell_angle_alpha   69.15386242
_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   508.04600414
_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  0.02021000  0.30225100  0.22078300  1
  Li  Li1  1  0.52021000  0.69774900  0.27921700  1
  Li  Li2  1  0.47979000  0.30225100  0.72078300  1
  Li  Li3  1  0.97979000  0.69774900  0.77921700  1
  Cr  Cr4  1  0.99549400  0.74042500  0.24734700  1
  Cr  Cr5  1  0.50450600  0.74042500  0.74734700  1
  Cr  Cr6  1  0.49549400  0.25957500  0.25265300  1
  Cr  Cr7  1  0.00450600  0.25957500  0.75265300  1
  P  P8  1  0.28975600  0.66915000  0.04792300  1
  P  P9  1  0.21024400  0.66915000  0.54792300  1
  P  P10  1  0.78975600  0.33085000  0.45207700  1
  P  P11  1  0.74086300  0.91606700  0.45465300  1
  P  P12  1  0.71024400  0.33085000  0.95207700  1
  P  P13  1  0.24086300  0.08393300  0.04534700  1
  P  P14  1  0.75913700  0.91606700  0.95465300  1
  P  P15  1  0.25913700  0.08393300  0.54534700  1
  O  O16  1  0.60755200  0.37876300  0.39560800  1
  O  O17  1  0.79937100  0.31564400  0.61564800  1
  O  O18  1  0.34073500  0.87991700  0.06395100  1
  O  O19  1  0.92155200  0.45851600  0.34341700  1
  O  O20  1  0.65926500  0.12008300  0.93604900  1
  O  O21  1  0.86551400  0.79975900  0.39955500  1
  O  O22  1  0.71268000  0.80646300  0.62271700  1
  O  O23  1  0.07984700  0.02701500  0.14162800  1
  O  O24  1  0.20062900  0.68435600  0.38435200  1
  O  O25  1  0.07844800  0.54148400  0.65658300  1
  O  O26  1  0.78732000  0.80646300  0.12271700  1
  O  O27  1  0.89244800  0.37876300  0.89560800  1
  O  O28  1  0.63448600  0.79975900  0.89955500  1
  O  O29  1  0.57844800  0.45851600  0.84341700  1
  O  O30  1  0.13448600  0.20024100  0.60044500  1
  O  O31  1  0.36551400  0.20024100  0.10044500  1
  O  O32  1  0.42015300  0.02701500  0.64162800  1
  O  O33  1  0.42155200  0.54148400  0.15658300  1
  O  O34  1  0.29937100  0.68435600  0.88435200  1
  O  O35  1  0.15926500  0.87991700  0.56395100  1
  O  O36  1  0.28732000  0.19353700  0.37728300  1
  O  O37  1  0.21268000  0.19353700  0.87728300  1
  O  O38  1  0.57984700  0.97298500  0.35837200  1
  O  O39  1  0.70062900  0.31564400  0.11564800  1
  O  O40  1  0.92015300  0.97298500  0.85837200  1
  O  O41  1  0.39244800  0.62123700  0.60439200  1
  O  O42  1  0.10755200  0.62123700  0.10439200  1
  O  O43  1  0.84073500  0.12008300  0.43604900  1
