# generated using pymatgen
data_Li2VCr(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.22518900
_cell_length_b   7.14760300
_cell_length_c   9.73450856
_cell_angle_alpha   68.61791570
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2VCr(P2O7)2
_chemical_formula_sum   'Li4 V2 Cr2 P8 O28'
_cell_volume   532.90433300
_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  0.63733500  0.67666900  0.49965100  1
  Li  Li1  1  0.13733500  0.32333100  0.50034900  1
  Li  Li2  1  0.63732800  0.67577100  0.00116700  1
  Li  Li3  1  0.13732800  0.32422900  0.99883300  1
  V  V4  1  0.00068400  0.72918300  0.49332500  1
  V  V5  1  0.50068400  0.27081700  0.50667500  1
  Cr  Cr6  1  0.99992900  0.72761000  0.99355000  1
  Cr  Cr7  1  0.49992900  0.27239000  0.00645000  1
  P  P8  1  0.21540300  0.91343400  0.68790400  1
  P  P9  1  0.32022100  0.52140200  0.68971400  1
  P  P10  1  0.82022100  0.47859800  0.31028600  1
  P  P11  1  0.21686900  0.91493000  0.18522000  1
  P  P12  1  0.71540300  0.08656600  0.31209600  1
  P  P13  1  0.31939800  0.52310900  0.18798600  1
  P  P14  1  0.81939800  0.47689100  0.81201400  1
  P  P15  1  0.71686900  0.08507000  0.81478000  1
  O  O16  1  0.34765500  0.75315200  0.67086300  1
  O  O17  1  0.06503000  0.91679700  0.59295500  1
  O  O18  1  0.82033400  0.60546900  0.64687100  1
  O  O19  1  0.15601200  0.50503600  0.62134500  1
  O  O20  1  0.46284800  0.48179500  0.60226000  1
  O  O21  1  0.67756800  0.14651900  0.65153600  1
  O  O22  1  0.30321600  0.11463100  0.62732500  1
  O  O23  1  0.80321600  0.88536900  0.37267500  1
  O  O24  1  0.17756800  0.85348100  0.34846400  1
  O  O25  1  0.96284800  0.51820500  0.39774000  1
  O  O26  1  0.65601200  0.49496400  0.37865500  1
  O  O27  1  0.32033400  0.39453100  0.35312900  1
  O  O28  1  0.56503000  0.08320300  0.40704500  1
  O  O29  1  0.84765500  0.24684800  0.32913700  1
  O  O30  1  0.34877500  0.75367300  0.17011500  1
  O  O31  1  0.06653100  0.91728800  0.09161600  1
  O  O32  1  0.82187100  0.60676100  0.14537800  1
  O  O33  1  0.15379500  0.50958100  0.11910700  1
  O  O34  1  0.46174400  0.48160900  0.10179800  1
  O  O35  1  0.67542000  0.14741200  0.14944300  1
  O  O36  1  0.30645400  0.11650000  0.12568200  1
  O  O37  1  0.80645400  0.88350000  0.87431800  1
  O  O38  1  0.17542000  0.85258800  0.85055700  1
  O  O39  1  0.96174400  0.51839100  0.89820200  1
  O  O40  1  0.65379500  0.49041900  0.88089300  1
  O  O41  1  0.32187100  0.39323900  0.85462200  1
  O  O42  1  0.56653100  0.08271200  0.90838400  1
  O  O43  1  0.84877500  0.24632700  0.82988500  1
