# generated using pymatgen
data_Li2Cr2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.44121562
_cell_length_b   6.44121562
_cell_length_c   13.92075400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   117.60808351
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Cr2O7
_chemical_formula_sum   'Li8 Cr8 O28'
_cell_volume   511.79954568
_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  0.24498000  0.24498000  0.00000000  1
  Li  Li1  1  0.25502000  0.25502000  0.50000000  1
  Li  Li2  1  0.69054000  0.30946000  0.35751100  1
  Li  Li3  1  0.80946000  0.19054000  0.85751100  1
  Li  Li4  1  0.19054000  0.80946000  0.14248900  1
  Li  Li5  1  0.30946000  0.69054000  0.64248900  1
  Li  Li6  1  0.74498000  0.74498000  0.50000000  1
  Li  Li7  1  0.75502000  0.75502000  0.00000000  1
  Cr  Cr8  1  0.17316900  0.32683100  0.25000000  1
  Cr  Cr9  1  0.32683100  0.17316900  0.75000000  1
  Cr  Cr10  1  0.25179300  0.74820700  0.92052600  1
  Cr  Cr11  1  0.74820700  0.25179300  0.07947400  1
  Cr  Cr12  1  0.75179300  0.24820700  0.57947400  1
  Cr  Cr13  1  0.24820700  0.75179300  0.42052600  1
  Cr  Cr14  1  0.82683100  0.67316900  0.75000000  1
  Cr  Cr15  1  0.67316900  0.82683100  0.25000000  1
  O  O16  1  0.20866200  0.18276800  0.16129900  1
  O  O17  1  0.18276800  0.20866200  0.83870100  1
  O  O18  1  0.55778000  0.03572900  0.14875600  1
  O  O19  1  0.53572900  0.05778000  0.64875600  1
  O  O20  1  0.03572900  0.55778000  0.85124400  1
  O  O21  1  0.05778000  0.53572900  0.35124400  1
  O  O22  1  0.31723200  0.29133800  0.33870100  1
  O  O23  1  0.29133800  0.31723200  0.66129900  1
  O  O24  1  0.63842700  0.36157300  0.49866900  1
  O  O25  1  0.62546000  0.37454000  0.78347800  1
  O  O26  1  0.88444900  0.11555100  0.52482500  1
  O  O27  1  0.12546000  0.87454000  0.71652200  1
  O  O28  1  0.86157300  0.13842700  0.99866900  1
  O  O29  1  0.87454000  0.12546000  0.28347800  1
  O  O30  1  0.36157300  0.63842700  0.50133100  1
  O  O31  1  0.61555100  0.38444900  0.02482500  1
  O  O32  1  0.37454000  0.62546000  0.21652200  1
  O  O33  1  0.11555100  0.88444900  0.47517500  1
  O  O34  1  0.13842700  0.86157300  0.00133100  1
  O  O35  1  0.38444900  0.61555100  0.97517500  1
  O  O36  1  0.70866200  0.68276800  0.33870100  1
  O  O37  1  0.68276800  0.70866200  0.66129900  1
  O  O38  1  0.46427100  0.94222000  0.35124400  1
  O  O39  1  0.44222000  0.96427100  0.85124400  1
  O  O40  1  0.96427100  0.44222000  0.14875600  1
  O  O41  1  0.94222000  0.46427100  0.64875600  1
  O  O42  1  0.81723200  0.79133800  0.16129900  1
  O  O43  1  0.79133800  0.81723200  0.83870100  1
