# generated using pymatgen
data_Li2Cr2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.66700700
_cell_length_b   8.76617294
_cell_length_c   9.75256934
_cell_angle_alpha   76.57657092
_cell_angle_beta   68.85156601
_cell_angle_gamma   71.31317158
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Cr2O7
_chemical_formula_sum   'Li8 Cr8 O28'
_cell_volume   574.03829508
_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  0.04135700  0.26616200  0.35902900  1
  Li  Li1  1  0.01379200  0.09229000  0.72317400  1
  Li  Li2  1  0.53071700  0.20878600  0.17988800  1
  Li  Li3  1  0.51724100  0.60187900  0.21607400  1
  Li  Li4  1  0.48275900  0.39812100  0.78392600  1
  Li  Li5  1  0.46928300  0.79121400  0.82011200  1
  Li  Li6  1  0.98620800  0.90771000  0.27682600  1
  Li  Li7  1  0.95864300  0.73383800  0.64097100  1
  Cr  Cr8  1  0.17390900  0.58848400  0.08713700  1
  Cr  Cr9  1  0.29438000  0.38002100  0.53607000  1
  Cr  Cr10  1  0.21011600  0.14639100  0.98779200  1
  Cr  Cr11  1  0.31878000  0.91245500  0.43732500  1
  Cr  Cr12  1  0.68122000  0.08754500  0.56267500  1
  Cr  Cr13  1  0.78988400  0.85360900  0.01220800  1
  Cr  Cr14  1  0.70562000  0.61997900  0.46393000  1
  Cr  Cr15  1  0.82609100  0.41151600  0.91286300  1
  O  O16  1  0.08702700  0.10843900  0.16289500  1
  O  O17  1  0.19812900  0.40502100  0.17568000  1
  O  O18  1  0.11712800  0.30307100  0.55710400  1
  O  O19  1  0.33341500  0.08666200  0.33329500  1
  O  O20  1  0.24010300  0.69887000  0.16421300  1
  O  O21  1  0.07260200  0.32740700  0.90490200  1
  O  O22  1  0.24550800  0.99563600  0.89982400  1
  O  O23  1  0.13278400  0.86419000  0.43031300  1
  O  O24  1  0.21221800  0.54984900  0.60696200  1
  O  O25  1  0.41117600  0.41151800  0.36011000  1
  O  O26  1  0.46581600  0.24530100  0.62849400  1
  O  O27  1  0.41418700  0.18117900  0.96983200  1
  O  O28  1  0.68458300  0.41509400  0.08591700  1
  O  O29  1  0.72070900  0.06577500  0.39214000  1
  O  O30  1  0.27929100  0.93422500  0.60786000  1
  O  O31  1  0.31541700  0.58490600  0.91408300  1
  O  O32  1  0.58581300  0.81882100  0.03016800  1
  O  O33  1  0.53418400  0.75469900  0.37150600  1
  O  O34  1  0.58882400  0.58848200  0.63989000  1
  O  O35  1  0.78778200  0.45015100  0.39303800  1
  O  O36  1  0.86721600  0.13581000  0.56968700  1
  O  O37  1  0.75449200  0.00436400  0.10017600  1
  O  O38  1  0.92739800  0.67259300  0.09509800  1
  O  O39  1  0.75989700  0.30113000  0.83578700  1
  O  O40  1  0.66658500  0.91333800  0.66670500  1
  O  O41  1  0.88287200  0.69692900  0.44289600  1
  O  O42  1  0.80187100  0.59497900  0.82432000  1
  O  O43  1  0.91297300  0.89156100  0.83710500  1
