# generated using pymatgen
data_Li2Cr2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.07895400
_cell_length_b   7.63595346
_cell_length_c   12.97772033
_cell_angle_alpha   89.74495540
_cell_angle_beta   79.13282283
_cell_angle_gamma   89.33944414
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Cr2O7
_chemical_formula_sum   'Li8 Cr8 O28'
_cell_volume   591.56377747
_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  0.91730200  0.19308400  0.83996900  1
  Li  Li1  1  0.38578000  0.87945800  0.84472600  1
  Li  Li2  1  0.80614500  0.56705200  0.67759200  1
  Li  Li3  1  0.22947100  0.24978000  0.58354400  1
  Li  Li4  1  0.77052900  0.75022000  0.41645600  1
  Li  Li5  1  0.19385500  0.43294800  0.32240800  1
  Li  Li6  1  0.61422000  0.12054200  0.15527400  1
  Li  Li7  1  0.08269800  0.80691600  0.16003100  1
  Cr  Cr8  1  0.88234600  0.64799300  0.89160500  1
  Cr  Cr9  1  0.40924700  0.27506000  0.88420800  1
  Cr  Cr10  1  0.74868000  0.05638600  0.61602800  1
  Cr  Cr11  1  0.30171900  0.67093200  0.58527300  1
  Cr  Cr12  1  0.69828100  0.32906800  0.41472700  1
  Cr  Cr13  1  0.25132000  0.94361400  0.38397200  1
  Cr  Cr14  1  0.59075300  0.72494000  0.11579200  1
  Cr  Cr15  1  0.11765400  0.35200700  0.10839500  1
  O  O16  1  0.27305500  0.41872400  0.98472000  1
  O  O17  1  0.61031300  0.16547000  0.92478000  1
  O  O18  1  0.09357200  0.76600300  0.90981700  1
  O  O19  1  0.96268400  0.47190900  0.82172200  1
  O  O20  1  0.71371700  0.76178700  0.83129200  1
  O  O21  1  0.22276600  0.13343200  0.85914100  1
  O  O22  1  0.51350900  0.39062900  0.78195300  1
  O  O23  1  0.54559100  0.99712800  0.70829600  1
  O  O24  1  0.94477600  0.14544300  0.67174800  1
  O  O25  1  0.19071400  0.80264600  0.67765700  1
  O  O26  1  0.54134600  0.59818500  0.60705700  1
  O  O27  1  0.83596200  0.88239300  0.54630900  1
  O  O28  1  0.62599100  0.21255700  0.53890000  1
  O  O29  1  0.12474000  0.50617500  0.58542300  1
  O  O30  1  0.87526000  0.49382500  0.41457700  1
  O  O31  1  0.37400900  0.78744300  0.46110000  1
  O  O32  1  0.16403800  0.11760700  0.45369100  1
  O  O33  1  0.45865400  0.40181500  0.39294300  1
  O  O34  1  0.80928600  0.19735400  0.32234300  1
  O  O35  1  0.05522400  0.85455700  0.32825200  1
  O  O36  1  0.45440900  0.00287200  0.29170400  1
  O  O37  1  0.48649100  0.60937100  0.21804700  1
  O  O38  1  0.77723400  0.86656800  0.14085900  1
  O  O39  1  0.28628300  0.23821300  0.16870800  1
  O  O40  1  0.03731600  0.52809100  0.17827800  1
  O  O41  1  0.90642800  0.23399700  0.09018300  1
  O  O42  1  0.38968700  0.83453000  0.07522000  1
  O  O43  1  0.72694500  0.58127600  0.01528000  1
