# generated using pymatgen
data_LiCr3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.58265800
_cell_length_b   8.13674800
_cell_length_c   14.66766100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCr3O8
_chemical_formula_sum   'Li4 Cr12 O32'
_cell_volume   666.27382658
_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  0.25000000  0.49937200  0.28505600  1
  Li  Li1  1  0.75000000  0.99937200  0.21494400  1
  Li  Li2  1  0.25000000  0.00062800  0.78505600  1
  Li  Li3  1  0.75000000  0.50062800  0.71494400  1
  Cr  Cr4  1  0.75000000  0.23816800  0.05655200  1
  Cr  Cr5  1  0.75000000  0.64674100  0.08758600  1
  Cr  Cr6  1  0.25000000  0.03162200  0.12194900  1
  Cr  Cr7  1  0.75000000  0.53162200  0.37805100  1
  Cr  Cr8  1  0.25000000  0.14674100  0.41241400  1
  Cr  Cr9  1  0.25000000  0.73816800  0.44344800  1
  Cr  Cr10  1  0.75000000  0.26183200  0.55655200  1
  Cr  Cr11  1  0.75000000  0.85325900  0.58758600  1
  Cr  Cr12  1  0.25000000  0.46837800  0.62194900  1
  Cr  Cr13  1  0.75000000  0.96837800  0.87805100  1
  Cr  Cr14  1  0.25000000  0.35325900  0.91241400  1
  Cr  Cr15  1  0.25000000  0.76183200  0.94344800  1
  O  O16  1  0.25000000  0.97304700  0.01331500  1
  O  O17  1  0.99415900  0.68036600  0.02495200  1
  O  O18  1  0.50584100  0.68036600  0.02495200  1
  O  O19  1  0.75000000  0.45009400  0.12397100  1
  O  O20  1  0.50818900  0.13911500  0.14349400  1
  O  O21  1  0.99181100  0.13911500  0.14349400  1
  O  O22  1  0.75000000  0.76632000  0.17742100  1
  O  O23  1  0.25000000  0.87412700  0.18742000  1
  O  O24  1  0.75000000  0.37412700  0.31258000  1
  O  O25  1  0.25000000  0.26632000  0.32257900  1
  O  O26  1  0.49181100  0.63911500  0.35650600  1
  O  O27  1  0.00818900  0.63911500  0.35650600  1
  O  O28  1  0.25000000  0.95009400  0.37602900  1
  O  O29  1  0.49415900  0.18036600  0.47504800  1
  O  O30  1  0.00584100  0.18036600  0.47504800  1
  O  O31  1  0.75000000  0.47304700  0.48668500  1
  O  O32  1  0.25000000  0.52695300  0.51331500  1
  O  O33  1  0.99415900  0.81963400  0.52495200  1
  O  O34  1  0.50584100  0.81963400  0.52495200  1
  O  O35  1  0.75000000  0.04990600  0.62397100  1
  O  O36  1  0.99181100  0.36088500  0.64349400  1
  O  O37  1  0.50818900  0.36088500  0.64349400  1
  O  O38  1  0.75000000  0.73368000  0.67742100  1
  O  O39  1  0.25000000  0.62587300  0.68742000  1
  O  O40  1  0.75000000  0.12587300  0.81258000  1
  O  O41  1  0.25000000  0.23368000  0.82257900  1
  O  O42  1  0.49181100  0.86088500  0.85650600  1
  O  O43  1  0.00818900  0.86088500  0.85650600  1
  O  O44  1  0.25000000  0.54990600  0.87602900  1
  O  O45  1  0.49415900  0.31963400  0.97504800  1
  O  O46  1  0.00584100  0.31963400  0.97504800  1
  O  O47  1  0.75000000  0.02695300  0.98668500  1
