# generated using pymatgen
data_Li2Cr3CuO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.90868671
_cell_length_b   5.90868671
_cell_length_c   5.90868670
_cell_angle_alpha   59.47817554
_cell_angle_beta   59.47817554
_cell_angle_gamma   59.47818012
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Cr3CuO8
_chemical_formula_sum   'Li2 Cr3 Cu1 O8'
_cell_volume   144.13595119
_cell_formula_units_Z   1
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  0.12383100  0.12383100  0.12383100  1
  Li  Li1  1  0.49979900  0.49979900  0.49979900  1
  Cr  Cr2  1  0.49848000  0.49848000  0.00703600  1
  Cr  Cr3  1  0.49848000  0.00703600  0.49848000  1
  Cr  Cr4  1  0.00703600  0.49848000  0.49848000  1
  Cu  Cu5  1  0.87900100  0.87900100  0.87900100  1
  O  O6  1  0.25999600  0.25999600  0.25999600  1
  O  O7  1  0.71050500  0.24825200  0.24825200  1
  O  O8  1  0.24825200  0.71050500  0.24825200  1
  O  O9  1  0.24825200  0.24825200  0.71050500  1
  O  O10  1  0.74821600  0.74821600  0.28824300  1
  O  O11  1  0.74821600  0.28824300  0.74821600  1
  O  O12  1  0.28824300  0.74821600  0.74821600  1
  O  O13  1  0.74169300  0.74169300  0.74169300  1
