# generated using pymatgen
data_Li3Co2NiO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.85724184
_cell_length_b   11.56038348
_cell_length_c   6.50276876
_cell_angle_alpha   103.38145691
_cell_angle_beta   77.35752615
_cell_angle_gamma   90.09788862
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Co2NiO6
_chemical_formula_sum   'Li6 Co4 Ni2 O12'
_cell_volume   203.62281849
_cell_formula_units_Z   2
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  0.33304200  0.41623400  0.33201300  1
  Li  Li1  1  0.33319500  0.91713100  0.33363000  1
  Li  Li2  1  0.00052000  0.24842200  0.99529100  1
  Li  Li3  1  0.00236300  0.74256100  0.99484600  1
  Li  Li4  1  0.66061400  0.09216700  0.67335100  1
  Li  Li5  1  0.66449100  0.57744900  0.66748500  1
  Co  Co6  1  0.00246200  0.99864300  0.99627400  1
  Co  Co7  1  0.66263600  0.33243500  0.66835400  1
  Co  Co8  1  0.00055300  0.49851500  0.99556200  1
  Co  Co9  1  0.66490500  0.83284600  0.66841400  1
  Ni  Ni10  1  0.33365800  0.66445100  0.32989400  1
  Ni  Ni11  1  0.33152300  0.16520700  0.33271700  1
  O  O12  1  0.50423800  0.11022300  0.99631500  1
  O  O13  1  0.50133800  0.61298300  0.99589300  1
  O  O14  1  0.16063400  0.21901300  0.66763800  1
  O  O15  1  0.16317000  0.72373800  0.66945500  1
  O  O16  1  0.81250700  0.28662100  0.35655500  1
  O  O17  1  0.81537700  0.79175200  0.36562900  1
  O  O18  1  0.85172300  0.04244800  0.30713700  1
  O  O19  1  0.84464000  0.54228100  0.30895800  1
  O  O20  1  0.15713600  0.44811100  0.68090800  1
  O  O21  1  0.15954400  0.94566600  0.68072600  1
  O  O22  1  0.50653200  0.38327300  0.98200100  1
  O  O23  1  0.51064500  0.88222200  0.97850400  1
