# generated using pymatgen
data_Li3Co2NiO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.95451510
_cell_length_b   9.81459511
_cell_length_c   7.68095928
_cell_angle_alpha   91.77959167
_cell_angle_beta   78.52541000
_cell_angle_gamma   80.97020599
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Co2NiO6
_chemical_formula_sum   'Li6 Co4 Ni2 O12'
_cell_volume   215.12412115
_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  0.08399200  0.25128400  0.58820500  1
  Li  Li1  1  0.58193500  0.74927900  0.08280800  1
  Li  Li2  1  0.24370600  0.75007200  0.75089100  1
  Li  Li3  1  0.75931100  0.24545700  0.23849900  1
  Li  Li4  1  0.92216700  0.74641900  0.41108800  1
  Li  Li5  1  0.40535200  0.25367700  0.92482800  1
  Co  Co6  1  0.49819000  0.49948400  0.49684200  1
  Co  Co7  1  0.66196700  0.99660000  0.66362900  1
  Co  Co8  1  0.00084400  0.00499000  0.00880800  1
  Co  Co9  1  0.17210900  0.50231800  0.15142100  1
  Ni  Ni10  1  0.33375200  0.99482200  0.33169200  1
  Ni  Ni11  1  0.83317800  0.49726500  0.83070100  1
  O  O12  1  0.89526200  0.60575700  0.60333000  1
  O  O13  1  0.38380100  0.12056500  0.12267700  1
  O  O14  1  0.24366400  0.88050500  0.55043600  1
  O  O15  1  0.78700400  0.37992900  0.04966000  1
  O  O16  1  0.70229300  0.10891100  0.47880800  1
  O  O17  1  0.20158000  0.62077300  0.96349100  1
  O  O18  1  0.96182000  0.88188100  0.19299000  1
  O  O19  1  0.46391400  0.38870700  0.69021200  1
  O  O20  1  0.08234100  0.11033000  0.79075400  1
  O  O21  1  0.54122800  0.60885100  0.29854600  1
  O  O22  1  0.62934900  0.89168000  0.85800700  1
  O  O23  1  0.10307000  0.39605900  0.38484600  1
