# generated using pymatgen
data_Li2Mn2NiO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05360104
_cell_length_b   5.06033233
_cell_length_c   10.26233508
_cell_angle_alpha   90.00724128
_cell_angle_beta   90.01456488
_cell_angle_gamma   60.04363531
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Mn2NiO6
_chemical_formula_sum   'Li4 Mn4 Ni2 O12'
_cell_volume   227.37755487
_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  0.66988800  0.50000100  0.25002700  1
  Li  Li1  1  0.33011200  0.49999800  0.74997300  1
  Li  Li2  1  0.83011100  0.50000100  0.74997300  1
  Li  Li3  1  0.16988900  0.49999900  0.25002700  1
  Mn  Mn4  1  0.83687800  0.32624900  0.50000000  1
  Mn  Mn5  1  0.16312300  0.67375200  0.50000100  1
  Mn  Mn6  1  0.33686400  0.32627800  0.00000000  1
  Mn  Mn7  1  0.66313900  0.67372000  0.99999900  1
  Ni  Ni8  1  0.49999500  0.00000400  0.50000000  1
  Ni  Ni9  1  0.99999700  0.99999800  0.99999900  1
  O  O10  1  0.14919700  0.00000200  0.40112000  1
  O  O11  1  0.64929100  0.00000000  0.09884000  1
  O  O12  1  0.85080400  0.99999900  0.59888000  1
  O  O13  1  0.35070900  0.99999900  0.90116000  1
  O  O14  1  0.14187200  0.36162800  0.60471900  1
  O  O15  1  0.49650000  0.36162900  0.39528100  1
  O  O16  1  0.00342800  0.63846300  0.89533300  1
  O  O17  1  0.99657200  0.36153700  0.10466800  1
  O  O18  1  0.64189100  0.36153600  0.89533200  1
  O  O19  1  0.35811000  0.63846300  0.10466900  1
  O  O20  1  0.85812900  0.63837200  0.39528000  1
  O  O21  1  0.50350100  0.63837100  0.60471900  1
