# generated using pymatgen
data_Li6NiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.66485601
_cell_length_b   9.33491089
_cell_length_c   9.33114068
_cell_angle_alpha   90.68976764
_cell_angle_beta   89.99411514
_cell_angle_gamma   89.99685817
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6NiO4
_chemical_formula_sum   'Li24 Ni4 O16'
_cell_volume   406.30454559
_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  0.70023500  0.25174600  0.99830500  1
  Li  Li1  1  0.70021500  0.74825500  0.50172100  1
  Li  Li2  1  0.20040600  0.25232300  0.99772400  1
  Li  Li3  1  0.20040600  0.74769100  0.50230900  1
  Li  Li4  1  0.30160300  0.75248700  0.00239900  1
  Li  Li5  1  0.30152000  0.24751700  0.49756400  1
  Li  Li6  1  0.80144600  0.75188100  0.00182300  1
  Li  Li7  1  0.80154100  0.24812200  0.49814000  1
  Li  Li8  1  0.74796900  0.28170800  0.24903800  1
  Li  Li9  1  0.74861800  0.78171000  0.75210200  1
  Li  Li10  1  0.74864400  0.49786500  0.46827500  1
  Li  Li11  1  0.74819400  0.00107000  0.96839800  1
  Li  Li12  1  0.74855900  0.50210900  0.03165400  1
  Li  Li13  1  0.74819800  0.99895400  0.53166500  1
  Li  Li14  1  0.74795500  0.71835500  0.25096000  1
  Li  Li15  1  0.74867600  0.21819000  0.74787300  1
  Li  Li16  1  0.24841600  0.28161900  0.74715000  1
  Li  Li17  1  0.25256600  0.78163800  0.25184800  1
  Li  Li18  1  0.24839000  0.50287100  0.96820700  1
  Li  Li19  1  0.25277700  0.99809800  0.46826500  1
  Li  Li20  1  0.24834500  0.49708600  0.53168100  1
  Li  Li21  1  0.25278300  0.00192300  0.03182200  1
  Li  Li22  1  0.24844700  0.71833000  0.75282600  1
  Li  Li23  1  0.25252800  0.21848200  0.24814900  1
  Ni  Ni24  1  0.76542100  0.00013500  0.25006400  1
  Ni  Ni25  1  0.23905400  0.50019100  0.24996800  1
  Ni  Ni26  1  0.23890800  0.99992200  0.75012500  1
  Ni  Ni27  1  0.74083300  0.50001900  0.74995500  1
  O  O28  1  0.96043500  0.13464800  0.11541600  1
  O  O29  1  0.96250000  0.62944900  0.62059500  1
  O  O30  1  0.96253300  0.37050200  0.87938100  1
  O  O31  1  0.96046000  0.86531500  0.38459100  1
  O  O32  1  0.46295000  0.13131100  0.87937600  1
  O  O33  1  0.46289400  0.62925700  0.38141100  1
  O  O34  1  0.46280600  0.37083600  0.11858700  1
  O  O35  1  0.46286700  0.86870800  0.62070200  1
  O  O36  1  0.04057500  0.63448800  0.11767300  1
  O  O37  1  0.04071800  0.13210500  0.61556600  1
  O  O38  1  0.04062200  0.86781300  0.88455000  1
  O  O39  1  0.04071400  0.36566300  0.38218900  1
  O  O40  1  0.53830500  0.87109900  0.12119600  1
  O  O41  1  0.54028200  0.36556900  0.61563300  1
  O  O42  1  0.54037600  0.63435700  0.88430300  1
  O  O43  1  0.53830600  0.12894600  0.37882700  1
