# generated using pymatgen
data_Li3Y(NiO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.27781615
_cell_length_b   10.12237469
_cell_length_c   5.32597971
_cell_angle_alpha   95.99879810
_cell_angle_beta   60.29210108
_cell_angle_gamma   102.16191443
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Y(NiO3)2
_chemical_formula_sum   'Li6 Y2 Ni4 O12'
_cell_volume   241.59019724
_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  0.75063100  0.25013500  0.99811700  1
  Li  Li1  1  0.25140000  0.74991900  0.99767000  1
  Li  Li2  1  0.03402800  0.25034800  0.38900000  1
  Li  Li3  1  0.57752700  0.74972900  0.38879600  1
  Li  Li4  1  0.46585600  0.24956600  0.61103200  1
  Li  Li5  1  0.92270300  0.75048200  0.61151200  1
  Y  Y6  1  0.00290900  0.00007700  0.99459000  1
  Y  Y7  1  0.49686100  0.50004200  0.00589200  1
  Ni  Ni8  1  0.16450300  0.50015100  0.67053500  1
  Ni  Ni9  1  0.83228000  0.50006600  0.33508100  1
  Ni  Ni10  1  0.66751300  0.99993500  0.66533500  1
  Ni  Ni11  1  0.33529000  0.99972100  0.32963800  1
  O  O12  1  0.07130300  0.38479700  0.03156400  1
  O  O13  1  0.60352200  0.88464200  0.96834100  1
  O  O14  1  0.42854800  0.11512200  0.96866400  1
  O  O15  1  0.89671600  0.61534700  0.03167700  1
  O  O16  1  0.02043800  0.11666000  0.64755100  1
  O  O17  1  0.56784100  0.61143800  0.62538000  1
  O  O18  1  0.69303100  0.11111200  0.37554300  1
  O  O19  1  0.16760100  0.61676900  0.35287900  1
  O  O20  1  0.47913200  0.38336100  0.35285000  1
  O  O21  1  0.93163700  0.88873700  0.37527900  1
  O  O22  1  0.80653600  0.38867400  0.62522900  1
  O  O23  1  0.33219700  0.88317200  0.64784700  1
