# generated using pymatgen
data_Mg(NiO2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97789309
_cell_length_b   4.97789309
_cell_length_c   9.34475300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   146.06313743
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg(NiO2)2
_chemical_formula_sum   'Mg2 Ni4 O8'
_cell_volume   129.27372069
_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
  Mg  Mg0  1  0.60763500  0.39236500  0.75000000  1.0
  Mg  Mg1  1  0.39236500  0.60763500  0.25000000  1.0
  Ni  Ni2  1  0.13459400  0.86540600  0.06978600  1.0
  Ni  Ni3  1  0.86540600  0.13459400  0.93021400  1.0
  Ni  Ni4  1  0.13459400  0.86540600  0.43021400  1.0
  Ni  Ni5  1  0.86540600  0.13459400  0.56978600  1.0
  O  O6  1  0.77567300  0.22432700  0.38610500  1.0
  O  O7  1  0.22432700  0.77567300  0.61389500  1.0
  O  O8  1  0.22432700  0.77567300  0.88610500  1.0
  O  O9  1  0.77567300  0.22432700  0.11389500  1.0
  O  O10  1  0.04217600  0.95782400  0.25000000  1.0
  O  O11  1  0.95782400  0.04217600  0.75000000  1.0
  O  O12  1  0.50000000  0.50000000  0.00000000  1.0
  O  O13  1  0.50000000  0.50000000  0.50000000  1.0