# generated using pymatgen
data_Mg(NiO2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.80392509
_cell_length_b   5.80392509
_cell_length_c   5.82268411
_cell_angle_alpha   59.74329523
_cell_angle_beta   59.74329523
_cell_angle_gamma   59.95344593
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg(NiO2)2
_chemical_formula_sum   'Mg2 Ni4 O8'
_cell_volume   138.10326624
_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  0.87866780  0.87866780  0.36669240  1.0
  Mg  Mg1  1  0.12133220  0.12133220  0.63330760  1.0
  Ni  Ni2  1  0.50000000  0.50000000  0.50000000  1.0
  Ni  Ni3  1  -0.00000000  0.50000000  0.00000000  1.0
  Ni  Ni4  1  0.50000000  -0.00000000  0.00000000  1.0
  Ni  Ni5  1  0.50000000  0.50000000  0.00000000  1.0
  O  O6  1  0.70437905  0.26057820  0.75451504  1.0
  O  O7  1  0.26057820  0.70437905  0.75451504  1.0
  O  O8  1  0.24301782  0.24301782  0.80257943  1.0
  O  O9  1  0.72652331  0.72652331  0.77494252  1.0
  O  O10  1  0.75698218  0.75698218  0.19742057  1.0
  O  O11  1  0.73942180  0.29562095  0.24548496  1.0
  O  O12  1  0.27347669  0.27347669  0.22505748  1.0
  O  O13  1  0.29562095  0.73942180  0.24548496  1.0