data_[Ni9O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.1265]
_cell_length_b [5.9232]
_cell_length_c [6.6422]
_cell_angle_alpha [102.7774]
_cell_angle_beta [97.6257]
_cell_angle_gamma [106.9066]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Ni9O10]
_chemical_formula_sum '[Ni9 O10]'
_cell_volume [183.9532]
_cell_formula_units_Z [1]
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
[
  Ni  Ni0  2  0.1968  0.8932  0.3927  1.0
  Ni  Ni1  2  0.2006  0.4019  0.3908  1.0
  Ni  Ni2  2  0.3866  0.7931  0.8014  1.0
  Ni  Ni3  2  0.4038  0.3047  0.8066  1.0
  Ni  Ni4  1  0.0000  0.0000  0.0000  1.0
  O  O5  2  0.0986  0.9505  0.7003  1.0
  O  O6  2  0.1083  0.4462  0.6804  1.0
  O  O7  2  0.3201  0.3411  0.1053  1.0
  O  O8  2  0.3206  0.8765  0.1100  1.0
  O  O9  2  0.4997  0.2479  0.5050  1.0
]