data_[Y2N6O28]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4441]
_cell_length_b [9.2270]
_cell_length_c [10.0095]
_cell_angle_alpha [64.6534]
_cell_angle_beta [84.6102]
_cell_angle_gamma [78.3740]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [YN3O14]
_chemical_formula_sum '[Y2 N6 O28]'
_cell_volume [526.8165]
_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
[
  Y  Y0  2  0.2543  0.3671  0.7911  1
  N  N1  2  0.0250  0.3274  0.3806  1
  N  N2  2  0.0325  0.1583  0.0597  1
  N  N3  2  0.4855  0.1684  0.6370  1
  O  O4  2  0.0110  0.3884  0.2396  1
  O  O5  2  0.0320  0.7269  0.2749  1
  O  O6  2  0.0504  0.6946  0.0263  1
  O  O7  2  0.0558  0.9214  0.8255  1
  O  O8  2  0.0948  0.5874  0.5575  1
  O  O9  2  0.1418  0.1996  0.4524  1
  O  O10  2  0.2115  0.1017  0.0177  1
  O  O11  2  0.3590  0.4063  0.9894  1
  O  O12  2  0.3978  0.0962  0.7619  1
  O  O13  2  0.4024  0.9085  0.4260  1
  O  O14  2  0.4179  0.7545  0.0952  1
  O  O15  2  0.4499  0.3241  0.5825  1
  O  O16  2  0.4844  0.5500  0.7304  1
  O  O17  2  0.4983  0.2808  0.1954  1
]