data_[Gd2V2N4O2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Gd  1.2000  1.8000  1.0750
  V  1.6300  1.3500  0.7775
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.2733]
_cell_length_b [5.3493]
_cell_length_c [5.7620]
_cell_angle_alpha [62.7212]
_cell_angle_beta [64.4416]
_cell_angle_gamma [60.4992]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [GdVN2O]
_chemical_formula_sum '[Gd2 V2 N4 O2]'
_cell_volume [121.2039]
_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
[
  Gd  Gd0  1  0.3771  0.3637  0.8894  1
  Gd  Gd1  1  0.6426  0.6286  0.1105  1
  V  V2  1  0.1394  0.1375  0.5631  1
  V  V3  1  0.8713  0.8167  0.4378  1
  N  N4  1  0.0095  0.8324  0.7319  1
  N  N5  1  0.1743  0.5924  0.2444  1
  N  N6  1  0.5619  0.9871  0.2792  1
  N  N7  1  0.8270  0.4378  0.7197  1
  O  O8  1  0.4114  0.0161  0.7574  1
  O  O9  1  0.9854  0.1877  0.2666  1
]