data_[Zn1C1N4O1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  C  2.5500  0.7000  0.3000
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [6.0413]
_cell_length_b [3.2254]
_cell_length_c [6.8176]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.9152]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [ZnCN4O]
_chemical_formula_sum '[Zn1 C1 N4 O1]'
_cell_volume [121.4386]
_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
[
  Zn  Zn0  1  0.6013  0.0000  0.7266  1
  C  C1  1  0.9948  0.5000  0.6940  1
  N  N2  1  0.1333  0.5000  0.5998  1
  N  N3  1  0.5466  0.0000  0.2766  1
  N  N4  1  0.6373  0.0000  0.1633  1
  N  N5  1  0.8223  0.5000  0.7461  1
  O  O6  1  0.3883  0.5000  0.7130  1
]