data_[Cu2H24C4N12O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  H  2.2000  0.2500  0.0000
  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 [P2_1/c]
_cell_length_a [7.5379]
_cell_length_b [9.1351]
_cell_length_c [8.9802]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.4908]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [CuH12C2(NO2)6]
_chemical_formula_sum '[Cu2 H24 C4 N12 O24]'
_cell_volume [575.3813]
_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
[
  Cu  Cu0  2  0.0000  0.0000  0.0000  1
  H  H1  4  0.0958  0.2488  0.9335  1
  H  H2  4  0.2593  0.1714  0.0738  1
  H  H3  4  0.2604  0.5508  0.2264  1
  H  H4  4  0.3062  0.1104  0.8469  1
  H  H5  4  0.4379  0.0327  0.5808  1
  H  H6  4  0.4977  0.7007  0.7896  1
  C  C7  4  0.4282  0.0969  0.6789  1
  N  N8  4  0.2053  0.0039  0.3337  1
  N  N9  4  0.2377  0.7350  0.5319  1
  N  N10  4  0.3313  0.0482  0.7589  1
  O  O11  4  0.0524  0.5488  0.8256  1
  O  O12  4  0.1571  0.6331  0.4297  1
  O  O13  4  0.1575  0.7212  0.1258  1
  O  O14  4  0.2243  0.0338  0.1982  1
  O  O15  4  0.2317  0.2196  0.9698  1
  O  O16  4  0.3933  0.7157  0.0370  1
]