data_[H10C2N2O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [Pc]
_cell_length_a [3.9061]
_cell_length_b [4.7236]
_cell_length_c [9.1825]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.8893]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [7]
_chemical_formula_structural [H5CNO2]
_chemical_formula_sum '[H10 C2 N2 O4]'
_cell_volume [169.2101]
_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
[
  H  H0  2  0.1447  0.1069  0.0990  1.0
  H  H1  2  0.1640  0.0365  0.9162  1.0
  H  H2  2  0.5055  0.4546  0.7294  1.0
  H  H3  2  0.8364  0.0927  0.5044  1.0
  H  H4  2  0.8557  0.2641  0.9755  1.0
  C  C5  2  0.5004  0.3707  0.3106  1.0
  N  N6  2  0.0004  0.0811  0.0001  1.0
  O  O7  2  0.3759  0.1347  0.2671  1.0
  O  O8  2  0.6198  0.4222  0.4392  1.0
]