data_[Cu1H4W1S4N1]
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
  W  2.3600  1.3500  0.7667
  S  2.5800  1.0000  0.8800
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.4791]
_cell_length_b [6.3601]
_cell_length_c [6.4875]
_cell_angle_alpha [82.3348]
_cell_angle_beta [65.3400]
_cell_angle_gamma [65.1032]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [CuH4WS4N]
_chemical_formula_sum '[Cu1 H4 W1 S4 N1]'
_cell_volume [186.1185]
_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
[
  Cu  Cu0  1  0.7453  0.5067  0.5003  1.0
  H  H1  1  0.2890  0.0845  0.0292  1.0
  H  H2  1  0.5336  0.8350  0.0801  1.0
  H  H3  1  0.5751  0.0876  0.0608  1.0
  H  H4  1  0.6307  0.9536  0.8245  1.0
  W  W5  1  0.2444  0.5080  0.5011  1.0
  S  S6  1  0.1269  0.2051  0.5632  1.0
  S  S7  1  0.2959  0.5822  0.8012  1.0
  S  S8  1  0.6678  0.4327  0.1951  1.0
  S  S9  1  0.8844  0.8141  0.4457  1.0
  N  N10  1  0.5071  0.9906  0.9989  1.0
]