# generated using pymatgen
data_CuH6S2(NO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.78802200
_cell_length_b   5.52165100
_cell_length_c   7.10203526
_cell_angle_alpha   71.61759513
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuH6S2(NO4)2
_chemical_formula_sum   'Cu2 H12 S4 N4 O16'
_cell_volume   550.32048097
_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  1  0.00000000  0.50000000  0.50000000  1.0
  Cu  Cu1  1  0.50000000  0.00000000  0.50000000  1.0
  H  H2  1  0.11226500  0.71056800  0.24381700  1.0
  H  H3  1  0.88773500  0.28943200  0.75618300  1.0
  H  H4  1  0.61226500  0.78943200  0.75618300  1.0
  H  H5  1  0.38773500  0.21056800  0.24381700  1.0
  H  H6  1  0.08307500  0.05751900  0.86396200  1.0
  H  H7  1  0.91692500  0.94248100  0.13603800  1.0
  H  H8  1  0.58307500  0.44248100  0.13603800  1.0
  H  H9  1  0.41692500  0.55751900  0.86396200  1.0
  H  H10  1  0.36886500  0.19230800  0.34609300  1.0
  H  H11  1  0.63113500  0.80769200  0.65390700  1.0
  H  H12  1  0.86886500  0.30769200  0.65390700  1.0
  H  H13  1  0.13113500  0.69230800  0.34609300  1.0
  S  S14  1  0.11896300  0.74503200  0.74732100  1.0
  S  S15  1  0.88103700  0.25496800  0.25267900  1.0
  S  S16  1  0.61896300  0.75496800  0.25267900  1.0
  S  S17  1  0.38103700  0.24503200  0.74732100  1.0
  N  N18  1  0.84849200  0.76041400  0.85652600  1.0
  N  N19  1  0.15150800  0.23958600  0.14347400  1.0
  N  N20  1  0.34849200  0.73958600  0.14347400  1.0
  N  N21  1  0.65150800  0.26041400  0.85652600  1.0
  O  O22  1  0.45254400  0.05400000  0.72602000  1.0
  O  O23  1  0.54745600  0.94600000  0.27398000  1.0
  O  O24  1  0.95254400  0.44600000  0.27398000  1.0
  O  O25  1  0.04745600  0.55400000  0.72602000  1.0
  O  O26  1  0.18042200  0.61128100  0.91435200  1.0
  O  O27  1  0.81957800  0.38871900  0.08564800  1.0
  O  O28  1  0.68042200  0.88871900  0.08564800  1.0
  O  O29  1  0.31957800  0.11128100  0.91435200  1.0
  O  O30  1  0.04877100  0.91968200  0.83699900  1.0
  O  O31  1  0.95122900  0.08031800  0.16300100  1.0
  O  O32  1  0.54877100  0.58031800  0.16300100  1.0
  O  O33  1  0.45122900  0.41968200  0.83699900  1.0
  O  O34  1  0.18648900  0.24234500  0.28736000  1.0
  O  O35  1  0.81351100  0.75765500  0.71264000  1.0
  O  O36  1  0.68648900  0.25765500  0.71264000  1.0
  O  O37  1  0.31351100  0.74234500  0.28736000  1.0