# generated using pymatgen
data_Co2Cu3(CN)12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.13749200
_cell_length_b   7.13749200
_cell_length_c   10.17518700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2Cu3(CN)12
_chemical_formula_sum   'Co2 Cu3 C12 N12'
_cell_volume   518.36261060
_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
  Co  Co0  1  0.50000000  0.00000000  0.75064400  1.0
  Co  Co1  1  0.00000000  0.50000000  0.24935600  1.0
  Cu  Cu2  1  0.50000000  0.00000000  0.24665300  1.0
  Cu  Cu3  1  0.00000000  0.50000000  0.75334700  1.0
  Cu  Cu4  1  0.50000000  0.50000000  0.50000000  1.0
  C  C5  1  0.18423300  0.68391600  0.24961100  1.0
  C  C6  1  0.68391600  0.18423300  0.75038900  1.0
  C  C7  1  0.50000000  0.00000000  0.56727800  1.0
  C  C8  1  0.00000000  0.50000000  0.06594300  1.0
  C  C9  1  0.81576700  0.68391600  0.24961100  1.0
  C  C10  1  0.31608400  0.18423300  0.75038900  1.0
  C  C11  1  0.50000000  0.00000000  0.93405700  1.0
  C  C12  1  0.00000000  0.50000000  0.43272200  1.0
  C  C13  1  0.18423300  0.31608400  0.24961100  1.0
  C  C14  1  0.68391600  0.81576700  0.75038900  1.0
  C  C15  1  0.81576700  0.31608400  0.24961100  1.0
  C  C16  1  0.31608400  0.81576700  0.75038900  1.0
  N  N17  1  0.30167400  0.79772600  0.25220200  1.0
  N  N18  1  0.79772600  0.30167400  0.74779800  1.0
  N  N19  1  0.50000000  0.00000000  0.45223900  1.0
  N  N20  1  0.00000000  0.50000000  0.95142400  1.0
  N  N21  1  0.69832600  0.79772600  0.25220200  1.0
  N  N22  1  0.20227400  0.30167400  0.74779800  1.0
  N  N23  1  0.50000000  0.00000000  0.04857600  1.0
  N  N24  1  0.00000000  0.50000000  0.54776100  1.0
  N  N25  1  0.30167400  0.20227400  0.25220200  1.0
  N  N26  1  0.79772600  0.69832600  0.74779800  1.0
  N  N27  1  0.69832600  0.20227400  0.25220200  1.0
  N  N28  1  0.20227400  0.69832600  0.74779800  1.0