# generated using pymatgen
data_Cu3Ni(CO5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.95936400
_cell_length_b   3.03280200
_cell_length_c   12.35641585
_cell_angle_alpha   83.55921040
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu3Ni(CO5)2
_chemical_formula_sum   'Cu6 Ni2 C4 O20'
_cell_volume   333.62910958
_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  0.49826800  0.98397500  0.03339700  1.0
  Cu  Cu1  1  0.99826800  0.01602500  0.96660300  1.0
  Cu  Cu2  1  0.49882100  0.52083500  0.46495100  1.0
  Cu  Cu3  1  0.99882100  0.47916500  0.53504900  1.0
  Cu  Cu4  1  0.26803600  0.54783800  0.86748200  1.0
  Cu  Cu5  1  0.76803600  0.45216200  0.13251800  1.0
  Ni  Ni6  1  0.73318900  0.96240000  0.63082100  1.0
  Ni  Ni7  1  0.23318900  0.03760000  0.36917900  1.0
  C  C8  1  0.22475300  0.26630400  0.12183600  1.0
  C  C9  1  0.72475300  0.73369600  0.87816400  1.0
  C  C10  1  0.77502000  0.23913200  0.38281600  1.0
  C  C11  1  0.27502000  0.76086800  0.61718400  1.0
  O  O12  1  0.15271400  0.36534200  0.02818800  1.0
  O  O13  1  0.65271400  0.63465800  0.97181200  1.0
  O  O14  1  0.84313100  0.12767800  0.47803500  1.0
  O  O15  1  0.34313100  0.87232200  0.52196500  1.0
  O  O16  1  0.15701600  0.13737800  0.20783100  1.0
  O  O17  1  0.65701600  0.86262200  0.79216900  1.0
  O  O18  1  0.84793100  0.36193600  0.29891800  1.0
  O  O19  1  0.34793100  0.63806400  0.70108200  1.0
  O  O20  1  0.37001900  0.33118100  0.11677600  1.0
  O  O21  1  0.87001900  0.66881900  0.88322400  1.0
  O  O22  1  0.62947600  0.18894800  0.38297200  1.0
  O  O23  1  0.12947600  0.81105200  0.61702800  1.0
  O  O24  1  0.13544500  0.05339600  0.84693000  1.0
  O  O25  1  0.63544500  0.94660400  0.15307000  1.0
  O  O26  1  0.86897700  0.44998800  0.65489700  1.0
  O  O27  1  0.36897700  0.55001200  0.34510300  1.0
  O  O28  1  0.39181900  0.03567300  0.90319600  1.0
  O  O29  1  0.89181900  0.96432700  0.09680400  1.0
  O  O30  1  0.60538500  0.47517100  0.59341600  1.0
  O  O31  1  0.10538500  0.52482900  0.40658400  1.0