# generated using pymatgen
data_VCrCoH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.86361108
_cell_length_b   10.85882373
_cell_length_c   10.85090282
_cell_angle_alpha   89.25462669
_cell_angle_beta   89.04717117
_cell_angle_gamma   63.79048480
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCrCoH8C14(NO)6
_chemical_formula_sum   'V2 Cr2 Co2 H16 C28 N12 O12'
_cell_volume   1148.24925723
_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
  Cr  Cr0  1  0.90526374  0.09620517  0.25341784  1
  Cr  Cr1  1  0.09473411  0.90379791  0.74657977  1
  V  V2  1  0.85412656  0.98620786  -0.00104442  1
  Co  Co3  1  0.01657914  0.14478675  0.50720689  1
  V  V4  1  0.14587511  0.01379110  1.00104412  1
  Co  Co5  1  0.98341599  0.85521790  0.49279406  1
  H  H6  1  0.53627215  0.16784791  0.41499941  1
  H  H7  1  0.83052547  0.46379333  0.08616163  1
  H  H8  1  0.46372986  0.83214200  0.58500617  1
  H  H9  1  0.16948000  0.53620812  0.91383562  1
  H  H10  1  0.33238217  0.15477150  0.51183976  1
  H  H11  1  0.84290645  0.66743219  0.98815031  1
  H  H12  1  0.66761289  0.84522742  0.48816113  1
  H  H13  1  0.15710010  0.33256966  0.01184783  1
  H  H14  1  0.42530065  0.07363120  0.05775645  1
  H  H15  1  0.92994304  0.57535945  0.44087211  1
  H  H16  1  0.57470134  0.92636637  0.94224528  1
  H  H17  1  0.07004915  0.42464623  0.55912864  1
  H  H18  1  0.87726367  0.21118769  0.04159482  1
  H  H19  1  0.79080437  0.12317790  0.45794582  1
  H  H20  1  0.12273771  0.78881290  0.95840287  1
  H  H21  1  0.20919357  0.87682660  0.54205214  1
  C  C22  1  0.62475801  0.11673143  0.17577234  1
  C  C23  1  0.88405051  0.37567900  0.32551962  1
  C  C24  1  0.37524441  0.88325763  0.82423107  1
  C  C25  1  0.11594567  0.62432499  0.67447844  1
  C  C26  1  0.49777380  0.11727050  0.23054196  1
  C  C27  1  0.88338947  0.50301064  0.26931354  1
  C  C28  1  0.50222815  0.88272125  0.76946190  1
  C  C29  1  0.11660927  0.49699288  0.73068529  1
  C  C30  1  0.46787346  0.14340879  0.35855704  1
  C  C31  1  0.85605273  0.53201784  0.14194462  1
  C  C32  1  0.53212846  0.85658313  0.64144651  1
  C  C33  1  0.14395100  0.46798423  0.85805347  1
  C  C34  1  0.35397930  0.13713384  0.41354514  1
  C  C35  1  0.86167822  0.64594188  0.08611644  1
  C  C36  1  0.64601881  0.86286299  0.58645646  1
  C  C37  1  0.13832676  0.35405974  0.91388218  1
  C  C38  1  0.26688189  0.10631602  0.33897090  1
  C  C39  1  0.89365685  0.73227820  0.15983540  1
  C  C40  1  0.73311614  0.89368340  0.66102870  1
  C  C41  1  0.10634793  0.26772257  0.84016386  1
  C  C42  1  0.29360229  0.08410841  0.21211888  1
  C  C43  1  0.91843478  0.70646655  0.28618606  1
  C  C44  1  0.70639850  0.91588829  0.78788135  1
  C  C45  1  0.08156350  0.29353758  0.71381461  1
  C  C46  1  0.40778505  0.09014631  0.15630597  1
  C  C47  1  0.91208100  0.59233857  0.34256700  1
  C  C48  1  0.59221708  0.90984860  0.84369588  1
  C  C49  1  0.08791548  0.40766520  0.65743300  1
  N  N50  1  0.15073221  0.08896555  0.36586792  1
  N  N51  1  0.90805521  0.84974016  0.13339942  1
  N  N52  1  0.84926331  0.91103894  0.63413050  1
  N  N53  1  0.09195495  0.15025737  0.86659927  1
  N  N54  1  0.10661435  0.05639159  0.26301085  1
  N  N55  1  0.94486312  0.89290665  0.23918041  1
  N  N56  1  0.89338087  0.94361375  0.73698743  1
  N  N57  1  0.05514142  0.10709371  0.76081968  1
  N  N58  1  0.19067163  0.05666329  0.16582306  1
  N  N59  1  0.94733800  0.80922546  0.33147187  1
  N  N60  1  0.80932658  0.94333866  0.83417613  1
  N  N61  1  0.05266008  0.19077783  0.66852906  1
  O  O62  1  0.92881706  0.11379118  0.06248532  1
  O  O63  1  0.88680571  0.07408278  0.43244108  1
  O  O64  1  0.07118377  0.88620918  0.93751211  1
  O  O65  1  0.11319217  0.92592194  0.56755659  1
  O  O66  1  0.70061650  0.14644835  0.24674381  1
  O  O67  1  0.85482300  0.29935809  0.25272021  1
  O  O68  1  0.29938397  0.85354823  0.75325519  1
  O  O69  1  0.14517367  0.70064620  0.74727661  1
  O  O70  1  0.65221800  0.08585839  0.06124501  1
  O  O71  1  0.91382682  0.35087976  0.43826975  1
  O  O72  1  0.34778550  0.91412361  0.93875901  1
  O  O73  1  0.08616683  0.64912453  0.56172830  1
