# generated using pymatgen
data_Fe2CoH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.89045110
_cell_length_b   10.88294489
_cell_length_c   10.87712195
_cell_angle_alpha   89.21990527
_cell_angle_beta   89.03160732
_cell_angle_gamma   63.69968709
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2CoH8C14(NO)6
_chemical_formula_sum   'Fe4 Co2 H16 C28 N12 O12'
_cell_volume   1155.51787058
_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
  Fe  Fe0  1  0.89912722  0.09985683  0.24782362  1
  Fe  Fe1  1  0.10087200  0.90014519  0.75217440  1
  Co  Co2  1  0.85858686  0.98502074  -0.00573934  1
  Fe  Fe3  1  0.00624322  0.14288661  0.50376492  1
  Co  Co4  1  0.14141313  0.01497705  1.00574069  1
  Fe  Fe5  1  0.99375389  0.85711800  0.49623393  1
  H  H6  1  0.53728629  0.16856418  0.41267369  1
  H  H7  1  0.82989840  0.46254803  0.08674582  1
  H  H8  1  0.46271673  0.83142498  0.58732871  1
  H  H9  1  0.17010611  0.53745268  0.91325084  1
  H  H10  1  0.33279804  0.15573602  0.50987895  1
  H  H11  1  0.84119472  0.66644077  0.98756078  1
  H  H12  1  0.66720055  0.84426238  0.49012388  1
  H  H13  1  0.15881390  0.33355911  0.01243747  1
  H  H14  1  0.42587844  0.07636051  0.05618601  1
  H  H15  1  0.92807918  0.57473273  0.44007842  1
  H  H16  1  0.57411795  0.92363530  0.94381579  1
  H  H17  1  0.07191253  0.42527283  0.55992241  1
  H  H18  1  0.87522564  0.21225537  0.03094922  1
  H  H19  1  0.78130428  0.11828692  0.46243004  1
  H  H20  1  0.12477807  0.78774440  0.96904915  1
  H  H21  1  0.21869330  0.88171706  0.53756700  1
  C  C22  1  0.62347201  0.11915244  0.17345734  1
  C  C23  1  0.88147952  0.37732154  0.32568470  1
  C  C24  1  0.37653141  0.88083916  0.82654562  1
  C  C25  1  0.11851578  0.62268335  0.67431342  1
  C  C26  1  0.49700715  0.11835874  0.22927160  1
  C  C27  1  0.88160030  0.50346142  0.26896951  1
  C  C28  1  0.50299382  0.88163415  0.77072989  1
  C  C29  1  0.11839699  0.49654275  0.73102888  1
  C  C30  1  0.46883747  0.14385434  0.35693674  1
  C  C31  1  0.85465739  0.53164000  0.14163653  1
  C  C32  1  0.53116470  0.85613707  0.64306426  1
  C  C33  1  0.14534490  0.46836179  0.85836091  1
  C  C34  1  0.35530180  0.13776859  0.41205889  1
  C  C35  1  0.85981102  0.64519926  0.08547994  1
  C  C36  1  0.64469703  0.86222728  0.58794323  1
  C  C37  1  0.14019476  0.35480151  0.91451894  1
  C  C38  1  0.26976643  0.10703371  0.33707440  1
  C  C39  1  0.89072738  0.73185325  0.15933380  1
  C  C40  1  0.73023003  0.89296613  0.66292870  1
  C  C41  1  0.10927901  0.26814592  0.84066591  1
  C  C42  1  0.29580218  0.08404928  0.21035224  1
  C  C43  1  0.91576162  0.70479544  0.28539792  1
  C  C44  1  0.70419617  0.91594952  0.78965123  1
  C  C45  1  0.08423764  0.29520670  0.71460262  1
  C  C46  1  0.40857891  0.09147448  0.15463838  1
  C  C47  1  0.91006733  0.59206533  0.34210233  1
  C  C48  1  0.59142084  0.90852023  0.84536384  1
  C  C49  1  0.08992781  0.40793879  0.65789820  1
  N  N50  1  0.15747679  0.08500254  0.36389679  1
  N  N51  1  0.91281681  0.84502206  0.13310791  1
  N  N52  1  0.84251612  0.91500248  0.63610020  1
  N  N53  1  0.08719369  0.15497475  0.86689092  1
  N  N54  1  0.12182688  0.04139349  0.26240604  1
  N  N55  1  0.95892147  0.87859704  0.23375550  1
  N  N56  1  0.87816697  0.95861572  0.73758885  1
  N  N57  1  0.04108454  0.12140127  0.76624408  1
  N  N58  1  0.19761746  0.04856498  0.16699686  1
  N  N59  1  0.95312469  0.80178566  0.32861920  1
  N  N60  1  0.80238079  0.95144059  0.83299965  1
  N  N61  1  0.04687494  0.19821650  0.67138189  1
  O  O62  1  0.92540990  0.11805197  0.05963976  1
  O  O63  1  0.87812426  0.06988373  0.44094887  1
  O  O64  1  0.07459092  0.88194670  0.94035707  1
  O  O65  1  0.12187358  0.93012093  0.55904963  1
  O  O66  1  0.69418426  0.15203858  0.24607275  1
  O  O67  1  0.84555912  0.30709040  0.25536296  1
  O  O68  1  0.30581644  0.84795641  0.75393002  1
  O  O69  1  0.15443719  0.69291351  0.74463544  1
  O  O70  1  0.65101970  0.08536710  0.06082306  1
  O  O71  1  0.91974211  0.34792082  0.43712261  1
  O  O72  1  0.34898783  0.91462129  0.93918109  1
  O  O73  1  0.08025218  0.65208439  0.56287687  1
