# generated using pymatgen
data_MnVFeH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.90862253
_cell_length_b   10.89954807
_cell_length_c   10.89863806
_cell_angle_alpha   89.22262999
_cell_angle_beta   89.02592524
_cell_angle_gamma   63.62348833
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVFeH8C14(NO)6
_chemical_formula_sum   'Mn2 V2 Fe2 H16 C28 N12 O12'
_cell_volume   1160.73930355
_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  0.90629535  0.09657487  0.24836745  1
  Fe  Fe1  1  0.09370462  0.90342780  0.75163239  1
  Mn  Mn2  1  0.85153091  0.99788836  -0.00485605  1
  V  V3  1  0.01132032  0.14561097  0.49856590  1
  Mn  Mn4  1  0.14847147  0.00211041  1.00485609  1
  V  V5  1  0.98867622  0.85439294  0.50143418  1
  H  H6  1  0.54029421  0.17204803  0.41652614  1
  H  H7  1  0.83011004  0.46383150  0.09253865  1
  H  H8  1  0.45970905  0.82794177  0.58347793  1
  H  H9  1  0.16989371  0.53616948  0.90745831  1
  H  H10  1  0.33795254  0.16079380  0.51855676  1
  H  H11  1  0.84354139  0.66761677  0.99594632  1
  H  H12  1  0.66204627  0.83920372  0.48144523  1
  H  H13  1  0.15646691  0.33238219  0.00405085  1
  H  H14  1  0.42509931  0.07509782  0.06482981  1
  H  H15  1  0.92238368  0.57437117  0.44862550  1
  H  H16  1  0.57490297  0.92489662  0.93517268  1
  H  H17  1  0.07760715  0.42563513  0.55137406  1
  H  H18  1  0.88709893  0.22194890  0.04091375  1
  H  H19  1  0.78629357  0.12402388  0.46734735  1
  H  H20  1  0.11290209  0.77805126  0.95908295  1
  H  H21  1  0.21370372  0.87597996  0.53264933  1
  C  C22  1  0.62445316  0.11775424  0.17826025  1
  C  C23  1  0.87955791  0.37729157  0.32945437  1
  C  C24  1  0.37554949  0.88223756  0.82174275  1
  C  C25  1  0.12043695  0.62271278  0.67054377  1
  C  C26  1  0.49735585  0.12110244  0.23519349  1
  C  C27  1  0.88024691  0.50327016  0.27563708  1
  C  C28  1  0.50264649  0.87889017  0.76480952  1
  C  C29  1  0.11975020  0.49673362  0.72436135  1
  C  C30  1  0.47041291  0.14828748  0.36251192  1
  C  C31  1  0.85478139  0.53208720  0.14833786  1
  C  C32  1  0.52958898  0.85170522  0.63749123  1
  C  C33  1  0.14522046  0.46791451  0.85165974  1
  C  C34  1  0.35760663  0.14381830  0.42040597  1
  C  C35  1  0.86154976  0.64487999  0.09338681  1
  C  C36  1  0.64239298  0.85617807  0.57959610  1
  C  C37  1  0.13845558  0.35512009  0.90661106  1
  C  C38  1  0.27089048  0.11294154  0.34757558  1
  C  C39  1  0.89451196  0.72932286  0.16836458  1
  C  C40  1  0.72910758  0.88705802  0.65242573  1
  C  C41  1  0.10549285  0.27067704  0.83163364  1
  C  C42  1  0.29720476  0.08499288  0.22184957  1
  C  C43  1  0.91746416  0.70267305  0.29454075  1
  C  C44  1  0.70279427  0.91500587  0.77815181  1
  C  C45  1  0.08253485  0.29732978  0.70545841  1
  C  C46  1  0.40839296  0.09282200  0.16287683  1
  C  C47  1  0.90825787  0.59143684  0.35041141  1
  C  C48  1  0.59160858  0.90717275  0.83712570  1
  C  C49  1  0.09173718  0.40856793  0.64958749  1
  N  N50  1  0.15606182  0.09498358  0.37468923  1
  N  N51  1  0.91603144  0.84142213  0.14046881  1
  N  N52  1  0.84393290  0.90502129  0.62531020  1
  N  N53  1  0.08397892  0.15857459  0.85952905  1
  N  N54  1  0.12040525  0.04716777  0.27212443  1
  N  N55  1  0.95839222  0.87910563  0.23985587  1
  N  N56  1  0.87958746  0.95284030  0.72787393  1
  N  N57  1  0.04161358  0.12089335  0.76014337  1
  N  N58  1  0.20214018  0.04555734  0.18012972  1
  N  N59  1  0.95289643  0.80220977  0.33729882  1
  N  N60  1  0.79785585  0.95444668  0.81986993  1
  N  N61  1  0.04710375  0.19779247  0.66270044  1
  O  O62  1  0.93281598  0.12468218  0.06058127  1
  O  O63  1  0.88369865  0.07126354  0.44823531  1
  O  O64  1  0.06718561  0.87531838  0.93941685  1
  O  O65  1  0.11629926  0.92873926  0.55176455  1
  O  O66  1  0.70106651  0.14431686  0.24898296  1
  O  O67  1  0.84797302  0.30445277  0.25939230  1
  O  O68  1  0.29893516  0.85567799  0.75101897  1
  O  O69  1  0.15202045  0.69555266  0.74060595  1
  O  O70  1  0.64930819  0.08458765  0.06515574  1
  O  O71  1  0.91371755  0.34785880  0.44306820  1
  O  O72  1  0.35069547  0.91540145  0.93484797  1
  O  O73  1  0.08627726  0.65214508  0.55693013  1
