# generated using pymatgen
data_FeCoH36Pd2C60(N2O)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.48496231
_cell_length_b   13.98000779
_cell_length_c   14.88295269
_cell_angle_alpha   87.37614510
_cell_angle_beta   83.15504725
_cell_angle_gamma   89.60598988
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCoH36Pd2C60(N2O)8
_chemical_formula_sum   'Fe1 Co1 H36 Pd2 C60 N16 O8'
_cell_volume   1544.62666981
_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  0.49999971  0.49999880  0.49999845  1
  Fe  Fe1  1  0.49999860  0.00000241  0.49999751  1
  H  H2  1  0.53248697  0.47672574  0.29774469  1
  H  H3  1  0.46751245  0.52327327  0.70225311  1
  H  H4  1  0.53796855  0.57439222  0.15378569  1
  H  H5  1  0.46202195  0.42560642  0.84621249  1
  H  H6  1  0.50261592  0.82595489  0.31347902  1
  H  H7  1  0.49739326  0.17404465  0.68651768  1
  H  H8  1  0.50332854  0.71899557  0.44960549  1
  H  H9  1  0.49668138  0.28100377  0.55039222  1
  H  H10  1  0.77621709  0.00392044  0.64056968  1
  H  H11  1  0.22378197  0.99608090  0.35943360  1
  H  H12  1  0.78245925  0.96083371  0.80227025  1
  H  H13  1  0.21753568  0.03916384  0.19773142  1
  H  H14  1  0.20050419  0.95377693  0.83237164  1
  H  H15  1  0.79948963  0.04622824  0.16762747  1
  H  H16  1  0.21449256  0.99688076  0.66932104  1
  H  H17  1  0.78550697  0.00312649  0.33067858  1
  H  H18  1  0.01571735  0.71803632  0.06849897  1
  H  H19  1  0.98428448  0.28195993  0.93150076  1
  H  H20  1  0.02609463  0.54056021  0.08356051  1
  H  H21  1  0.97391109  0.45943709  0.91643927  1
  H  H22  1  0.03757996  0.45860689  0.23537693  1
  H  H23  1  0.96242288  0.54139002  0.76462305  1
  H  H24  1  0.03587156  0.55480078  0.37150806  1
  H  H25  1  0.96413088  0.44519599  0.62849203  1
  H  H26  1  0.02729410  0.73289481  0.35609255  1
  H  H27  1  0.97270391  0.26710181  0.64390810  1
  H  H28  1  0.23801124  0.26364664  0.24219351  1
  H  H29  1  0.76200081  0.73635735  0.75781647  1
  H  H30  1  0.48900652  0.23509202  0.33609161  1
  H  H31  1  0.51101313  0.76491332  0.66391390  1
  H  H32  1  0.79865811  0.28861375  0.27749132  1
  H  H33  1  0.20135923  0.71138788  0.72250721  1
  H  H34  1  0.85528771  0.37515395  0.12660263  1
  H  H35  1  0.14472258  0.62484060  0.87339186  1
  H  H36  1  0.60206873  0.41014620  0.03599665  1
  H  H37  1  0.39793391  0.58984845  0.96400266  1
  Pd  Pd38  1  0.00913535  0.25753196  0.45948369  1
  Pd  Pd39  1  0.99086303  0.74246911  0.54050826  1
  C  C40  1  0.52645140  0.55432150  0.29829305  1
  C  C41  1  0.47354630  0.44567736  0.70170510  1
  C  C42  1  0.52813321  0.60856532  0.21808127  1
  C  C43  1  0.47186098  0.39143343  0.78191720  1
  C  C44  1  0.51756474  0.70919284  0.22112531  1
  C  C45  1  0.48243361  0.29080577  0.77887267  1
  C  C46  1  0.50896790  0.74903930  0.30704249  1
  C  C47  1  0.49103650  0.25095987  0.69295524  1
  C  C48  1  0.50951318  0.68887918  0.38324634  1
  C  C49  1  0.49049228  0.31112026  0.61675141  1
  C  C50  1  0.51242406  0.76674729  0.14208983  1
  C  C51  1  0.48756780  0.23325009  0.85790871  1
  C  C52  1  0.50574720  0.81618142  0.07133829  1
  C  C53  1  0.49423847  0.18381799  0.92866122  1
  C  C54  1  0.17605888  0.64054083  0.55554942  1
  C  C55  1  0.82393527  0.35945815  0.44444493  1
  C  C56  1  0.19452258  0.15924862  0.48700411  1
  C  C57  1  0.80547709  0.84075380  0.51298912  1
  C  C58  1  0.81351506  0.15833287  0.47523161  1
  C  C59  1  0.18648192  0.84166943  0.52476161  1
  C  C60  1  0.20043071  0.35865585  0.44900232  1
  C  C61  1  0.79956827  0.64134499  0.55099317  1
  C  C62  1  0.65065722  0.99039713  0.68407498  1
  C  C63  1  0.34934033  0.00960459  0.31592695  1
  C  C64  1  0.65498870  0.96573422  0.77463591  1
  C  C65  1  0.34500636  0.03426714  0.22536649  1
  C  C66  1  0.49148004  0.94670805  0.83054533  1
  C  C67  1  0.50851327  0.05329720  0.16945719  1
  C  C68  1  0.32981321  0.96191361  0.79141499  1
  C  C69  1  0.67018229  0.03809248  0.20858585  1
  C  C70  1  0.33840451  0.98647105  0.70005613  1
  C  C71  1  0.66159411  0.01353454  0.29994433  1
  C  C72  1  0.49072194  0.90974136  0.91955100  1
  C  C73  1  0.50927191  0.09026438  0.08045129  1
  C  C74  1  0.49764840  0.86640177  0.99346909  1
  C  C75  1  0.50233753  0.13359846  0.00653161  1
  C  C76  1  0.02225611  0.73535412  0.21160543  1
  C  C77  1  0.97774226  0.26464269  0.78839491  1
  C  C78  1  0.02184791  0.68168488  0.13420317  1
  C  C79  1  0.97815493  0.31831210  0.86579685  1
  C  C80  1  0.02708513  0.58249418  0.14332000  1
  C  C81  1  0.97291830  0.41750268  0.85668012  1
  C  C82  1  0.03319310  0.53647582  0.22848485  1
  C  C83  1  0.96680855  0.46352112  0.77151529  1
  C  C84  1  0.03264910  0.59058691  0.30516190  1
  C  C85  1  0.96735227  0.40940997  0.69483819  1
  C  C86  1  0.02734358  0.68973623  0.29720305  1
  C  C87  1  0.97265635  0.31026067  0.70279707  1
  C  C88  1  0.40634197  0.33828190  0.13371611  1
  C  C89  1  0.59366445  0.66171933  0.86629026  1
  C  C90  1  0.37332587  0.28852660  0.21833719  1
  C  C91  1  0.62668556  0.71147746  0.78167060  1
  C  C92  1  0.51425349  0.27219132  0.26979727  1
  C  C93  1  0.48576175  0.72781324  0.73020786  1
  C  C94  1  0.68814572  0.30278429  0.23707976  1
  C  C95  1  0.31186895  0.69721778  0.76292083  1
  C  C96  1  0.71969516  0.35231214  0.15283191  1
  C  C97  1  0.28031517  0.64768637  0.84716676  1
  C  C98  1  0.57985891  0.37146319  0.10135284  1
  C  C99  1  0.42014691  0.62853536  0.89864864  1
  N  N100  1  0.51611751  0.59258872  0.38009113  1
  N  N101  1  0.48388311  0.40741066  0.61990690  1
  N  N102  1  0.29015192  0.58266774  0.55698247  1
  N  N103  1  0.70984136  0.41733171  0.44301539  1
  N  N104  1  0.30584765  0.10285156  0.50147314  1
  N  N105  1  0.69415302  0.89715191  0.49852183  1
  N  N106  1  0.69681540  0.10167555  0.48553293  1
  N  N107  1  0.30317828  0.89832874  0.51446250  1
  N  N108  1  0.49574384  0.99730342  0.64521166  1
  N  N109  1  0.50425529  0.00270039  0.35478899  1
  N  N110  1  0.31466472  0.41532767  0.45072539  1
  N  N111  1  0.68533495  0.58467206  0.54927242  1
  N  N112  1  0.01677868  0.83856526  0.20376527  1
  N  N113  1  0.98321191  0.16143166  0.79623527  1
  N  N114  1  0.26342584  0.35377683  0.07925223  1
  N  N115  1  0.73657527  0.64622234  0.92075698  1
  O  O116  1  0.01629444  0.88312223  0.27482364  1
  O  O117  1  0.98368201  0.11687490  0.72517745  1
  O  O118  1  0.01287892  0.87786235  0.12753928  1
  O  O119  1  0.98711874  0.12213438  0.87246055  1
  O  O120  1  0.12252858  0.30546053  0.09854412  1
  O  O121  1  0.87747586  0.69453664  0.90146788  1
  O  O122  1  0.28575823  0.41445886  0.01432006  1
  O  O123  1  0.71423592  0.58553995  0.98568863  1
