# generated using pymatgen
data_FeCoH48Pd2(C19N3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.26838435
_cell_length_b   14.08263430
_cell_length_c   16.08118949
_cell_angle_alpha   101.76847364
_cell_angle_beta   95.39873795
_cell_angle_gamma   90.00445528
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCoH48Pd2(C19N3)4
_chemical_formula_sum   'Fe1 Co1 H48 Pd2 C76 N12'
_cell_volume   1603.97646243
_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
  Fe  Fe0  1  0.50077482  1.00002347  0.50100747  1
  Co  Co1  1  0.49903300  0.49850375  0.48728448  1
  H  H2  1  0.55933534  0.98986638  0.68603510  1
  H  H3  1  0.44139771  0.01070657  0.31551922  1
  H  H4  1  0.56612115  0.09458807  0.82933315  1
  H  H5  1  0.43334946  0.90584204  0.17220547  1
  H  H6  1  0.48472279  0.34003158  0.70742270  1
  H  H7  1  0.51547393  0.66051504  0.29407948  1
  H  H8  1  0.48384892  0.22733120  0.56878462  1
  H  H9  1  0.51702887  0.77318351  0.43278887  1
  H  H10  1  0.77105981  0.52240496  0.36617571  1
  H  H11  1  0.23040675  0.47580510  0.63664607  1
  H  H12  1  0.78006271  0.49302468  0.20848885  1
  H  H13  1  0.22087946  0.50593373  0.79392517  1
  H  H14  1  0.20535642  0.40377566  0.18165699  1
  H  H15  1  0.79389539  0.59822851  0.82049760  1
  H  H16  1  0.21503211  0.44045469  0.34041601  1
  H  H17  1  0.78239556  0.56356230  0.66202255  1
  H  H18  1  0.47368352  0.20392153  0.32183138  1
  H  H19  1  0.52627787  0.79618186  0.67822788  1
  H  H20  1  0.19211823  0.11161381  0.25023041  1
  H  H21  1  0.80771773  0.88848640  0.74988981  1
  H  H22  1  0.16182055  0.05089121  0.09193924  1
  H  H23  1  0.83788777  0.94915038  0.90820252  1
  H  H24  1  0.41235286  0.08549763  0.00632355  1
  H  H25  1  0.58728668  0.91442452  0.99374497  1
  H  H26  1  0.78064455  0.27142290  0.31470417  1
  H  H27  1  0.21938499  0.72831808  0.68529057  1
  H  H28  1  0.03915173  0.29723913  0.23071709  1
  H  H29  1  0.96090103  0.70245718  0.76917120  1
  H  H30  1  0.00411907  0.24394907  0.07149831  1
  H  H31  1  0.99563898  0.75592572  0.92835590  1
  H  H32  1  0.71556791  0.15825116  0.99831882  1
  H  H33  1  0.28415158  0.84162960  0.00168598  1
  H  H34  1  0.11715312  0.15577134  0.95034060  1
  H  H35  1  0.88263292  0.84429380  0.04977596  1
  H  H36  1  0.16543104  0.98590388  0.87594733  1
  H  H37  1  0.83432071  0.01415835  0.12415509  1
  H  H38  1  0.12471637  0.94190493  0.71601769  1
  H  H39  1  0.87502548  0.05818033  0.28406084  1
  H  H40  1  0.03635873  0.06699770  0.63265918  1
  H  H41  1  0.96337065  0.93311537  0.36745444  1
  H  H42  1  0.96376400  0.23569121  0.62722936  1
  H  H43  1  0.03576851  0.76446988  0.37292012  1
  H  H44  1  0.91380892  0.40518761  0.70115770  1
  H  H45  1  0.08575206  0.59501576  0.29908906  1
  H  H46  1  0.94839665  0.44930554  0.86104358  1
  H  H47  1  0.05079573  0.55069374  0.13913434  1
  H  H48  1  0.03714930  0.32422108  0.94506119  1
  H  H49  1  0.96241927  0.67577921  0.05508536  1
  Pd  Pd50  1  0.99474336  0.24343744  0.46547966  1
  Pd  Pd51  1  0.00716805  0.75563223  0.53354423  1
  C  C52  1  0.54266024  0.06771374  0.69272836  1
  C  C53  1  0.45791150  0.93285684  0.30885990  1
  C  C54  1  0.54606969  0.12606649  0.77317340  1
  C  C55  1  0.45374416  0.87446995  0.22841684  1
  C  C56  1  0.52307556  0.22708718  0.78127862  1
  C  C57  1  0.47663982  0.77345892  0.22037534  1
  C  C58  1  0.50148566  0.26312758  0.70509993  1
  C  C59  1  0.49878943  0.73743596  0.29653288  1
  C  C60  1  0.50021745  0.19934725  0.62733688  1
  C  C61  1  0.50057559  0.80125350  0.37428956  1
  C  C62  1  0.52030443  0.28824694  0.86156493  1
  C  C63  1  0.47909203  0.71204441  0.14027296  1
  C  C64  1  0.51263188  0.33564945  0.93533710  1
  C  C65  1  0.48712781  0.66394405  0.06679086  1
  C  C66  1  0.79430241  0.14372633  0.45849495  1
  C  C67  1  0.20762930  0.85597110  0.54316742  1
  C  C68  1  0.19720130  0.34213021  0.47393121  1
  C  C69  1  0.80304366  0.65663604  0.51884089  1
  C  C70  1  0.80577135  0.34806545  0.47956224  1
  C  C71  1  0.19434438  0.65066931  0.51100535  1
  C  C72  1  0.18125897  0.13761947  0.45569521  1
  C  C73  1  0.82090443  0.86167595  0.54597031  1
  C  C74  1  0.64829230  0.49697091  0.32333057  1
  C  C75  1  0.35326908  0.50274899  0.67911566  1
  C  C76  1  0.65402851  0.47967194  0.23583818  1
  C  C77  1  0.34655957  0.51988321  0.76674363  1
  C  C78  1  0.49416340  0.44306106  0.18174751  1
  C  C79  1  0.50630859  0.55689309  0.82056001  1
  C  C80  1  0.33197596  0.43026343  0.22083716  1
  C  C81  1  0.66764503  0.57111311  0.78152494  1
  C  C82  1  0.33761506  0.45078454  0.30907286  1
  C  C83  1  0.66001360  0.55126026  0.69304864  1
  C  C84  1  0.49720163  0.41608327  0.09302049  1
  C  C85  1  0.50343378  0.58325911  0.90932782  1
  C  C86  1  0.50266627  0.38101547  0.01588590  1
  C  C87  1  0.49768415  0.61822489  0.98642283  1
  C  C88  1  0.45904870  0.17760657  0.25282521  1
  C  C89  1  0.54091451  0.82234863  0.74725485  1
  C  C90  1  0.30182806  0.12639068  0.21248648  1
  C  C91  1  0.69804544  0.87362276  0.78762940  1
  C  C92  1  0.28472463  0.09235660  0.12338492  1
  C  C93  1  0.71507445  0.90762370  0.87673174  1
  C  C94  1  0.42428631  0.11104261  0.07545673  1
  C  C95  1  0.57549180  0.88887298  0.92461605  1
  C  C96  1  0.60530651  0.19601331  0.20566882  1
  C  C97  1  0.39465358  0.80387700  0.79435977  1
  C  C98  1  0.76963873  0.24557991  0.24557812  1
  C  C99  1  0.23045278  0.75420377  0.75438343  1
  C  C100  1  0.91171258  0.26136558  0.19811606  1
  C  C101  1  0.08833270  0.73842777  0.80179721  1
  C  C102  1  0.89232729  0.23034837  0.10857487  1
  C  C103  1  0.10754942  0.76950729  0.89132797  1
  C  C104  1  0.73296200  0.18151551  0.06771069  1
  C  C105  1  0.26687479  0.81833001  0.93229512  1
  C  C106  1  0.58729039  0.16243107  0.11494303  1
  C  C107  1  0.41257351  0.83742041  0.88508319  1
  C  C108  1  0.04808859  0.20827502  0.83454237  1
  C  C109  1  0.95151787  0.79177706  0.16558367  1
  C  C110  1  0.09819171  0.13521751  0.88080440  1
  C  C111  1  0.90153131  0.86484101  0.11931514  1
  C  C112  1  0.12518278  0.04083483  0.83897147  1
  C  C113  1  0.87455630  0.95923136  0.16113493  1
  C  C114  1  0.10200277  0.01596848  0.74915305  1
  C  C115  1  0.89770708  0.98411379  0.25094617  1
  C  C116  1  0.05380281  0.08576275  0.70218824  1
  C  C117  1  0.94591210  0.91433391  0.29792400  1
  C  C118  1  0.02676194  0.18294686  0.74321066  1
  C  C119  1  0.97284386  0.81713452  0.25691536  1
  C  C120  1  0.97946622  0.25600776  0.69679147  1
  C  C121  1  0.02003561  0.74411143  0.30335670  1
  C  C122  1  0.95239868  0.35035023  0.73837232  1
  C  C123  1  0.04705833  0.64974431  0.26179257  1
  C  C124  1  0.97245020  0.37524841  0.82828772  1
  C  C125  1  0.02699397  0.62478787  0.17187282  1
  C  C126  1  0.02006901  0.30546244  0.87543895  1
  C  C127  1  0.97942944  0.69456529  0.12470633  1
  N  N128  1  0.51803993  0.10227452  0.62008088  1
  N  N129  1  0.48304798  0.89833363  0.38157737  1
  N  N130  1  0.68134983  0.08488848  0.46063449  1
  N  N131  1  0.32063894  0.91495905  0.54149901  1
  N  N132  1  0.31587520  0.39986233  0.47827489  1
  N  N133  1  0.68281880  0.59851721  0.50749584  1
  N  N134  1  0.68995386  0.40631225  0.48665582  1
  N  N135  1  0.30804562  0.59209634  0.49700321  1
  N  N136  1  0.49334941  0.48236643  0.36042823  1
  N  N137  1  0.50641963  0.51800583  0.64252035  1
  N  N138  1  0.29229743  0.07726147  0.45736894  1
  N  N139  1  0.70980975  0.92217772  0.54514111  1
