# generated using pymatgen
data_MnVH48Pd2(C19N3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.26871743
_cell_length_b   14.08310741
_cell_length_c   16.08056944
_cell_angle_alpha   101.76971384
_cell_angle_beta   95.39846936
_cell_angle_gamma   90.00438822
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVH48Pd2(C19N3)4
_chemical_formula_sum   'Mn1 V1 H48 Pd2 C76 N12'
_cell_volume   1604.03548363
_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
  V  V0  1  0.50070676  1.00015399  0.50100038  1
  Mn  Mn1  1  0.49881601  0.49828015  0.48485128  1
  H  H2  1  0.55904066  0.98932839  0.68535462  1
  H  H3  1  0.44169476  0.01121194  0.31623167  1
  H  H4  1  0.56612521  0.09491539  0.82950124  1
  H  H5  1  0.43334562  0.90549946  0.17204571  1
  H  H6  1  0.48471425  0.33989319  0.70752174  1
  H  H7  1  0.51535363  0.66066042  0.29400872  1
  H  H8  1  0.48364351  0.22682439  0.56828631  1
  H  H9  1  0.51723677  0.77364282  0.43327377  1
  H  H10  1  0.77395733  0.52272415  0.36576472  1
  H  H11  1  0.22924841  0.47569740  0.63717166  1
  H  H12  1  0.77978361  0.49310859  0.20904781  1
  H  H13  1  0.22139915  0.50586426  0.79330984  1
  H  H14  1  0.20562273  0.40389646  0.18215028  1
  H  H15  1  0.79338977  0.59800889  0.81980552  1
  H  H16  1  0.21178471  0.44002801  0.33980019  1
  H  H17  1  0.78380421  0.56379948  0.66267739  1
  H  H18  1  0.47377509  0.20394270  0.32171465  1
  H  H19  1  0.52619321  0.79613570  0.67835731  1
  H  H20  1  0.19209524  0.11167670  0.25023035  1
  H  H21  1  0.80775928  0.88842397  0.74989845  1
  H  H22  1  0.16183290  0.05084130  0.09186420  1
  H  H23  1  0.83786985  0.94919851  0.90827934  1
  H  H24  1  0.41249488  0.08552520  0.00641159  1
  H  H25  1  0.58714146  0.91439414  0.99365093  1
  H  H26  1  0.78049351  0.27131938  0.31464614  1
  H  H27  1  0.21959519  0.72841772  0.68535191  1
  H  H28  1  0.03918676  0.29723059  0.23075014  1
  H  H29  1  0.96085799  0.70245461  0.76914322  1
  H  H30  1  0.00419320  0.24391409  0.07147206  1
  H  H31  1  0.99556312  0.75595435  0.92836931  1
  H  H32  1  0.71541715  0.15818555  0.99833035  1
  H  H33  1  0.28431369  0.84169345  0.00166289  1
  H  H34  1  0.11710865  0.15578960  0.95028591  1
  H  H35  1  0.88267824  0.84427897  0.04983438  1
  H  H36  1  0.16544306  0.98591255  0.87602099  1
  H  H37  1  0.83430999  0.01415326  0.12408678  1
  H  H38  1  0.12456056  0.94191161  0.71603897  1
  H  H39  1  0.87516364  0.05817603  0.28406234  1
  H  H40  1  0.03637632  0.06713286  0.63276687  1
  H  H41  1  0.96336905  0.93298013  0.36734274  1
  H  H42  1  0.96377591  0.23563023  0.62732624  1
  H  H43  1  0.03572052  0.76451800  0.37284294  1
  H  H44  1  0.91385440  0.40517608  0.70117223  1
  H  H45  1  0.08575767  0.59503463  0.29906952  1
  H  H46  1  0.94839115  0.44931184  0.86106305  1
  H  H47  1  0.05077934  0.55070069  0.13910076  1
  H  H48  1  0.03711346  0.32417152  0.94502459  1
  H  H49  1  0.96244933  0.67583047  0.05511074  1
  Pd  Pd50  1  0.99435899  0.24306340  0.46537077  1
  Pd  Pd51  1  0.00765422  0.75594296  0.53359271  1
  C  C52  1  0.54281765  0.06731036  0.69272831  1
  C  C53  1  0.45777817  0.93322107  0.30888241  1
  C  C54  1  0.54608128  0.12590630  0.77305435  1
  C  C55  1  0.45373739  0.87461801  0.22854100  1
  C  C56  1  0.52307052  0.22694995  0.78117315  1
  C  C57  1  0.47663834  0.77359702  0.22048129  1
  C  C58  1  0.50150635  0.26296527  0.70493825  1
  C  C59  1  0.49872797  0.73758097  0.29666645  1
  C  C60  1  0.50013708  0.19947039  0.62711661  1
  C  C61  1  0.50064857  0.80109396  0.37449549  1
  C  C62  1  0.52027052  0.28836558  0.86151712  1
  C  C63  1  0.47913139  0.71194776  0.14032163  1
  C  C64  1  0.51262097  0.33564524  0.93538010  1
  C  C65  1  0.48713499  0.66393890  0.06678033  1
  C  C66  1  0.79409298  0.14388710  0.45822824  1
  C  C67  1  0.20800201  0.85584555  0.54342250  1
  C  C68  1  0.19560665  0.34171022  0.47396095  1
  C  C69  1  0.80456644  0.65706987  0.51911774  1
  C  C70  1  0.80742028  0.34752803  0.47967322  1
  C  C71  1  0.19291950  0.65118747  0.51121651  1
  C  C72  1  0.18063976  0.13808842  0.45550377  1
  C  C73  1  0.82159833  0.86112946  0.54609443  1
  C  C74  1  0.64938217  0.49728598  0.32403100  1
  C  C75  1  0.35385410  0.50264856  0.67830565  1
  C  C76  1  0.65392217  0.47969877  0.23663464  1
  C  C77  1  0.34709294  0.51979302  0.76597044  1
  C  C78  1  0.49413950  0.44303719  0.18216128  1
  C  C79  1  0.50624190  0.55687531  0.82019803  1
  C  C80  1  0.33203412  0.43034498  0.22163822  1
  C  C81  1  0.66706427  0.57087851  0.78067177  1
  C  C82  1  0.33612853  0.45072615  0.30959941  1
  C  C83  1  0.65947963  0.55106190  0.69216076  1
  C  C84  1  0.49732253  0.41625280  0.09335883  1
  C  C85  1  0.50340705  0.58316838  0.90908656  1
  C  C86  1  0.50265520  0.38109098  0.01610344  1
  C  C87  1  0.49771525  0.61816117  0.98624303  1
  C  C88  1  0.45901167  0.17765418  0.25270788  1
  C  C89  1  0.54093869  0.82231068  0.74737384  1
  C  C90  1  0.30175277  0.12639690  0.21243988  1
  C  C91  1  0.69812202  0.87361946  0.78767424  1
  C  C92  1  0.28462680  0.09235048  0.12338511  1
  C  C93  1  0.71516894  0.90763147  0.87672884  1
  C  C94  1  0.42425690  0.11109842  0.07551598  1
  C  C95  1  0.57551838  0.88881351  0.92455116  1
  C  C96  1  0.60529828  0.19605648  0.20560561  1
  C  C97  1  0.39465122  0.80383743  0.79441883  1
  C  C98  1  0.76958711  0.24559097  0.24551710  1
  C  C99  1  0.23047771  0.75420098  0.75444577  1
  C  C100  1  0.91176562  0.26136559  0.19808465  1
  C  C101  1  0.08827019  0.73841447  0.80182576  1
  C  C102  1  0.89235512  0.23038881  0.10856055  1
  C  C103  1  0.10751461  0.76947202  0.89134064  1
  C  C104  1  0.73299855  0.18147517  0.06771863  1
  C  C105  1  0.26683856  0.81836723  0.93227590  1
  C  C106  1  0.58732323  0.16240862  0.11492728  1
  C  C107  1  0.41254324  0.83743647  0.88509190  1
  C  C108  1  0.04805868  0.20827628  0.83455760  1
  C  C109  1  0.95153958  0.79177805  0.16557021  1
  C  C110  1  0.09814401  0.13520776  0.88077686  1
  C  C111  1  0.90157781  0.86485222  0.11934458  1
  C  C112  1  0.12523251  0.04081924  0.83900540  1
  C  C113  1  0.87450480  0.95924941  0.16110321  1
  C  C114  1  0.10196569  0.01596961  0.74921199  1
  C  C115  1  0.89773568  0.98412013  0.25088870  1
  C  C116  1  0.05376138  0.08581691  0.70230098  1
  C  C117  1  0.94594751  0.91428348  0.29781007  1
  C  C118  1  0.02680604  0.18297689  0.74327836  1
  C  C119  1  0.97280364  0.81710862  0.25685411  1
  C  C120  1  0.97956328  0.25602630  0.69687734  1
  C  C121  1  0.01995883  0.74410013  0.30328723  1
  C  C122  1  0.95236162  0.35037349  0.73842560  1
  C  C123  1  0.04712663  0.64973592  0.26173273  1
  C  C124  1  0.97251140  0.37527133  0.82831735  1
  C  C125  1  0.02691170  0.62477656  0.17183441  1
  C  C126  1  0.02004778  0.30543633  0.87542557  1
  C  C127  1  0.97943070  0.69459954  0.12471043  1
  N  N128  1  0.51793108  0.10200033  0.61970717  1
  N  N129  1  0.48329028  0.89853501  0.38194480  1
  N  N130  1  0.68063788  0.08494532  0.46001550  1
  N  N131  1  0.32154617  0.91495663  0.54216208  1
  N  N132  1  0.31551781  0.39898240  0.47886983  1
  N  N133  1  0.68329684  0.59952259  0.50841550  1
  N  N134  1  0.69181386  0.40595321  0.48780512  1
  N  N135  1  0.30663495  0.59250252  0.49706102  1
  N  N136  1  0.49299417  0.48286992  0.36205350  1
  N  N137  1  0.50621188  0.51803126  0.64029907  1
  N  N138  1  0.29167110  0.07750283  0.45635045  1
  N  N139  1  0.71057174  0.92187450  0.54629901  1
