# generated using pymatgen
data_MnVH36Pd2C60(N2O)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.48523604
_cell_length_b   13.98047748
_cell_length_c   14.88299583
_cell_angle_alpha   87.37669953
_cell_angle_beta   83.15482981
_cell_angle_gamma   89.60604189
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVH36Pd2C60(N2O)8
_chemical_formula_sum   'Mn1 V1 H36 Pd2 C60 N16 O8'
_cell_volume   1544.73951410
_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  0.49999866  0.49999904  0.49999813  1
  Mn  Mn1  1  0.49999763  0.00000257  0.49999761  1
  H  H2  1  0.53273595  0.47619869  0.29742543  1
  H  H3  1  0.46726322  0.52380032  0.70257294  1
  H  H4  1  0.53793348  0.57438131  0.15388837  1
  H  H5  1  0.46205700  0.42561727  0.84610959  1
  H  H6  1  0.50261645  0.82582472  0.31349945  1
  H  H7  1  0.49739278  0.17417521  0.68649690  1
  H  H8  1  0.50315122  0.71945550  0.44994231  1
  H  H9  1  0.49685911  0.28054432  0.55005519  1
  H  H10  1  0.77599477  0.00378503  0.64059860  1
  H  H11  1  0.22400405  0.99621647  0.35940483  1
  H  H12  1  0.78255739  0.96071999  0.80244806  1
  H  H13  1  0.21743782  0.03927753  0.19755350  1
  H  H14  1  0.20046576  0.95368079  0.83251544  1
  H  H15  1  0.79952816  0.04632439  0.16748359  1
  H  H16  1  0.21479469  0.99672615  0.66929777  1
  H  H17  1  0.78520484  0.00328114  0.33070212  1
  H  H18  1  0.01578400  0.71803385  0.06866013  1
  H  H19  1  0.98421779  0.28196240  0.93133944  1
  H  H20  1  0.02602482  0.54054340  0.08367931  1
  H  H21  1  0.97398009  0.45945396  0.91632024  1
  H  H22  1  0.03744983  0.45856481  0.23535941  1
  H  H23  1  0.96255301  0.54143219  0.76464063  1
  H  H24  1  0.03587958  0.55485255  0.37144193  1
  H  H25  1  0.96412291  0.44514421  0.62855833  1
  H  H26  1  0.02724144  0.73293428  0.35591364  1
  H  H27  1  0.97275643  0.26706216  0.64408713  1
  H  H28  1  0.23813214  0.26370894  0.24221044  1
  H  H29  1  0.76187990  0.73629500  0.75779955  1
  H  H30  1  0.48923134  0.23501815  0.33604092  1
  H  H31  1  0.51078850  0.76498705  0.66396461  1
  H  H32  1  0.79882687  0.28856664  0.27754728  1
  H  H33  1  0.20119077  0.71143468  0.72245107  1
  H  H34  1  0.85525146  0.37519490  0.12672961  1
  H  H35  1  0.14475892  0.62479964  0.87326468  1
  H  H36  1  0.60205268  0.41008249  0.03610169  1
  H  H37  1  0.39794956  0.58991220  0.96389738  1
  Pd  Pd38  1  0.00942225  0.25970867  0.45896733  1
  Pd  Pd39  1  0.99057681  0.74029252  0.54102429  1
  C  C40  1  0.52653273  0.55385488  0.29814137  1
  C  C41  1  0.47346491  0.44614401  0.70185692  1
  C  C42  1  0.52813745  0.60824406  0.21833355  1
  C  C43  1  0.47185666  0.39175461  0.78166453  1
  C  C44  1  0.51760553  0.70904781  0.22121441  1
  C  C45  1  0.48239303  0.29095079  0.77878380  1
  C  C46  1  0.50899233  0.74889969  0.30734017  1
  C  C47  1  0.49101199  0.25109935  0.69265821  1
  C  C48  1  0.50948884  0.68934564  0.38358305  1
  C  C49  1  0.49051634  0.31065348  0.61641512  1
  C  C50  1  0.51240341  0.76668363  0.14233284  1
  C  C51  1  0.48758889  0.23331414  0.85766610  1
  C  C52  1  0.50571283  0.81611020  0.07145564  1
  C  C53  1  0.49427262  0.18388851  0.92854374  1
  C  C54  1  0.17757985  0.63996741  0.55565344  1
  C  C55  1  0.82241452  0.36003198  0.44434110  1
  C  C56  1  0.19176679  0.16068817  0.48642696  1
  C  C57  1  0.80823313  0.83931437  0.51356624  1
  C  C58  1  0.81661057  0.15990995  0.47486120  1
  C  C59  1  0.18338694  0.84009233  0.52513171  1
  C  C60  1  0.20224303  0.35945832  0.44922757  1
  C  C61  1  0.79775581  0.64054255  0.55076773  1
  C  C62  1  0.65082324  0.99038010  0.68431814  1
  C  C63  1  0.34917421  0.00962139  0.31568420  1
  C  C64  1  0.65522250  0.96577818  0.77477967  1
  C  C65  1  0.34477238  0.03422317  0.22522291  1
  C  C66  1  0.49151584  0.94675792  0.83067363  1
  C  C67  1  0.50847752  0.05324740  0.16932840  1
  C  C68  1  0.32966076  0.96196198  0.79154445  1
  C  C69  1  0.67033438  0.03804424  0.20845637  1
  C  C70  1  0.33832194  0.98642108  0.70027026  1
  C  C71  1  0.66167673  0.01358422  0.29973012  1
  C  C72  1  0.49073698  0.90969180  0.91958970  1
  C  C73  1  0.50925758  0.09031458  0.08041245  1
  C  C74  1  0.49764085  0.86630900  0.99352294  1
  C  C75  1  0.50234463  0.13369122  0.00647756  1
  C  C76  1  0.02229113  0.73553207  0.21160276  1
  C  C77  1  0.97770735  0.26446470  0.78839768  1
  C  C78  1  0.02190500  0.68168973  0.13427816  1
  C  C79  1  0.97809802  0.31830718  0.86572180  1
  C  C80  1  0.02708492  0.58254059  0.14334790  1
  C  C81  1  0.97291834  0.41745644  0.85665202  1
  C  C82  1  0.03317648  0.53647715  0.22850305  1
  C  C83  1  0.96682502  0.46351980  0.77149701  1
  C  C84  1  0.03266215  0.59066432  0.30514368  1
  C  C85  1  0.96733918  0.40933243  0.69485644  1
  C  C86  1  0.02734934  0.68976665  0.29711976  1
  C  C87  1  0.97265085  0.31023031  0.70288047  1
  C  C88  1  0.40607518  0.33827783  0.13366122  1
  C  C89  1  0.59393226  0.66172365  0.86634498  1
  C  C90  1  0.37333554  0.28857815  0.21832863  1
  C  C91  1  0.62667556  0.71142606  0.78167901  1
  C  C92  1  0.51418555  0.27224377  0.26982908  1
  C  C93  1  0.48582929  0.72776075  0.73017610  1
  C  C94  1  0.68817125  0.30285334  0.23716400  1
  C  C95  1  0.31184306  0.69714863  0.76283694  1
  C  C96  1  0.71960288  0.35237667  0.15286365  1
  C  C97  1  0.28040758  0.64762169  0.84713532  1
  C  C98  1  0.57973175  0.37145489  0.10142834  1
  C  C99  1  0.42027454  0.62854388  0.89857302  1
  N  N100  1  0.51588067  0.59211939  0.38083243  1
  N  N101  1  0.48411960  0.40787981  0.61916541  1
  N  N102  1  0.29211979  0.58204974  0.55674013  1
  N  N103  1  0.70787367  0.41794939  0.44325700  1
  N  N104  1  0.30226935  0.10470049  0.50246427  1
  N  N105  1  0.69773114  0.89530318  0.49753093  1
  N  N106  1  0.70013427  0.10338801  0.48538380  1
  N  N107  1  0.29986008  0.89661602  0.51461143  1
  N  N108  1  0.49582039  0.99743119  0.64575179  1
  N  N109  1  0.50417936  0.00257232  0.35424893  1
  N  N110  1  0.31688556  0.41629249  0.45072247  1
  N  N111  1  0.68311422  0.58370709  0.54927619  1
  N  N112  1  0.01683696  0.83851784  0.20374836  1
  N  N113  1  0.98315406  0.16147905  0.79625202  1
  N  N114  1  0.26344355  0.35372004  0.07931748  1
  N  N115  1  0.73655773  0.64627902  0.92069201  1
  O  O116  1  0.01640499  0.88296268  0.27488219  1
  O  O117  1  0.98357046  0.11703439  0.72511889  1
  O  O118  1  0.01289880  0.87768536  0.12749861  1
  O  O119  1  0.98709891  0.12231133  0.87250109  1
  O  O120  1  0.12274182  0.30528455  0.09865726  1
  O  O121  1  0.87726250  0.69471262  0.90135468  1
  O  O122  1  0.28594306  0.41452672  0.01443801  1
  O  O123  1  0.71405108  0.58547208  0.98557105  1
