# generated using pymatgen
data_MnCrH36Pd2C60(N2O)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.48516631
_cell_length_b   13.98048546
_cell_length_c   14.88317641
_cell_angle_alpha   87.37618504
_cell_angle_beta   83.15516445
_cell_angle_gamma   89.60631503
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCrH36Pd2C60(N2O)8
_chemical_formula_sum   'Mn1 Cr1 H36 Pd2 C60 N16 O8'
_cell_volume   1544.74520828
_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
  Mn  Mn0  1  0.49999931  0.49999941  0.49999866  1
  Cr  Cr1  1  0.49999899  0.00000229  0.49999770  1
  H  H2  1  0.53246588  0.47667929  0.29721535  1
  H  H3  1  0.46753314  0.52331978  0.70278282  1
  H  H4  1  0.53799692  0.57434460  0.15369638  1
  H  H5  1  0.46199356  0.42565395  0.84630191  1
  H  H6  1  0.50261665  0.82607786  0.31348735  1
  H  H7  1  0.49739258  0.17392140  0.68650932  1
  H  H8  1  0.50325972  0.71934673  0.44950862  1
  H  H9  1  0.49675037  0.28065291  0.55048902  1
  H  H10  1  0.77647469  0.00399114  0.64052183  1
  H  H11  1  0.22352441  0.99601017  0.35948136  1
  H  H12  1  0.78225575  0.96086559  0.80221784  1
  H  H13  1  0.21773934  0.03913196  0.19778385  1
  H  H14  1  0.20070214  0.95380426  0.83231822  1
  H  H15  1  0.79929160  0.04620085  0.16768092  1
  H  H16  1  0.21407528  0.99687417  0.66934960  1
  H  H17  1  0.78592422  0.00313300  0.33065001  1
  H  H18  1  0.01570461  0.71804117  0.06851963  1
  H  H19  1  0.98429712  0.28195512  0.93148001  1
  H  H20  1  0.02611680  0.54056203  0.08353630  1
  H  H21  1  0.97388910  0.45943513  0.91646348  1
  H  H22  1  0.03765292  0.45859763  0.23533107  1
  H  H23  1  0.96234985  0.54139930  0.76466900  1
  H  H24  1  0.03590958  0.55480846  0.37148332  1
  H  H25  1  0.96409287  0.44518842  0.62851669  1
  H  H26  1  0.02733751  0.73295734  0.35601999  1
  H  H27  1  0.97266050  0.26703916  0.64398076  1
  H  H28  1  0.23801757  0.26365155  0.24215421  1
  H  H29  1  0.76199475  0.73635262  0.75785569  1
  H  H30  1  0.48903203  0.23507238  0.33600801  1
  H  H31  1  0.51098760  0.76493285  0.66399765  1
  H  H32  1  0.79863260  0.28860630  0.27749031  1
  H  H33  1  0.20138509  0.71139523  0.72250831  1
  H  H34  1  0.85533163  0.37514100  0.12657322  1
  H  H35  1  0.14467869  0.62485358  0.87342129  1
  H  H36  1  0.60210511  0.41014921  0.03599683  1
  H  H37  1  0.39789739  0.58984547  0.96400243  1
  Pd  Pd38  1  0.00907372  0.25681852  0.45988348  1
  Pd  Pd39  1  0.99092468  0.74318237  0.54010841  1
  C  C40  1  0.52653235  0.55431527  0.29803339  1
  C  C41  1  0.47346531  0.44568367  0.70196462  1
  C  C42  1  0.52816370  0.60856581  0.21798697  1
  C  C43  1  0.47183053  0.39143270  0.78201133  1
  C  C44  1  0.51759460  0.70923149  0.22101902  1
  C  C45  1  0.48240361  0.29076709  0.77897966  1
  C  C46  1  0.50900019  0.74918565  0.30686324  1
  C  C47  1  0.49100425  0.25081360  0.69313421  1
  C  C48  1  0.50957596  0.68922075  0.38311625  1
  C  C49  1  0.49042937  0.31077864  0.61688150  1
  C  C50  1  0.51241518  0.76680191  0.14209388  1
  C  C51  1  0.48757674  0.23319628  0.85790469  1
  C  C52  1  0.50576936  0.81619998  0.07129177  1
  C  C53  1  0.49421635  0.18379904  0.92870724  1
  C  C54  1  0.17482136  0.64134052  0.55548726  1
  C  C55  1  0.82517331  0.35865863  0.44450707  1
  C  C56  1  0.19478367  0.15906122  0.48719035  1
  C  C57  1  0.80521575  0.84094126  0.51280330  1
  C  C58  1  0.81327327  0.15814269  0.47528720  1
  C  C59  1  0.18672394  0.84185931  0.52470624  1
  C  C60  1  0.19914357  0.35789576  0.44917489  1
  C  C61  1  0.80085500  0.64210497  0.55082056  1
  C  C62  1  0.65080532  0.99041280  0.68395006  1
  C  C63  1  0.34919234  0.00958884  0.31605195  1
  C  C64  1  0.65486757  0.96573102  0.77447354  1
  C  C65  1  0.34512738  0.03427040  0.22552841  1
  C  C66  1  0.49145556  0.94669673  0.83049596  1
  C  C67  1  0.50853758  0.05330859  0.16950620  1
  C  C68  1  0.32992476  0.96190862  0.79125775  1
  C  C69  1  0.67007017  0.03809747  0.20874288  1
  C  C70  1  0.33811962  0.98646002  0.69996039  1
  C  C71  1  0.66187843  0.01354550  0.30003993  1
  C  C72  1  0.49067711  0.90982363  0.91951387  1
  C  C73  1  0.50931756  0.09018208  0.08048845  1
  C  C74  1  0.49764944  0.86643529  0.99344443  1
  C  C75  1  0.50233639  0.13356515  0.00655623  1
  C  C76  1  0.02225301  0.73535895  0.21158793  1
  C  C77  1  0.97774517  0.26463798  0.78841230  1
  C  C78  1  0.02182456  0.68172965  0.13422727  1
  C  C79  1  0.97817815  0.31826728  0.86577278  1
  C  C80  1  0.02706019  0.58249763  0.14331728  1
  C  C81  1  0.97294336  0.41749922  0.85668286  1
  C  C82  1  0.03318447  0.53648213  0.22846512  1
  C  C83  1  0.96681734  0.46351491  0.77153497  1
  C  C84  1  0.03268853  0.59058217  0.30513313  1
  C  C85  1  0.96731284  0.40941467  0.69486700  1
  C  C86  1  0.02734792  0.68982929  0.29711845  1
  C  C87  1  0.97265200  0.31016754  0.70288180  1
  C  C88  1  0.40630312  0.33828893  0.13370222  1
  C  C89  1  0.59370340  0.66171224  0.86630411  1
  C  C90  1  0.37327319  0.28857599  0.21828031  1
  C  C91  1  0.62673796  0.71142801  0.78172736  1
  C  C92  1  0.51425965  0.27222902  0.26976508  1
  C  C93  1  0.48575556  0.72777544  0.73023980  1
  C  C94  1  0.68818066  0.30280454  0.23704099  1
  C  C95  1  0.31183362  0.69719751  0.76295962  1
  C  C96  1  0.71970157  0.35230554  0.15282409  1
  C  C97  1  0.28030871  0.64769288  0.84717454  1
  C  C98  1  0.57971822  0.37146051  0.10135059  1
  C  C99  1  0.42028805  0.62853811  0.89865080  1
  N  N100  1  0.51607683  0.59273907  0.38006120  1
  N  N101  1  0.48392369  0.40726006  0.61993692  1
  N  N102  1  0.28775106  0.58309531  0.55907799  1
  N  N103  1  0.71224321  0.41690426  0.44092030  1
  N  N104  1  0.30631374  0.10273118  0.50132793  1
  N  N105  1  0.69368672  0.89727258  0.49866724  1
  N  N106  1  0.69651945  0.10160175  0.48550844  1
  N  N107  1  0.30347502  0.89840199  0.51448662  1
  N  N108  1  0.49569714  0.99762745  0.64486188  1
  N  N109  1  0.50430178  0.00237672  0.35513917  1
  N  N110  1  0.31338214  0.41497626  0.44894302  1
  N  N111  1  0.68661730  0.58502319  0.55105434  1
  N  N112  1  0.01678499  0.83855297  0.20377652  1
  N  N113  1  0.98320581  0.16144402  0.79622389  1
  N  N114  1  0.26347567  0.35378573  0.07927028  1
  N  N115  1  0.73652524  0.64621337  0.92073907  1
  O  O116  1  0.01630567  0.88305099  0.27487266  1
  O  O117  1  0.98367063  0.11694623  0.72512850  1
  O  O118  1  0.01286310  0.87780320  0.12750579  1
  O  O119  1  0.98713440  0.12219354  0.87249409  1
  O  O120  1  0.12249951  0.30547190  0.09861012  1
  O  O121  1  0.87750514  0.69452541  0.90140200  1
  O  O122  1  0.28587660  0.41446833  0.01429352  1
  O  O123  1  0.71411709  0.58553054  0.98571514  1
