# generated using pymatgen
data_Mn2Cr2NiH32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.37190184
_cell_length_b   9.72912332
_cell_length_c   13.68816315
_cell_angle_alpha   103.39131451
_cell_angle_beta   90.00004398
_cell_angle_gamma   90.00016544
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2Cr2NiH32C12(NO2)6
_chemical_formula_sum   'Mn4 Cr4 Ni2 H64 C24 N12 O24'
_cell_volume   1214.15766080
_cell_formula_units_Z   2
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  0.09161528  0.85473461  0.73311852  1
  Mn  Mn1  1  0.59161470  0.64524649  0.76688637  1
  Mn  Mn2  1  0.90838454  0.14526782  0.26688183  1
  Mn  Mn3  1  0.40837478  0.35474840  0.23311396  1
  Cr  Cr4  1  0.95345927  0.55104723  0.71987396  1
  Cr  Cr5  1  0.45346051  0.94893088  0.78012419  1
  Cr  Cr6  1  0.04653880  0.44895329  0.28012647  1
  Cr  Cr7  1  0.54653693  0.05107273  0.21987526  1
  Ni  Ni8  1  0.00000763  0.99997437  1.00000525  1
  Ni  Ni9  1  0.50007494  0.50005993  0.49997645  1
  H  H10  1  0.17970428  0.19459490  0.09188728  1
  H  H11  1  0.67969393  0.30540285  0.40810822  1
  H  H12  1  0.82029595  0.80540445  0.90811220  1
  H  H13  1  0.32030966  0.69459600  0.59189202  1
  H  H14  1  0.27418634  0.09926479  0.99616176  1
  H  H15  1  0.77418346  0.40073120  0.50383025  1
  H  H16  1  0.72581411  0.90073515  0.00383797  1
  H  H17  1  0.22582307  0.59926542  0.49616926  1
  H  H18  1  0.52861682  0.46831647  0.88407943  1
  H  H19  1  0.02859386  0.03168176  0.61588901  1
  H  H20  1  0.47136987  0.53168380  0.11594166  1
  H  H21  1  0.97140575  0.96831924  0.38411028  1
  H  H22  1  0.54340126  0.22834308  0.89230503  1
  H  H23  1  0.04339262  0.27164902  0.60768626  1
  H  H24  1  0.45659720  0.77165880  0.10769156  1
  H  H25  1  0.95660829  0.72835350  0.39231349  1
  H  H26  1  0.77649316  0.03704273  0.84767329  1
  H  H27  1  0.27648580  0.46294860  0.65232693  1
  H  H28  1  0.22350626  0.96295892  0.15232329  1
  H  H29  1  0.72351629  0.53704849  0.34767422  1
  H  H30  1  0.92553832  0.11632982  0.80493414  1
  H  H31  1  0.42552555  0.38364976  0.69506838  1
  H  H32  1  0.07446165  0.88366996  0.19506174  1
  H  H33  1  0.57447709  0.61635217  0.30493282  1
  H  H34  1  0.21574681  0.32856378  0.96703857  1
  H  H35  1  0.71574262  0.17143688  0.53295614  1
  H  H36  1  0.78425340  0.67143418  0.03296002  1
  H  H37  1  0.28425731  0.82856602  0.46704372  1
  H  H38  1  0.15432202  0.18024962  0.87581078  1
  H  H39  1  0.65432082  0.31974754  0.62418674  1
  H  H40  1  0.84567854  0.81974818  0.12418856  1
  H  H41  1  0.34567882  0.68025278  0.37581283  1
  H  H42  1  0.58432325  0.38905081  0.06303884  1
  H  H43  1  0.08434715  0.11097486  0.43695617  1
  H  H44  1  0.41566074  0.61095952  0.93696362  1
  H  H45  1  0.91565370  0.88902691  0.56304464  1
  H  H46  1  0.74987300  0.43506887  0.00350590  1
  H  H47  1  0.24987683  0.06490960  0.49648675  1
  H  H48  1  0.25012600  0.56492451  0.99649105  1
  H  H49  1  0.75012150  0.93509089  0.50351322  1
  H  H50  1  0.79854467  0.25692642  0.10430737  1
  H  H51  1  0.29853563  0.24307306  0.39569104  1
  H  H52  1  0.20145873  0.74306856  0.89568910  1
  H  H53  1  0.70146810  0.75693326  0.60431195  1
  H  H54  1  0.69136252  0.13171376  0.02287819  1
  H  H55  1  0.19134993  0.36827194  0.47712205  1
  H  H56  1  0.30864023  0.86828205  0.97711725  1
  H  H57  1  0.80865111  0.63172903  0.52288076  1
  H  H58  1  0.80104841  0.33728803  0.81500580  1
  H  H59  1  0.30103996  0.16269959  0.68498926  1
  H  H60  1  0.19895120  0.66271306  0.18499067  1
  H  H61  1  0.69895913  0.83729909  0.31500935  1
  H  H62  1  0.69150346  0.19589067  0.75212559  1
  H  H63  1  0.19148510  0.30409124  0.74786807  1
  H  H64  1  0.30849799  0.80411040  0.24787127  1
  H  H65  1  0.80851476  0.69590682  0.25213232  1
  H  H66  1  0.98387374  0.35529158  0.05294724  1
  H  H67  1  0.48386973  0.14470601  0.44705167  1
  H  H68  1  0.01612699  0.64470677  0.94705060  1
  H  H69  1  0.51613192  0.85529525  0.55294842  1
  H  H70  1  0.97042462  0.36618793  0.92388237  1
  H  H71  1  0.47042386  0.13381168  0.57611563  1
  H  H72  1  0.02957802  0.63381104  0.07611518  1
  H  H73  1  0.52957935  0.86618761  0.42388424  1
  C  C74  1  0.83426456  0.13698494  0.85580325  1
  C  C75  1  0.33425680  0.36300466  0.64419487  1
  C  C76  1  0.16573638  0.86301620  0.14419397  1
  C  C77  1  0.66574862  0.63699429  0.35580241  1
  C  C78  1  0.14177983  0.23831453  0.95405800  1
  C  C79  1  0.64177562  0.26168527  0.54593899  1
  C  C80  1  0.85822017  0.76168247  0.04594132  1
  C  C81  1  0.35822238  0.73831736  0.45406113  1
  C  C82  1  0.68062511  0.34233307  0.99719941  1
  C  C83  1  0.18062342  0.15764680  0.50279496  1
  C  C84  1  0.31937499  0.65766079  0.00279840  1
  C  C85  1  0.81937514  0.84235377  0.49720515  1
  C  C86  1  0.76107314  0.22353997  0.02714723  1
  C  C87  1  0.26107198  0.27645237  0.47285296  1
  C  C88  1  0.23892870  0.77645626  0.97284948  1
  C  C89  1  0.73893241  0.72355099  0.52715071  1
  C  C90  1  0.73748497  0.24657186  0.82497425  1
  C  C91  1  0.23747298  0.25341659  0.67502089  1
  C  C92  1  0.26251532  0.75342932  0.17502324  1
  C  C93  1  0.76252702  0.74658408  0.32497896  1
  C  C94  1  0.99141693  0.29527011  0.97448906  1
  C  C95  1  0.49141297  0.20473071  0.52550922  1
  C  C96  1  0.00858302  0.70472757  0.02550837  1
  C  C97  1  0.50858481  0.79527333  0.47449128  1
  N  N98  1  0.88449678  0.18002332  0.96032935  1
  N  N99  1  0.38449175  0.31997386  0.53967084  1
  N  N100  1  0.11550286  0.81997679  0.03966658  1
  N  N101  1  0.61550764  0.68002280  0.46033137  1
  N  N102  1  0.17594782  0.14120386  0.01776647  1
  N  N103  1  0.67594557  0.35879808  0.48223116  1
  N  N104  1  0.82405250  0.85879205  0.98223219  1
  N  N105  1  0.32405906  0.64120603  0.51776809  1
  N  N106  1  0.62442068  0.30138864  0.89727821  1
  N  N107  1  0.12441714  0.19859522  0.60271529  1
  N  N108  1  0.37558003  0.69860912  0.10272061  1
  N  N109  1  0.87558244  0.80140294  0.39728521  1
  O  O110  1  0.04984837  0.92075468  0.87004684  1
  O  O111  1  0.54983527  0.57925742  0.62995604  1
  O  O112  1  0.95015007  0.07927967  0.12994703  1
  O  O113  1  0.45007063  0.42066189  0.37007589  1
  O  O114  1  -0.00881396  0.94157723  0.62803131  1
  O  O115  1  0.49116422  0.55841204  0.87196089  1
  O  O116  1  1.00881587  0.05842197  0.37196658  1
  O  O117  1  0.50885662  0.44160192  0.12805862  1
  O  O118  1  0.90050080  0.40793307  0.63767285  1
  O  O119  1  0.40050217  0.09204004  0.86233366  1
  O  O120  1  0.09950005  0.59206650  0.36232946  1
  O  O121  1  0.59949177  0.90796482  0.13766275  1
  O  O122  1  0.05504164  0.64794714  0.65858777  1
  O  O123  1  0.55503865  0.85203291  0.84141235  1
  O  O124  1  0.94494986  0.35205612  0.34141088  1
  O  O125  1  0.44496160  0.14797450  0.15858806  1
  O  O126  1  0.31228054  0.85162641  0.72450694  1
  O  O127  1  0.81228729  0.64836668  0.77548806  1
  O  O128  1  0.68771916  0.14837134  0.27549426  1
  O  O129  1  0.18770733  0.35162937  0.22451371  1
  O  O130  1  0.04997228  0.50464764  0.80662476  1
  O  O131  1  0.54997609  0.99534639  0.69338169  1
  O  O132  1  0.95003618  0.49535756  0.19337413  1
  O  O133  1  0.45002047  0.00465444  0.30661631  1
