# generated using pymatgen
data_Mn2Co2NiH32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35899492
_cell_length_b   9.71076798
_cell_length_c   13.65841293
_cell_angle_alpha   103.42427934
_cell_angle_beta   90.00001841
_cell_angle_gamma   90.00013147
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2Co2NiH32C12(NO2)6
_chemical_formula_sum   'Mn4 Co4 Ni2 H64 C24 N12 O24'
_cell_volume   1207.40212609
_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  0.09436264  0.85528698  0.72755382  1
  Mn  Mn1  1  0.59436462  0.64470657  0.77244249  1
  Mn  Mn2  1  0.90563682  0.14471238  0.27244547  1
  Mn  Mn3  1  0.40563520  0.35529528  0.22755971  1
  Co  Co4  1  0.93782134  0.55698715  0.73097758  1
  Co  Co5  1  0.43782248  0.94300513  0.76902437  1
  Co  Co6  1  0.06217829  0.44301265  0.26902304  1
  Co  Co7  1  0.56217646  0.05699660  0.23097496  1
  Ni  Ni8  1  -0.00000006  1.00000013  0.99999968  1
  Ni  Ni9  1  0.50000022  0.49999988  0.50000055  1
  H  H10  1  0.18879318  0.18912887  0.08729866  1
  H  H11  1  0.68879267  0.31087282  0.41270051  1
  H  H12  1  0.81120748  0.81087161  0.91270069  1
  H  H13  1  0.31120866  0.68912722  0.58730014  1
  H  H14  1  0.27480035  0.09286590  0.98778709  1
  H  H15  1  0.77480127  0.40713569  0.51221151  1
  H  H16  1  0.72519976  0.90713455  0.01221265  1
  H  H17  1  0.22519891  0.59286462  0.48778943  1
  H  H18  1  0.58266682  0.38165828  0.87084825  1
  H  H19  1  0.08266806  0.11833568  0.62914922  1
  H  H20  1  0.41733349  0.61834308  0.12915146  1
  H  H21  1  0.91733158  0.88166370  0.37085021  1
  H  H22  1  0.47386412  0.16480467  0.88140128  1
  H  H23  1  -0.02613751  0.33518791  0.61859960  1
  H  H24  1  0.52613508  0.83519743  0.11859691  1
  H  H25  1  1.02613713  0.66481246  0.38140212  1
  H  H26  1  0.76109846  0.03048916  0.85512632  1
  H  H27  1  0.26109839  0.46950754  0.64487572  1
  H  H28  1  0.23890128  0.96951238  0.14487289  1
  H  H29  1  0.73890259  0.53049077  0.35512521  1
  H  H30  1  0.91349427  0.09062270  0.80117379  1
  H  H31  1  0.41349276  0.40937415  0.69882823  1
  H  H32  1  0.08650600  0.90937756  0.19882560  1
  H  H33  1  0.58650852  0.59062395  0.30117209  1
  H  H34  1  0.20838156  0.32814320  0.97045385  1
  H  H35  1  0.70838253  0.17185659  0.52954454  1
  H  H36  1  0.79161772  0.67185708  0.02954533  1
  H  H37  1  0.29161784  0.82814316  0.47045576  1
  H  H38  1  0.16575302  0.18100934  0.87216651  1
  H  H39  1  0.66575569  0.31899005  0.62783291  1
  H  H40  1  0.83424513  0.81899063  0.12783299  1
  H  H41  1  0.33424368  0.68100900  0.37216766  1
  H  H42  1  0.58368514  0.36795894  0.04711739  1
  H  H43  1  0.08368565  0.13203890  0.45288287  1
  H  H44  1  0.41631436  0.63203983  0.95288224  1
  H  H45  1  0.91631381  0.86796320  0.54711714  1
  H  H46  1  0.74102775  0.43987781  0.00814868  1
  H  H47  1  0.24103139  0.06012016  0.49185083  1
  H  H48  1  0.25897067  0.56012187  0.99185162  1
  H  H49  1  0.75896737  0.93987983  0.50814844  1
  H  H50  1  0.79967116  0.26378535  0.10452745  1
  H  H51  1  0.29967192  0.23621613  0.39547357  1
  H  H52  1  0.20032786  0.73621386  0.89547196  1
  H  H53  1  0.70032825  0.76378456  0.60452708  1
  H  H54  1  0.69400294  0.13295390  0.02622591  1
  H  H55  1  0.19400227  0.36704410  0.47377628  1
  H  H56  1  0.30599676  0.86704522  0.97377325  1
  H  H57  1  0.80599864  0.63295688  0.52622428  1
  H  H58  1  0.80926180  0.31881721  0.80242295  1
  H  H59  1  0.30926214  0.18117745  0.69757464  1
  H  H60  1  0.19073926  0.68118429  0.19757613  1
  H  H61  1  0.69073843  0.81882022  0.30242558  1
  H  H62  1  0.68584101  0.18324134  0.75066882  1
  H  H63  1  0.18584149  0.31675180  0.74933121  1
  H  H64  1  0.31416048  0.81676028  0.24933042  1
  H  H65  1  0.81416013  0.68324596  0.25066931  1
  H  H66  1  0.97741336  0.41510148  0.10504761  1
  H  H67  1  0.47741508  0.08490069  0.39495052  1
  H  H68  1  0.02258666  0.58489781  0.89495259  1
  H  H69  1  0.52258495  0.91509958  0.60504874  1
  H  H70  1  0.96517731  0.37321341  0.93265140  1
  H  H71  1  0.46517919  0.12678696  0.56734985  1
  H  H72  1  0.03482207  0.62678749  0.06734989  1
  H  H73  1  0.53482108  0.87321229  0.43264917  1
  C  C74  1  0.82629597  0.12379318  0.85464842  1
  C  C75  1  0.32629547  0.37620332  0.64535251  1
  C  C76  1  0.17370435  0.87620746  0.14535097  1
  C  C77  1  0.67370479  0.62379530  0.35464788  1
  C  C78  1  0.14087899  0.23276905  0.95115549  1
  C  C79  1  0.64088078  0.26723125  0.54884397  1
  C  C80  1  0.85912014  0.76723145  0.04884419  1
  C  C81  1  0.35911919  0.73276836  0.45115635  1
  C  C82  1  0.67631367  0.34206953  0.99631273  1
  C  C83  1  0.17631282  0.15792573  0.50368477  1
  C  C84  1  0.32368655  0.65792933  0.00368573  1
  C  C85  1  0.82368707  0.84207535  0.49631543  1
  C  C86  1  0.76067056  0.22577331  0.02775822  1
  C  C87  1  0.26067106  0.27422499  0.47224262  1
  C  C88  1  0.23932888  0.77422572  0.97224086  1
  C  C89  1  0.73932902  0.72577534  0.52775760  1
  C  C90  1  0.73915103  0.23658471  0.82078129  1
  C  C91  1  0.23915154  0.26341032  0.67921833  1
  C  C92  1  0.26084979  0.76341659  0.17921786  1
  C  C93  1  0.76084923  0.73658822  0.32078210  1
  C  C94  1  0.99073906  0.27771471  0.96085154  1
  C  C95  1  0.49074006  0.22228489  0.53914904  1
  C  C96  1  0.00926052  0.72228608  0.03914912  1
  C  C97  1  0.50926019  0.77771406  0.46085016  1
  N  N98  1  0.88321721  0.17649142  0.95876609  1
  N  N99  1  0.38321798  0.32350826  0.54123527  1
  N  N100  1  0.11678225  0.82350886  0.04123343  1
  N  N101  1  0.61678249  0.67649118  0.45876498  1
  N  N102  1  0.17648961  0.13344580  0.01372097  1
  N  N103  1  0.67649048  0.36655550  0.48627864  1
  N  N104  1  0.82351037  0.86655470  0.98627836  1
  N  N105  1  0.32351022  0.63344434  0.51372209  1
  N  N106  1  0.62873258  0.29666978  0.89281423  1
  N  N107  1  0.12873340  0.20332463  0.60718443  1
  N  N108  1  0.37126782  0.70333057  0.10718459  1
  N  N109  1  0.87126646  0.79667441  0.39281608  1
  O  O110  1  0.05485959  0.90109433  0.85185393  1
  O  O111  1  0.55486759  0.59891267  0.64814127  1
  O  O112  1  0.94513928  0.09890600  0.14814528  1
  O  O113  1  0.44513065  0.40108478  0.35186122  1
  O  O114  1  0.02071445  0.96367839  0.66215169  1
  O  O115  1  0.52071164  0.53630542  0.83783331  1
  O  O116  1  0.97928484  0.03632005  0.33784640  1
  O  O117  1  0.47928803  0.46370086  0.16217275  1
  O  O118  1  0.89193456  0.40234934  0.63028478  1
  O  O119  1  0.39193805  0.09764084  0.86972007  1
  O  O120  1  0.10806360  0.59764939  0.36971742  1
  O  O121  1  0.60805856  0.90236298  0.13027662  1
  O  O122  1  0.04181717  0.68161224  0.67299186  1
  O  O123  1  0.54181670  0.81837872  0.82700832  1
  O  O124  1  0.95818298  0.31838629  0.32700782  1
  O  O125  1  0.45818532  0.18162421  0.17299134  1
  O  O126  1  0.27884502  0.84065658  0.70824103  1
  O  O127  1  0.77884496  0.65933503  0.79176215  1
  O  O128  1  0.72115510  0.15934269  0.29175908  1
  O  O129  1  0.22115536  0.34066644  0.20823841  1
  O  O130  1  0.03396746  0.50457396  0.83656658  1
  O  O131  1  0.53396351  0.99542286  0.66343565  1
  O  O132  1  0.96603334  0.49542553  0.16343374  1
  O  O133  1  0.46603631  0.00457773  0.33656359  1
