# generated using pymatgen
data_MnCr2Co2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.37845386
_cell_length_b   9.74229355
_cell_length_c   13.69129716
_cell_angle_alpha   103.48871309
_cell_angle_beta   89.99996124
_cell_angle_gamma   90.00011074
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCr2Co2H32C12(NO2)6
_chemical_formula_sum   'Mn2 Cr4 Co4 H64 C24 N12 O24'
_cell_volume   1216.43554113
_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
  Cr  Cr0  1  0.09502260  0.85449836  0.72957310  1
  Cr  Cr1  1  0.59503434  0.64548188  0.77042415  1
  Cr  Cr2  1  0.90497883  0.14549659  0.27042734  1
  Cr  Cr3  1  0.40496222  0.35452423  0.22957240  1
  Co  Co4  1  0.94009868  0.55448274  0.73199463  1
  Co  Co5  1  0.44011696  0.94548270  0.76798059  1
  Co  Co6  1  0.05990649  0.44553703  0.26804057  1
  Co  Co7  1  0.55989258  0.05450467  0.23199153  1
  Mn  Mn8  1  -0.00000026  1.00000505  0.99999846  1
  Mn  Mn9  1  0.49999872  0.49999514  0.49999846  1
  H  H10  1  0.19412591  0.19393614  0.08479462  1
  H  H11  1  0.69411579  0.30606220  0.41517738  1
  H  H12  1  0.80588032  0.80605154  0.91518485  1
  H  H13  1  0.30590040  0.69394993  0.58483759  1
  H  H14  1  0.27587284  0.09882341  0.98182604  1
  H  H15  1  0.77586234  0.40116862  0.51815579  1
  H  H16  1  0.72413603  0.90116052  0.01816290  1
  H  H17  1  0.22414012  0.59885313  0.48185490  1
  H  H18  1  0.57490312  0.37766697  0.86559306  1
  H  H19  1  0.07491247  0.12233333  0.63440859  1
  H  H20  1  0.42508925  0.62233414  0.13440733  1
  H  H21  1  0.92508159  0.87766470  0.36558887  1
  H  H22  1  0.47477008  0.15965001  0.88393596  1
  H  H23  1  -0.02525384  0.34030372  0.61603235  1
  H  H24  1  0.52525027  0.84031498  0.11602938  1
  H  H25  1  1.02528183  0.65974336  0.38401123  1
  H  H26  1  0.76325097  0.03472285  0.85214935  1
  H  H27  1  0.26329170  0.46529546  0.64785941  1
  H  H28  1  0.23671680  0.96529618  0.14786014  1
  H  H29  1  0.73668351  0.53469385  0.35213630  1
  H  H30  1  0.91486239  0.10034735  0.80067041  1
  H  H31  1  0.41491567  0.39959964  0.69928896  1
  H  H32  1  0.08508808  0.89960488  0.19928912  1
  H  H33  1  0.58504781  0.60043477  0.30074152  1
  H  H34  1  0.20606904  0.33426124  0.96819021  1
  H  H35  1  0.70607132  0.16573378  0.53178180  1
  H  H36  1  0.79393156  0.66572790  0.03179272  1
  H  H37  1  0.29393282  0.83427004  0.46822789  1
  H  H38  1  0.16193686  0.18689788  0.87057257  1
  H  H39  1  0.66192903  0.31306540  0.62941794  1
  H  H40  1  0.83807929  0.81306352  0.12942421  1
  H  H41  1  0.33807930  0.68695245  0.37058317  1
  H  H42  1  0.57669251  0.36908847  0.04091272  1
  H  H43  1  0.07666907  0.13089705  0.45909062  1
  H  H44  1  0.42333540  0.63090259  0.95909320  1
  H  H45  1  0.92335089  0.86911164  0.54090480  1
  H  H46  1  0.73232279  0.44285399  0.00168202  1
  H  H47  1  0.23230840  0.05714296  0.49830204  1
  H  H48  1  0.26769530  0.55714050  0.99829761  1
  H  H49  1  0.76770188  0.94285824  0.50171080  1
  H  H50  1  0.79301035  0.27378788  0.10156513  1
  H  H51  1  0.29293408  0.22621485  0.39840192  1
  H  H52  1  0.20706403  0.72621358  0.89840196  1
  H  H53  1  0.70711567  0.77378596  0.60161994  1
  H  H54  1  0.69242429  0.13786332  0.02334903  1
  H  H55  1  0.19240472  0.36212858  0.47665417  1
  H  H56  1  0.30759946  0.86212852  0.97664974  1
  H  H57  1  0.80761460  0.63787668  0.52334908  1
  H  H58  1  0.80393912  0.32513915  0.80275661  1
  H  H59  1  0.30393113  0.17483862  0.69723884  1
  H  H60  1  0.19606210  0.67484294  0.19723753  1
  H  H61  1  0.69606864  0.82517045  0.30276335  1
  H  H62  1  0.68797112  0.18576475  0.74579417  1
  H  H63  1  0.18801174  0.31425372  0.75419164  1
  H  H64  1  0.31198674  0.81424490  0.25419655  1
  H  H65  1  0.81195764  0.68574385  0.24581458  1
  H  H66  1  0.97775871  0.41120767  0.10170779  1
  H  H67  1  0.47787980  0.08886928  0.39828060  1
  H  H68  1  0.02212867  0.58885488  0.89828960  1
  H  H69  1  0.52204077  0.91108344  0.60173810  1
  H  H70  1  0.96620631  0.37970144  0.93111496  1
  H  H71  1  0.46618439  0.12030837  0.56892121  1
  H  H72  1  0.03383454  0.62032626  0.06893765  1
  H  H73  1  0.53385151  0.87968039  0.43106007  1
  C  C74  1  0.82531782  0.13010302  0.85250198  1
  C  C75  1  0.32535023  0.36988811  0.64747974  1
  C  C76  1  0.17465329  0.86989172  0.14747931  1
  C  C77  1  0.67462768  0.63012049  0.35252627  1
  C  C78  1  0.13875379  0.23901757  0.94966891  1
  C  C79  1  0.63878752  0.26097412  0.55031307  1
  C  C80  1  0.86121689  0.76097157  0.05031878  1
  C  C81  1  0.36120242  0.73902795  0.44968960  1
  C  C82  1  0.66955903  0.34427940  0.99107858  1
  C  C83  1  0.16954634  0.15571607  0.50891096  1
  C  C84  1  0.33045389  0.65571661  0.00891090  1
  C  C85  1  0.83046355  0.84428686  0.49109539  1
  C  C86  1  0.75635929  0.23217156  0.02451289  1
  C  C87  1  0.25633823  0.26781708  0.47547486  1
  C  C88  1  0.24366350  0.76781776  0.97547298  1
  C  C89  1  0.74368212  0.73218920  0.52453471  1
  C  C90  1  0.73564401  0.23959908  0.81764030  1
  C  C91  1  0.23566021  0.26039330  0.68234617  1
  C  C92  1  0.26433890  0.76039211  0.18234605  1
  C  C93  1  0.76432652  0.73961258  0.31766363  1
  C  C94  1  0.98910753  0.28497232  0.96059855  1
  C  C95  1  0.48907829  0.21504286  0.53947230  1
  C  C96  1  0.01092702  0.71504709  0.03946863  1
  C  C97  1  0.51094560  0.78492842  0.46046729  1
  N  N98  1  0.87918966  0.18535314  0.95652663  1
  N  N99  1  0.37917898  0.31465282  0.54344732  1
  N  N100  1  0.12082385  0.81466060  0.04344614  1
  N  N101  1  0.62084143  0.68532503  0.45657461  1
  N  N102  1  0.17857916  0.13954615  0.01143857  1
  N  N103  1  0.67855215  0.36045467  0.48855022  1
  N  N104  1  0.82144455  0.86044780  0.98855678  1
  N  N105  1  0.32146757  0.63954597  0.51145539  1
  N  N106  1  0.62167882  0.29426838  0.88813323  1
  N  N107  1  0.12168278  0.20572675  0.61186042  1
  N  N108  1  0.37831611  0.70572743  0.11186132  1
  N  N109  1  0.87831218  0.79427579  0.38814230  1
  O  O110  1  0.05376186  0.90308945  0.85334332  1
  O  O111  1  0.55379491  0.59687838  0.64665141  1
  O  O112  1  0.94622738  0.09689486  0.14665736  1
  O  O113  1  0.44618751  0.40313055  0.35334596  1
  O  O114  1  0.02392259  0.96723584  0.67028532  1
  O  O115  1  0.52391817  0.53277268  0.82972816  1
  O  O116  1  0.97607328  0.03275615  0.32970893  1
  O  O117  1  0.47607806  0.46723547  0.17027584  1
  O  O118  1  0.89612344  0.41090476  0.62457509  1
  O  O119  1  0.39614829  0.08905180  0.87538314  1
  O  O120  1  0.10388719  0.58912195  0.37547591  1
  O  O121  1  0.60386601  0.91092169  0.12457600  1
  O  O122  1  0.03380848  0.69072472  0.67484617  1
  O  O123  1  0.53383359  0.80926168  0.82513864  1
  O  O124  1  0.96619969  0.30926703  0.32516260  1
  O  O125  1  0.46616723  0.19074630  0.17485387  1
  O  O126  1  0.27506972  0.84384789  0.70987667  1
  O  O127  1  0.77508447  0.65611750  0.79012890  1
  O  O128  1  0.72493042  0.15611645  0.29011921  1
  O  O129  1  0.22490892  0.34392637  0.20987087  1
  O  O130  1  0.03568207  0.51076512  0.83888956  1
  O  O131  1  0.53564698  0.98923389  0.66108692  1
  O  O132  1  0.96427080  0.48925403  0.16115649  1
  O  O133  1  0.46430999  0.01077506  0.33888242  1
