# generated using pymatgen
data_Cr2Co2NiH32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.37409788
_cell_length_b   9.72790994
_cell_length_c   13.68874029
_cell_angle_alpha   103.41582441
_cell_angle_beta   90.00000805
_cell_angle_gamma   90.00012498
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2Co2NiH32C12(NO2)6
_chemical_formula_sum   'Cr4 Co4 Ni2 H64 C24 N12 O24'
_cell_volume   1214.21811810
_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  0.09713630  0.85110627  0.72664312  1
  Cr  Cr1  1  0.59713755  0.64888865  0.77335557  1
  Cr  Cr2  1  0.90286404  0.14889335  0.27335696  1
  Cr  Cr3  1  0.40286297  0.35111274  0.22664455  1
  Co  Co4  1  0.94029090  0.55311676  0.73197530  1
  Co  Co5  1  0.44029153  0.94687723  0.76802460  1
  Co  Co6  1  0.05971011  0.44688391  0.26802679  1
  Co  Co7  1  0.55970924  0.05312234  0.23197280  1
  Ni  Ni8  1  0.00000006  1.00000030  0.99999955  1
  Ni  Ni9  1  0.50000023  0.49999978  0.50000052  1
  H  H10  1  0.18809532  0.18620677  0.08631548  1
  H  H11  1  0.68809352  0.31379413  0.41368409  1
  H  H12  1  0.81190365  0.81379397  0.91368396  1
  H  H13  1  0.31190613  0.68620569  0.58631671  1
  H  H14  1  0.27280483  0.09094356  0.98582614  1
  H  H15  1  0.77280590  0.40905663  0.51417125  1
  H  H16  1  0.72719570  0.90905449  0.01417553  1
  H  H17  1  0.22719538  0.59094550  0.48582760  1
  H  H18  1  0.58323390  0.37468199  0.86686442  1
  H  H19  1  0.08323791  0.12531226  0.63313657  1
  H  H20  1  0.41676449  0.62531862  0.13313644  1
  H  H21  1  0.91676027  0.87468779  0.36686271  1
  H  H22  1  0.47373956  0.16161503  0.88432722  1
  H  H23  1  -0.02626109  0.33837564  0.61567415  1
  H  H24  1  0.52626004  0.83838266  0.11566878  1
  H  H25  1  1.02626115  0.66162639  0.38432983  1
  H  H26  1  0.76581235  0.02864405  0.85429541  1
  H  H27  1  0.26581340  0.47135405  0.64570776  1
  H  H28  1  0.23418647  0.97135850  0.14570509  1
  H  H29  1  0.73418670  0.52864332  0.35429237  1
  H  H30  1  0.91891358  0.09200499  0.80300997  1
  H  H31  1  0.41891485  0.40799238  0.69699191  1
  H  H32  1  0.08108501  0.90799506  0.19698838  1
  H  H33  1  0.58108515  0.59200670  0.30300974  1
  H  H34  1  0.20829285  0.32812377  0.97110760  1
  H  H35  1  0.70829266  0.17187519  0.52889040  1
  H  H36  1  0.79170679  0.67187700  0.02889145  1
  H  H37  1  0.29170775  0.82812386  0.47111010  1
  H  H38  1  0.16338587  0.18244123  0.87251533  1
  H  H39  1  0.66338989  0.31755689  0.62748402  1
  H  H40  1  0.83661316  0.81755968  0.12748368  1
  H  H41  1  0.33660986  0.68244153  0.37251668  1
  H  H42  1  0.58304111  0.36588285  0.04199299  1
  H  H43  1  0.08304085  0.13411543  0.45800849  1
  H  H44  1  0.41695959  0.63411619  0.95800736  1
  H  H45  1  0.91696005  0.86588635  0.54199097  1
  H  H46  1  0.74027077  0.43765425  0.00336920  1
  H  H47  1  0.24027179  0.06234458  0.49663040  1
  H  H48  1  0.25972882  0.56234614  0.99663049  1
  H  H49  1  0.75972744  0.93765580  0.50337020  1
  H  H50  1  0.79662373  0.26709786  0.10337603  1
  H  H51  1  0.29662192  0.23290417  0.39662558  1
  H  H52  1  0.20337828  0.73290166  0.89662316  1
  H  H53  1  0.70338020  0.76709706  0.60337539  1
  H  H54  1  0.69348105  0.13308073  0.02582070  1
  H  H55  1  0.19347998  0.36691920  0.47418289  1
  H  H56  1  0.30651989  0.86691891  0.97417855  1
  H  H57  1  0.80652172  0.63308206  0.52581815  1
  H  H58  1  0.81141028  0.31779872  0.80327742  1
  H  H59  1  0.31141260  0.18219810  0.69672356  1
  H  H60  1  0.18858832  0.68220276  0.19672197  1
  H  H61  1  0.68858645  0.81779951  0.30327622  1
  H  H62  1  0.69329789  0.17955041  0.74777713  1
  H  H63  1  0.19330050  0.32044512  0.75222472  1
  H  H64  1  0.30670000  0.82045108  0.25222292  1
  H  H65  1  0.80669885  0.67955287  0.24777530  1
  H  H66  1  0.97720457  0.41223376  0.10129096  1
  H  H67  1  0.47720585  0.08776826  0.39870780  1
  H  H68  1  0.02279033  0.58776598  0.89870738  1
  H  H69  1  0.52278764  0.91223205  0.60129330  1
  H  H70  1  0.96368346  0.37262252  0.93352409  1
  H  H71  1  0.46368429  0.12737606  0.56647566  1
  H  H72  1  0.03631759  0.62737676  0.06647411  1
  H  H73  1  0.53631733  0.87262474  0.43352558  1
  C  C74  1  0.82977474  0.12300130  0.85479172  1
  C  C75  1  0.32977555  0.37699650  0.64521018  1
  C  C76  1  0.17022494  0.87700013  0.14520747  1
  C  C77  1  0.67022525  0.62300200  0.35479070  1
  C  C78  1  0.13991139  0.23345737  0.95164572  1
  C  C79  1  0.63991234  0.26654193  0.54835381  1
  C  C80  1  0.86008886  0.76654317  0.04835370  1
  C  C81  1  0.36008849  0.73345734  0.45164643  1
  C  C82  1  0.67626160  0.33964533  0.99254552  1
  C  C83  1  0.17626235  0.16035296  0.50745582  1
  C  C84  1  0.32373831  0.66035438  0.00745448  1
  C  C85  1  0.82373775  0.83964806  0.49254445  1
  C  C86  1  0.75984202  0.22563049  0.02652389  1
  C  C87  1  0.25984117  0.27436943  0.47347813  1
  C  C88  1  0.24015888  0.77436929  0.97347538  1
  C  C89  1  0.74015978  0.72563145  0.52652272  1
  C  C90  1  0.74210069  0.23357661  0.81933467  1
  C  C91  1  0.24210251  0.26641982  0.68066696  1
  C  C92  1  0.25789834  0.76642447  0.18066507  1
  C  C93  1  0.75789700  0.73357870  0.31933327  1
  C  C94  1  0.99037395  0.27857348  0.96272015  1
  C  C95  1  0.49037415  0.22142616  0.53728020  1
  C  C96  1  0.00962706  0.72142487  0.03727765  1
  C  C97  1  0.50962730  0.77857558  0.46272130  1
  N  N98  1  0.88361147  0.17541681  0.95948199  1
  N  N99  1  0.38361133  0.32458229  0.54051975  1
  N  N100  1  0.11638849  0.82458366  0.04051672  1
  N  N101  1  0.61638913  0.67541725  0.45948146  1
  N  N102  1  0.17502948  0.13198690  0.01278601  1
  N  N103  1  0.67502966  0.36801277  0.48721390  1
  N  N104  1  0.82497130  0.86801440  0.98721328  1
  N  N105  1  0.32497162  0.63198630  0.51278705  1
  N  N106  1  0.62851113  0.29071254  0.88950061  1
  N  N107  1  0.12851303  0.20928363  0.61050074  1
  N  N108  1  0.37148787  0.70928822  0.11049932  1
  N  N109  1  0.87148574  0.79071703  0.38949935  1
  O  O110  1  0.05454035  0.89838575  0.84866512  1
  O  O111  1  0.55454455  0.60161168  0.65133276  1
  O  O112  1  0.94545974  0.10161479  0.15133474  1
  O  O113  1  0.44545578  0.39838770  0.34866781  1
  O  O114  1  0.03062991  0.96591855  0.66729832  1
  O  O115  1  0.53062744  0.53407513  0.83269808  1
  O  O116  1  0.96936967  0.03408018  0.33270107  1
  O  O117  1  0.46937239  0.46592794  0.16730364  1
  O  O118  1  0.89394517  0.40775528  0.62641307  1
  O  O119  1  0.39394498  0.09223573  0.87358834  1
  O  O120  1  0.10605251  0.59224390  0.37359189  1
  O  O121  1  0.60605192  0.90776450  0.12640625  1
  O  O122  1  0.03330527  0.68811931  0.67165719  1
  O  O123  1  0.53330888  0.81187554  0.82834200  1
  O  O124  1  0.96669418  0.31187978  0.32834346  1
  O  O125  1  0.46669175  0.18812720  0.17165704  1
  O  O126  1  0.27747381  0.83951034  0.71031243  1
  O  O127  1  0.77747457  0.66048166  0.78968935  1
  O  O128  1  0.72252649  0.16048804  0.28968668  1
  O  O129  1  0.22252588  0.33952003  0.21031182  1
  O  O130  1  0.03518477  0.50938354  0.83930971  1
  O  O131  1  0.53518281  0.99061471  0.66069106  1
  O  O132  1  0.96481823  0.49061414  0.16068979  1
  O  O133  1  0.46481958  0.00938757  0.33930891  1
