# generated using pymatgen
data_Ni5H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.31944373
_cell_length_b   9.67691913
_cell_length_c   13.61548911
_cell_angle_alpha   103.62034329
_cell_angle_beta   90.00008919
_cell_angle_gamma   90.00000341
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni5H32C12(NO2)6
_chemical_formula_sum   'Ni10 H64 C24 N12 O24'
_cell_volume   1193.36103969
_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
  Ni  Ni0  1  0.10405609  0.82906361  0.74411442  1
  Ni  Ni1  1  0.60406004  0.67092097  0.75588449  1
  Ni  Ni2  1  0.89591956  0.17101681  0.25591116  1
  Ni  Ni3  1  0.39592440  0.32899799  0.24409722  1
  Ni  Ni4  1  0.93527401  0.55550321  0.73592594  1
  Ni  Ni5  1  0.43527127  0.94445857  0.76408195  1
  Ni  Ni6  1  0.06465895  0.44458873  0.26411060  1
  Ni  Ni7  1  0.56467735  0.05543373  0.23588820  1
  Ni  Ni8  1  0.00061737  0.99967431  1.00026933  1
  Ni  Ni9  1  0.50063686  0.50032150  0.49973610  1
  H  H10  1  0.17316454  0.21114646  0.10507732  1
  H  H11  1  0.67312210  0.28886288  0.39491282  1
  H  H12  1  0.82686382  0.78893513  0.89516604  1
  H  H13  1  0.32691733  0.71105492  0.60484886  1
  H  H14  1  0.25912344  0.11150480  1.00368327  1
  H  H15  1  0.75911959  0.38850252  0.49628734  1
  H  H16  1  0.74109060  0.88860292  -0.00340514  1
  H  H17  1  0.24112727  0.61138639  0.50343918  1
  H  H18  1  0.55285585  0.45096544  0.85551853  1
  H  H19  1  0.05283178  0.04902622  0.64448149  1
  H  H20  1  0.44698869  0.54913846  0.14444998  1
  H  H21  1  0.94701633  0.95084941  0.35554358  1
  H  H22  1  0.51637440  0.22751000  0.88298270  1
  H  H23  1  0.01636856  0.27250541  0.61701194  1
  H  H24  1  0.48348304  0.77248702  0.11693314  1
  H  H25  1  0.98350510  0.72750918  0.38306500  1
  H  H26  1  0.73626503  0.01391861  0.85702743  1
  H  H27  1  0.23625987  0.48607272  0.64300258  1
  H  H28  1  0.26374869  0.98625957  0.14307204  1
  H  H29  1  0.76377646  0.51375360  0.35691427  1
  H  H30  1  0.88701348  0.05869700  0.79081558  1
  H  H31  1  0.38699392  0.44128165  0.70922762  1
  H  H32  1  0.11293209  0.94153538  0.20928473  1
  H  H33  1  0.61296278  0.55847697  0.29069279  1
  H  H34  1  0.20312742  0.32688463  0.95692360  1
  H  H35  1  0.70313223  0.17312609  0.54305258  1
  H  H36  1  0.79699056  0.67275524  0.04297238  1
  H  H37  1  0.29698873  0.82722691  0.45704032  1
  H  H38  1  0.27285184  0.10757030  0.85201712  1
  H  H39  1  0.77283935  0.39246860  0.64796102  1
  H  H40  1  0.72718662  0.89232575  0.14800650  1
  H  H41  1  0.22719637  0.60765636  0.35201088  1
  H  H42  1  0.54396290  0.41262541  0.10145417  1
  H  H43  1  0.04402109  0.08733033  0.39854340  1
  H  H44  1  0.45625896  0.58773815  0.89865583  1
  H  H45  1  0.95630234  0.91221051  0.60131930  1
  H  H46  1  0.70798004  0.44170851  0.00110551  1
  H  H47  1  0.20785658  0.05827822  0.49883749  1
  H  H48  1  0.29121936  0.55851707  0.99913176  1
  H  H49  1  0.79116305  0.94148745  0.50081716  1
  H  H50  1  0.80783195  0.27201338  0.09214021  1
  H  H51  1  0.30784472  0.22798837  0.40788154  1
  H  H52  1  0.19206166  0.72836349  0.90786003  1
  H  H53  1  0.69206741  0.77166088  0.59212661  1
  H  H54  1  0.69895562  0.13288252  0.02715311  1
  H  H55  1  0.19897107  0.36712658  0.47286365  1
  H  H56  1  0.30115901  0.86728144  0.97285078  1
  H  H57  1  0.80117573  0.63274510  0.52714537  1
  H  H58  1  0.78421192  0.29094986  0.78843069  1
  H  H59  1  0.28419703  0.20902056  0.71157552  1
  H  H60  1  0.21561174  0.70921950  0.21157699  1
  H  H61  1  0.71563444  0.79080284  0.28842806  1
  H  H62  1  0.65499207  0.15362654  0.74248107  1
  H  H63  1  0.15497243  0.34633962  0.75753675  1
  H  H64  1  0.34497107  0.84640448  0.25748855  1
  H  H65  1  0.84499336  0.65362304  0.24249919  1
  H  H66  1  0.96602939  0.44730369  0.10286357  1
  H  H67  1  0.46605463  0.05270342  0.39711947  1
  H  H68  1  0.03410973  0.55264403  0.89718870  1
  H  H69  1  0.53409777  0.94736741  0.60283557  1
  H  H70  1  0.96834683  0.34502396  0.89070840  1
  H  H71  1  0.46837970  0.15498339  0.60930286  1
  H  H72  1  0.03199147  0.65504431  0.10928912  1
  H  H73  1  0.53198918  0.84493139  0.39068455  1
  C  C74  1  0.80504987  0.10217378  0.84690206  1
  C  C75  1  0.30503983  0.39781515  0.65313130  1
  C  C76  1  0.19488742  0.89806842  0.15319317  1
  C  C77  1  0.69491280  0.60194110  0.34679004  1
  C  C78  1  0.12168253  0.25156645  0.96953681  1
  C  C79  1  0.62167692  0.24844107  0.53045486  1
  C  C80  1  0.87839421  0.74822274  0.03050942  1
  C  C81  1  0.37841179  0.75176807  0.46949154  1
  C  C82  1  0.67247796  0.33025263  0.98174252  1
  C  C83  1  0.17247463  0.16977083  0.51826477  1
  C  C84  1  0.32722735  0.66978567  0.01822417  1
  C  C85  1  0.82723162  0.83023752  0.48176301  1
  C  C86  1  0.76062199  0.22568142  0.01835443  1
  C  C87  1  0.26063927  0.27433159  0.48166733  1
  C  C88  1  0.23932844  0.77457234  0.98163638  1
  C  C89  1  0.73933801  0.72544548  0.51835114  1
  C  C90  1  0.71500884  0.21038461  0.80929384  1
  C  C91  1  0.21499105  0.28959473  0.69072245  1
  C  C92  1  0.28486246  0.78973516  0.19069341  1
  C  C93  1  0.78488938  0.71028097  0.30929822  1
  C  C94  1  0.98660508  0.26223761  0.93448555  1
  C  C95  1  0.48661375  0.23777910  0.56553220  1
  C  C96  1  0.01348994  0.73782322  0.06558895  1
  C  C97  1  0.51349611  0.76216302  0.43439070  1
  N  N98  1  0.87656505  0.16724616  0.94396780  1
  N  N99  1  0.37656461  0.33276440  0.55606600  1
  N  N100  1  0.12335004  0.83309852  0.05606359  1
  N  N101  1  0.62336815  0.66690558  0.44391944  1
  N  N102  1  0.16094033  0.15549160  0.02584229  1
  N  N103  1  0.66092521  0.34452331  0.47415393  1
  N  N104  1  0.83918259  0.84448013  0.97433948  1
  N  N105  1  0.33922449  0.65551284  0.52567169  1
  N  N106  1  0.61185953  0.28620530  0.88640626  1
  N  N107  1  0.11184816  0.21379462  0.61359437  1
  N  N108  1  0.38794174  0.71390377  0.11354607  1
  N  N109  1  0.88796719  0.78610005  0.38644753  1
  O  O110  1  0.08442951  0.92087250  0.88029159  1
  O  O111  1  0.58443976  0.57914111  0.61970853  1
  O  O112  1  0.91580676  0.07928875  0.11968198  1
  O  O113  1  0.41582113  0.42070257  0.38032170  1
  O  O114  1  0.00672666  0.96488094  0.66237038  1
  O  O115  1  0.50671638  0.53508501  0.83761464  1
  O  O116  1  0.99314123  0.03495887  0.33760188  1
  O  O117  1  0.49313366  0.46504720  0.16240157  1
  O  O118  1  0.87654318  0.37929234  0.64983102  1
  O  O119  1  0.37656773  0.12066535  0.85018402  1
  O  O120  1  0.12349410  0.62084633  0.35012020  1
  O  O121  1  0.62347458  0.87918485  0.14986437  1
  O  O122  1  0.05926393  0.64330467  0.66943573  1
  O  O123  1  0.55929974  0.85668485  0.83055789  1
  O  O124  1  0.94069998  0.35683031  0.33066947  1
  O  O125  1  0.44069005  0.14319199  0.16934918  1
  O  O126  1  0.29963070  0.81800088  0.70585802  1
  O  O127  1  0.79963259  0.68194820  0.79415449  1
  O  O128  1  0.70031390  0.18201286  0.29408454  1
  O  O129  1  0.20031880  0.31803794  0.20591922  1
  O  O130  1  0.01596735  0.47109096  0.84115649  1
  O  O131  1  0.51596352  1.02891727  0.65886928  1
  O  O132  1  0.98404698  0.52897724  0.15883175  1
  O  O133  1  0.48405607  -0.02897513  0.34115277  1
