# generated using pymatgen
data_CoNi4H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.32064215
_cell_length_b   9.67365384
_cell_length_c   13.59055585
_cell_angle_alpha   103.68174701
_cell_angle_beta   90.00005535
_cell_angle_gamma   90.00004643
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoNi4H32C12(NO2)6
_chemical_formula_sum   'Co2 Ni8 H64 C24 N12 O24'
_cell_volume   1190.61695645
_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  0.08258177  0.84324796  0.73767277  1
  Ni  Ni1  1  0.58254416  0.65671987  0.76233672  1
  Ni  Ni2  1  0.91738379  0.15665529  0.26161425  1
  Ni  Ni3  1  0.41733602  0.34336795  0.23840943  1
  Ni  Ni4  1  0.92384648  0.56321786  0.73415412  1
  Ni  Ni5  1  0.42387648  0.93679950  0.76583170  1
  Ni  Ni6  1  0.07628008  0.43678898  0.26605714  1
  Ni  Ni7  1  0.57630412  0.06325833  0.23393630  1
  Co  Co8  1  0.00456643  0.99474202  1.00239583  1
  Co  Co9  1  0.50453733  0.50526212  0.49761032  1
  H  H10  1  0.18724633  0.20396312  0.10135507  1
  H  H11  1  0.68724003  0.29604280  0.39863916  1
  H  H12  1  0.81395725  0.79509695  0.89957533  1
  H  H13  1  0.31397036  0.70490548  0.60040203  1
  H  H14  1  0.26144716  0.10796131  0.99308613  1
  H  H15  1  0.76144240  0.39206333  0.50686525  1
  H  H16  1  0.74109954  0.89244897  0.00819193  1
  H  H17  1  0.24114757  0.60757154  0.49175474  1
  H  H18  1  0.52406277  0.42692027  0.82589038  1
  H  H19  1  0.02407796  0.07305734  0.67411959  1
  H  H20  1  0.47524783  0.57293251  0.17476287  1
  H  H21  1  0.97526660  0.92708068  0.32523814  1
  H  H22  1  0.51668743  0.22239620  0.88096114  1
  H  H23  1  0.01664592  0.27757223  0.61904367  1
  H  H24  1  0.48193083  0.77805528  0.11870533  1
  H  H25  1  0.98191573  0.72195161  0.38130960  1
  H  H26  1  0.74712254  0.01558776  0.84963081  1
  H  H27  1  0.24713751  0.48436973  0.65034522  1
  H  H28  1  0.25359597  0.98577973  0.15102556  1
  H  H29  1  0.75360620  0.51421353  0.34897146  1
  H  H30  1  0.90214625  0.06310443  0.77075619  1
  H  H31  1  0.40212678  0.43684638  0.72925049  1
  H  H32  1  0.09805139  0.93766777  0.22865945  1
  H  H33  1  0.59800788  0.56233096  0.27134938  1
  H  H34  1  0.20783197  0.32639314  0.96302725  1
  H  H35  1  0.70790691  0.17367401  0.53697425  1
  H  H36  1  0.79265865  0.67008893  0.03800908  1
  H  H37  1  0.29269858  0.82998895  0.46200332  1
  H  H38  1  0.26836780  0.11524835  0.83590020  1
  H  H39  1  0.76831475  0.38481734  0.66407279  1
  H  H40  1  0.73091281  0.88390699  0.16456282  1
  H  H41  1  0.23090169  0.61615310  0.33542682  1
  H  H42  1  0.57949314  0.35671599  0.04233568  1
  H  H43  1  0.07948848  0.14326963  0.45766028  1
  H  H44  1  0.41914444  0.64337267  0.95746499  1
  H  H45  1  0.91914422  0.85663008  0.54254047  1
  H  H46  1  0.72477321  0.43159116  -0.01015576  1
  H  H47  1  0.22473598  0.06836353  0.51017148  1
  H  H48  1  0.27322983  0.56944186  1.01000744  1
  H  H49  1  0.77322642  0.93056136  0.49001053  1
  H  H50  1  0.81095165  0.26915067  0.09130346  1
  H  H51  1  0.31096035  0.23078443  0.40870577  1
  H  H52  1  0.18814441  0.73175597  0.90836750  1
  H  H53  1  0.68815922  0.76823774  0.59164905  1
  H  H54  1  0.70239356  0.13092022  0.02474766  1
  H  H55  1  0.20239738  0.36901417  0.47525663  1
  H  H56  1  0.29767573  0.86973746  0.97430558  1
  H  H57  1  0.79767098  0.63025825  0.52569771  1
  H  H58  1  0.78150416  0.30039875  0.79142873  1
  H  H59  1  0.28144557  0.19958386  0.70859012  1
  H  H60  1  0.21691005  0.70047604  0.20806945  1
  H  H61  1  0.71690583  0.79952495  0.29193654  1
  H  H62  1  0.65991538  0.15603722  0.74066561  1
  H  H63  1  0.15987424  0.34396714  0.75931768  1
  H  H64  1  0.33917447  0.84407159  0.25894666  1
  H  H65  1  0.83915337  0.65593106  0.24105673  1
  H  H66  1  0.97158314  0.43495679  0.10889728  1
  H  H67  1  0.47156916  0.06503639  0.39106136  1
  H  H68  1  0.02872246  0.56553512  0.89157107  1
  H  H69  1  0.52872031  0.93446529  0.60841360  1
  H  H70  1  0.97482303  0.35117225  0.89419777  1
  H  H71  1  0.47481979  0.14880578  0.60577062  1
  H  H72  1  0.02827399  0.64925221  0.10627043  1
  H  H73  1  0.52830926  0.85076450  0.39371328  1
  C  C74  1  0.80896268  0.10977320  0.84395951  1
  C  C75  1  0.30896621  0.39019797  0.65605916  1
  C  C76  1  0.19068091  0.89196767  0.15606224  1
  C  C77  1  0.69067830  0.60803003  0.34394496  1
  C  C78  1  0.12270441  0.25318097  0.97313300  1
  C  C79  1  0.62273917  0.24684399  0.52687561  1
  C  C80  1  0.87717854  0.74355543  0.02732781  1
  C  C81  1  0.37721341  0.75650900  0.47267548  1
  C  C82  1  0.66515974  0.33178229  0.98544871  1
  C  C83  1  0.16514507  0.16818190  0.51455932  1
  C  C84  1  0.33338833  0.66888564  0.01430569  1
  C  C85  1  0.83338319  0.83111654  0.48570667  1
  C  C86  1  0.76399357  0.22390173  0.01710172  1
  C  C87  1  0.26400975  0.27604683  0.48290979  1
  C  C88  1  0.23561545  0.77721102  0.98235288  1
  C  C89  1  0.73561856  0.72279072  0.51765859  1
  C  C90  1  0.71392054  0.21629406  0.80958395  1
  C  C91  1  0.21389211  0.28369141  0.69041410  1
  C  C92  1  0.28484261  0.78437643  0.19001624  1
  C  C93  1  0.78483371  0.71562528  0.30999204  1
  C  C94  1  0.99067014  0.26631330  0.93574931  1
  C  C95  1  0.49070275  0.23370504  0.56425722  1
  C  C96  1  0.00975207  0.73288198  0.06437162  1
  C  C97  1  0.50978665  0.76715334  0.43562822  1
  N  N98  1  0.87740459  0.17148093  0.94051150  1
  N  N99  1  0.37740844  0.32852354  0.55949817  1
  N  N100  1  0.12150721  0.83124103  0.05892210  1
  N  N101  1  0.62152042  0.66877617  0.44108435  1
  N  N102  1  0.16470307  0.14915901  0.02451444  1
  N  N103  1  0.66469099  0.35085360  0.47546984  1
  N  N104  1  0.83681291  0.84846618  0.97664058  1
  N  N105  1  0.33684240  0.65156727  0.52333433  1
  N  N106  1  0.60730394  0.28544353  0.88370367  1
  N  N107  1  0.10727645  0.21453939  0.61629743  1
  N  N108  1  0.39141696  0.71493961  0.11599017  1
  N  N109  1  0.89140484  0.78506477  0.38402028  1
  O  O110  1  0.07277585  0.91924981  0.88505241  1
  O  O111  1  0.57276812  0.58072034  0.61495544  1
  O  O112  1  0.92715764  0.08129857  0.11426910  1
  O  O113  1  0.42711037  0.41866573  0.38574468  1
  O  O114  1  -0.03302606  1.00388087  0.70176056  1
  O  O115  1  0.46693831  0.49608709  0.79825418  1
  O  O116  1  1.03248016  -0.00370377  0.29779621  1
  O  O117  1  0.53244291  0.50370670  0.20220725  1
  O  O118  1  0.86441454  0.39417509  0.63813125  1
  O  O119  1  0.36441721  0.10578635  0.86188806  1
  O  O120  1  0.13552163  0.60555007  0.36207371  1
  O  O121  1  0.63550395  0.89445710  0.13794140  1
  O  O122  1  0.02578309  0.66606443  0.66354097  1
  O  O123  1  0.52581539  0.83397195  0.83645370  1
  O  O124  1  0.97355899  0.33399601  0.33626801  1
  O  O125  1  0.47367502  0.16612063  0.16372827  1
  O  O126  1  0.27540793  0.83398914  0.69777231  1
  O  O127  1  0.77537069  0.66598461  0.80222659  1
  O  O128  1  0.72495757  0.16578919  0.30182623  1
  O  O129  1  0.22489847  0.33416144  0.19819080  1
  O  O130  1  0.02406080  0.48398159  0.83361705  1
  O  O131  1  0.52413661  1.01597634  0.66639788  1
  O  O132  1  0.97717388  0.51684938  0.16656300  1
  O  O133  1  0.47719772  -0.01685609  0.33340015  1
