# generated using pymatgen
data_CoH20C20(N2O)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.04283493
_cell_length_b   12.24013546
_cell_length_c   11.33614659
_cell_angle_alpha   79.67130738
_cell_angle_beta   80.89118654
_cell_angle_gamma   70.68691188
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoH20C20(N2O)4
_chemical_formula_sum   'Co2 H40 C40 N16 O8'
_cell_volume   1030.21415508
_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
  Co  Co0  1  -0.00002807  -0.00015370  0.00002569  1
  Co  Co1  1  0.49999718  0.50014479  0.49998939  1
  H  H2  1  0.24008946  0.43899501  0.83591199  1
  H  H3  1  0.75991396  0.56099916  0.16409541  1
  H  H4  1  0.81180506  0.37408080  0.08664959  1
  H  H5  1  0.18819749  0.62591480  0.91335398  1
  H  H6  1  0.70953787  0.09821528  0.82448923  1
  H  H7  1  0.29045991  0.90178682  0.17550609  1
  H  H8  1  0.65941554  0.09994436  0.19237835  1
  H  H9  1  0.34058697  0.90005597  0.80761753  1
  H  H10  1  0.33826515  0.20855277  0.11646528  1
  H  H11  1  0.66173560  0.79144460  0.88353153  1
  H  H12  1  0.38064380  0.18890662  0.87818015  1
  H  H13  1  0.61935675  0.81109026  0.12181602  1
  H  H14  1  0.09675104  0.15495584  0.76526944  1
  H  H15  1  0.90325628  0.84505367  0.23472984  1
  H  H16  1  0.97712215  0.83934858  0.81935530  1
  H  H17  1  0.02288761  0.16066227  0.18063733  1
  H  H18  1  0.08822663  0.87988904  0.58280490  1
  H  H19  1  0.91178835  0.12011587  0.41719373  1
  H  H20  1  0.15094802  0.08631785  0.55273962  1
  H  H21  1  0.84906521  0.91368874  0.44725647  1
  H  H22  1  0.42668952  0.19555621  0.37684539  1
  H  H23  1  0.57331149  0.80444636  0.62315076  1
  H  H24  1  0.62445724  0.96982496  0.69494136  1
  H  H25  1  0.37554619  0.03017712  0.30505113  1
  H  H26  1  0.37022364  0.69735279  0.28908914  1
  H  H27  1  0.62976695  0.30264223  0.71091206  1
  H  H28  1  0.55814100  0.33369304  0.30561460  1
  H  H29  1  0.44186507  0.66630859  0.69438401  1
  H  H30  1  0.42520022  0.41894837  0.09168073  1
  H  H31  1  0.57480395  0.58105219  0.90831992  1
  H  H32  1  0.31117286  0.65397869  0.08494686  1
  H  H33  1  0.68881776  0.34602396  0.91505889  1
  H  H34  1  0.22481714  0.39166189  0.63519613  1
  H  H35  1  0.77519073  0.60833055  0.36480658  1
  H  H36  1  0.15637036  0.72552817  0.45636438  1
  H  H37  1  0.84362208  0.27446675  0.54364593  1
  H  H38  1  0.83560822  0.71589856  0.56386860  1
  H  H39  1  0.16438559  0.28409229  0.43613652  1
  H  H40  1  0.89550182  0.50108607  0.69258103  1
  H  H41  1  0.10450340  0.49890289  0.30742591  1
  C  C42  1  0.04833232  0.28170041  0.90599586  1
  C  C43  1  0.95166360  0.71829314  0.09401010  1
  C  C44  1  0.02705627  0.39375129  0.95410273  1
  C  C45  1  0.97294612  0.60624541  0.04590321  1
  C  C46  1  0.13343707  0.46535944  0.90758184  1
  C  C47  1  0.86656597  0.53463596  0.09242492  1
  C  C48  1  0.89468830  0.42942637  0.04823236  1
  C  C49  1  0.10531414  0.57056999  0.95177324  1
  C  C50  1  0.62600190  0.10952072  0.10175133  1
  C  C51  1  0.37399981  0.89048184  0.89824552  1
  C  C52  1  0.45961122  0.16564841  0.06257801  1
  C  C53  1  0.54038777  0.83434857  0.93741909  1
  C  C54  1  0.47893577  0.15523726  0.94175074  1
  C  C55  1  0.52106468  0.84475987  0.05824640  1
  C  C56  1  0.01100180  0.91563900  0.77274819  1
  C  C57  1  0.98900839  0.08437592  0.22725000  1
  C  C58  1  0.07095751  0.93565433  0.65178637  1
  C  C59  1  0.92905252  0.06435237  0.34821361  1
  C  C60  1  0.10661336  0.04040468  0.63619488  1
  C  C61  1  0.89339638  0.95960295  0.36379889  1
  C  C62  1  0.54396362  0.19895728  0.58624062  1
  C  C63  1  0.45602885  0.80104831  0.41375879  1
  C  C64  1  0.52361260  0.09546532  0.54238427  1
  C  C65  1  0.47639069  0.90453603  0.45760849  1
  C  C66  1  0.45564244  0.10999638  0.43218898  1
  C  C67  1  0.54436120  0.89000432  0.56780524  1
  C  C68  1  0.56877311  0.98394030  0.60963558  1
  C  C69  1  0.43122963  0.01606153  0.39035761  1
  C  C70  1  0.49373932  0.42424687  0.27228339  1
  C  C71  1  0.50625910  0.57575373  0.72771927  1
  C  C72  1  0.43085627  0.46883090  0.16087064  1
  C  C73  1  0.56914418  0.53116997  0.83913124  1
  C  C74  1  0.36879435  0.58883916  0.15797645  1
  C  C75  1  0.63119897  0.41115938  0.84202696  1
  C  C76  1  0.12771881  0.65321406  0.51636996  1
  C  C77  1  0.87226825  0.34678148  0.48363459  1
  C  C78  1  0.96345153  0.64921319  0.57433969  1
  C  C79  1  0.03653965  0.35077865  0.42566940  1
  C  C80  1  0.99191478  0.53923525  0.63964914  1
  C  C81  1  0.00809133  0.46075493  0.36035695  1
  N  N82  1  0.74332447  0.06605681  0.00898629  1
  N  N83  1  0.25669049  0.93399489  0.99099888  1
  N  N84  1  0.64931190  0.09284383  0.91130682  1
  N  N85  1  0.35069102  0.90715575  0.08869038  1
  N  N86  1  0.00682310  1.00629317  0.82823311  1
  N  N87  1  0.99319408  -0.00625116  0.17175685  1
  N  N88  1  0.07118325  0.08069711  0.74334268  1
  N  N89  1  0.92882135  0.91931452  0.25664373  1
  N  N90  1  0.46802875  0.51386202  0.33551643  1
  N  N91  1  0.53193163  0.48612937  0.66450201  1
  N  N92  1  0.38945151  0.61399285  0.26445420  1
  N  N93  1  0.61054324  0.38600315  0.73554902  1
  N  N94  1  0.25129043  0.54858828  0.54381818  1
  N  N95  1  0.74869882  0.45140643  0.45616704  1
  N  N96  1  0.16650664  0.48071951  0.62282182  1
  N  N97  1  0.83350445  0.51927547  0.37717514  1
  O  O98  1  0.98090079  0.20937552  0.97305724  1
  O  O99  1  0.01908847  0.79062788  0.02693891  1
  O  O100  1  0.13029244  0.26805711  0.80043647  1
  O  O101  1  0.86971532  0.73194229  0.19956303  1
  O  O102  1  0.45245571  0.29972318  0.54218934  1
  O  O103  1  0.54753799  0.70027757  0.45782024  1
  O  O104  1  0.65447034  0.17798401  0.66333605  1
  O  O105  1  0.34552724  0.82201852  0.33666602  1
