# generated using pymatgen
data_CuH7(C7O2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   17.73900000
_cell_length_b   17.71900000
_cell_length_c   17.71300000
_cell_angle_alpha   96.74100000
_cell_angle_beta   96.79600000
_cell_angle_gamma   96.63900000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuH7(C7O2)2
_chemical_formula_sum   'Cu6 H42 C84 O24'
_cell_volume   5442.61592488
_cell_formula_units_Z   6
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
  Cu  Cu1  1  0.305274  0.904094  0.903786  1.0
  Cu  Cu2  1  0.904830  0.304952  0.903850  1.0
  Cu  Cu3  1  0.904537  0.904423  0.304356  1.0
  Cu  Cu4  1  0.855821  0.171146  0.854309  1.0
  Cu  Cu5  1  0.855200  0.854965  0.170460  1.0
  Cu  Cu6  1  0.171827  0.854659  0.853810  1.0
  H  H7  1  0.211662  0.478167  0.818605  1.0
  H  H8  1  0.180880  0.611138  0.818117  1.0
  H  H9  1  0.431800  0.565347  0.948866  1.0
  H  H10  1  0.402049  0.698209  0.943468  1.0
  H  H11  1  0.225380  0.386949  0.891514  1.0
  H  H12  1  0.142703  0.305456  0.891571  1.0
  H  H13  1  0.819582  0.210793  0.477485  1.0
  H  H14  1  0.818771  0.179997  0.610471  1.0
  H  H15  1  0.949435  0.430945  0.565355  1.0
  H  H16  1  0.943768  0.401189  0.698205  1.0
  H  H17  1  0.893230  0.224639  0.386556  1.0
  H  H18  1  0.893411  0.142066  0.304896  1.0
  H  H19  1  0.478774  0.822530  0.207614  1.0
  H  H20  1  0.611591  0.822212  0.177023  1.0
  H  H21  1  0.565943  0.949980  0.429398  1.0
  H  H22  1  0.698666  0.944720  0.399771  1.0
  H  H23  1  0.386749  0.893805  0.223081  1.0
  H  H24  1  0.304646  0.890142  0.140491  1.0
  H  H25  1  0.479263  0.208727  0.821701  1.0
  H  H26  1  0.612161  0.178172  0.821075  1.0
  H  H27  1  0.566339  0.430168  0.949583  1.0
  H  H28  1  0.699089  0.400572  0.944041  1.0
  H  H29  1  0.387577  0.223865  0.893420  1.0
  H  H30  1  0.305560  0.141356  0.891024  1.0
  H  H31  1  0.212111  0.817376  0.477653  1.0
  H  H32  1  0.181661  0.817344  0.610716  1.0
  H  H33  1  0.431666  0.948640  0.564591  1.0
  H  H34  1  0.402297  0.943696  0.697579  1.0
  H  H35  1  0.224874  0.890067  0.386092  1.0
  H  H36  1  0.142060  0.891556  0.304505  1.0
  H  H37  1  0.821582  0.478514  0.209188  1.0
  H  H38  1  0.820406  0.611521  0.178648  1.0
  H  H39  1  0.950035  0.566000  0.430419  1.0
  H  H40  1  0.944072  0.698862  0.400814  1.0
  H  H41  1  0.894864  0.387306  0.223934  1.0
  H  H42  1  0.893345  0.305337  0.141233  1.0
  H  H43  1  0.462024  0.460088  0.879294  1.0
  H  H44  1  0.065168  0.065008  0.870463  1.0
  H  H45  1  0.879532  0.461293  0.460197  1.0
  H  H46  1  0.873051  0.064750  0.064240  1.0
  H  H47  1  0.462077  0.879293  0.459314  1.0
  H  H48  1  0.064259  0.870623  0.063812  1.0
  C  C49  1  0.289504  0.662961  0.880751  1.0
  C  C50  1  0.253136  0.526014  0.847613  1.0
  C  C51  1  0.235819  0.600414  0.846332  1.0
  C  C52  1  0.323930  0.511644  0.884221  1.0
  C  C53  1  0.377206  0.574922  0.918740  1.0
  C  C54  1  0.360614  0.649490  0.916639  1.0
  C  C55  1  0.271090  0.742749  0.879578  1.0
  C  C56  1  0.017133  0.206123  0.879953  1.0
  C  C57  1  0.341635  0.432285  0.886662  1.0
  C  C58  1  0.283127  0.372613  0.889354  1.0
  C  C59  1  0.097408  0.187773  0.881693  1.0
  C  C60  1  0.157686  0.247500  0.888193  1.0
  C  C61  1  0.881229  0.288629  0.662589  1.0
  C  C62  1  0.848382  0.252269  0.525505  1.0
  C  C63  1  0.846977  0.234935  0.599884  1.0
  C  C64  1  0.885036  0.323055  0.511383  1.0
  C  C65  1  0.919297  0.376380  0.574812  1.0
  C  C66  1  0.917083  0.359764  0.649342  1.0
  C  C67  1  0.880051  0.270202  0.742346  1.0
  C  C68  1  0.881928  0.016553  0.205404  1.0
  C  C69  1  0.887617  0.340888  0.432115  1.0
  C  C70  1  0.890855  0.282458  0.372361  1.0
  C  C71  1  0.883951  0.096881  0.187128  1.0
  C  C72  1  0.890290  0.157172  0.246998  1.0
  C  C73  1  0.663414  0.883155  0.286592  1.0
  C  C74  1  0.526585  0.850888  0.249545  1.0
  C  C75  1  0.600909  0.849728  0.232304  1.0
  C  C76  1  0.512283  0.886396  0.320873  1.0
  C  C77  1  0.575503  0.920434  0.374510  1.0
  C  C78  1  0.649973  0.918439  0.357990  1.0
  C  C79  1  0.743170  0.881204  0.268737  1.0
  C  C80  1  0.205240  0.879946  0.015218  1.0
  C  C81  1  0.433088  0.887699  0.339042  1.0
  C  C82  1  0.372916  0.890384  0.280874  1.0
  C  C83  1  0.187037  0.881283  0.095589  1.0
  C  C84  1  0.246947  0.887374  0.155800  1.0
  C  C85  1  0.663888  0.287538  0.882283  1.0
  C  C86  1  0.527068  0.250572  0.850110  1.0
  C  C87  1  0.601421  0.233357  0.848765  1.0
  C  C88  1  0.512718  0.321768  0.885880  1.0
  C  C89  1  0.575919  0.375349  0.919904  1.0
  C  C90  1  0.650410  0.358853  0.917740  1.0
  C  C91  1  0.743664  0.269633  0.880426  1.0
  C  C92  1  0.206037  0.016151  0.879876  1.0
  C  C93  1  0.433500  0.339852  0.887601  1.0
  C  C94  1  0.373557  0.281671  0.890378  1.0
  C  C95  1  0.187921  0.096593  0.881521  1.0
  C  C96  1  0.247813  0.156701  0.887972  1.0
  C  C97  1  0.289993  0.880575  0.662480  1.0
  C  C98  1  0.253538  0.846692  0.525461  1.0
  C  C99  1  0.236408  0.845689  0.599934  1.0
  C  C100  1  0.324035  0.883533  0.510970  1.0
  C  C101  1  0.377283  0.918377  0.574244  1.0
  C  C102  1  0.360884  0.916546  0.648898  1.0
  C  C103  1  0.271600  0.879826  0.742318  1.0
  C  C104  1  0.016453  0.880099  0.205108  1.0
  C  C105  1  0.341446  0.885981  0.431520  1.0
  C  C106  1  0.282671  0.888415  0.371806  1.0
  C  C107  1  0.096646  0.881654  0.186702  1.0
  C  C108  1  0.156977  0.887972  0.246536  1.0
  C  C109  1  0.882028  0.663408  0.287858  1.0
  C  C110  1  0.849995  0.526451  0.250957  1.0
  C  C111  1  0.848359  0.600827  0.233765  1.0
  C  C112  1  0.886196  0.512240  0.322050  1.0
  C  C113  1  0.920138  0.575544  0.375656  1.0
  C  C114  1  0.917728  0.650068  0.359158  1.0
  C  C115  1  0.880240  0.743146  0.269696  1.0
  C  C116  1  0.882183  0.205705  0.015847  1.0
  C  C117  1  0.888379  0.432983  0.339975  1.0
  C  C118  1  0.891721  0.373143  0.281673  1.0
  C  C119  1  0.884005  0.187586  0.096235  1.0
  C  C120  1  0.890314  0.247514  0.156460  1.0
  C  C121  1  0.416693  0.415042  0.885318  1.0
  C  C122  1  0.297503  0.296458  0.890399  1.0
  C  C123  1  0.234096  0.233334  0.889568  1.0
  C  C124  1  0.111992  0.111613  0.876735  1.0
  C  C125  1  0.885976  0.416039  0.415085  1.0
  C  C126  1  0.892092  0.297017  0.296285  1.0
  C  C127  1  0.891696  0.233684  0.233036  1.0
  C  C128  1  0.879257  0.111547  0.111015  1.0
  C  C129  1  0.416517  0.885140  0.414257  1.0
  C  C130  1  0.296857  0.889847  0.295646  1.0
  C  C131  1  0.233340  0.889089  0.232455  1.0
  C  C132  1  0.111121  0.876689  0.110506  1.0
  O  O133  1  0.325973  0.797157  0.902707  1.0
  O  O134  1  0.963328  0.150955  0.856685  1.0
  O  O135  1  0.008930  0.275702  0.902225  1.0
  O  O136  1  0.201849  0.750868  0.855708  1.0
  O  O137  1  0.903226  0.325142  0.796836  1.0
  O  O138  1  0.859465  0.962663  0.150036  1.0
  O  O139  1  0.903062  0.008431  0.275287  1.0
  O  O140  1  0.856365  0.200900  0.750368  1.0
  O  O141  1  0.797365  0.903375  0.324163  1.0
  O  O142  1  0.150159  0.857342  0.961068  1.0
  O  O143  1  0.274885  0.901740  0.007303  1.0
  O  O144  1  0.751446  0.857622  0.199411  1.0
  O  O145  1  0.797758  0.324940  0.903009  1.0
  O  O146  1  0.150968  0.962292  0.856544  1.0
  O  O147  1  0.275578  0.007936  0.902154  1.0
  O  O148  1  0.752096  0.200434  0.856528  1.0
  O  O149  1  0.326365  0.903206  0.796905  1.0
  O  O150  1  0.962519  0.856649  0.150006  1.0
  O  O151  1  0.008467  0.902681  0.274691  1.0
  O  O152  1  0.202370  0.856071  0.750276  1.0
  O  O153  1  0.903419  0.797518  0.324754  1.0
  O  O154  1  0.859623  0.150361  0.961935  1.0
  O  O155  1  0.903424  0.275464  0.007679  1.0
  O  O156  1  0.856000  0.751242  0.200461  1.0
