# generated using pymatgen
data_Fe2CoNi2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.33591048
_cell_length_b   9.69455740
_cell_length_c   13.59179101
_cell_angle_alpha   103.75369766
_cell_angle_beta   89.99998307
_cell_angle_gamma   90.00047579
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2CoNi2H32C12(NO2)6
_chemical_formula_sum   'Fe4 Co2 Ni4 H64 C24 N12 O24'
_cell_volume   1194.88660601
_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
  Fe  Fe0  1  0.09126326  0.83966293  0.73164897  1
  Fe  Fe1  1  0.59133538  0.66052063  0.76863267  1
  Fe  Fe2  1  0.90852307  0.16081813  0.26848056  1
  Fe  Fe3  1  0.40836601  0.33944025  0.23196938  1
  Ni  Ni4  1  0.92931617  0.54675033  0.73246890  1
  Ni  Ni5  1  0.42949449  0.95313713  0.76778204  1
  Ni  Ni6  1  0.07048419  0.45324351  0.26781317  1
  Ni  Ni7  1  0.57057810  0.04671883  0.23239311  1
  Co  Co8  1  -0.00506961  1.00542446  0.99805584  1
  Co  Co9  1  0.50366400  0.50395759  0.49869766  1
  H  H10  1  0.18051201  0.20741396  0.10100318  1
  H  H11  1  0.68120429  0.29324691  0.39901620  1
  H  H12  1  0.81850930  0.79329113  0.89898004  1
  H  H13  1  0.31922752  0.70727770  0.60107892  1
  H  H14  1  0.25695543  0.11521748  0.99213308  1
  H  H15  1  0.75848753  0.38401976  0.50792715  1
  H  H16  1  0.74121526  0.88393532  0.00805093  1
  H  H17  1  0.24262853  0.61541270  0.49211314  1
  H  H18  1  0.53170791  0.46866550  0.87011435  1
  H  H19  1  0.03095053  0.03172367  0.62917485  1
  H  H20  1  0.46922913  0.53208340  0.12902015  1
  H  H21  1  0.96851466  0.96843780  0.37027604  1
  H  H22  1  0.51061274  0.23357980  0.89976917  1
  H  H23  1  0.00973891  0.26594941  0.60001044  1
  H  H24  1  0.49046441  0.76563814  0.09999668  1
  H  H25  1  0.98951958  0.73388350  0.39986397  1
  H  H26  1  0.72577189  0.02251584  0.86016872  1
  H  H27  1  0.22531672  0.47613873  0.63945019  1
  H  H28  1  0.27479327  0.97569968  0.13930947  1
  H  H29  1  0.77437490  0.52289011  0.36030879  1
  H  H30  1  0.87178503  0.07160298  0.79227199  1
  H  H31  1  0.37065898  0.42721405  0.70785441  1
  H  H32  1  0.12967534  0.92671113  0.20783509  1
  H  H33  1  0.62853516  0.57197162  0.29233539  1
  H  H34  1  0.19318635  0.33852934  0.96584495  1
  H  H35  1  0.69288470  0.16318529  0.53366925  1
  H  H36  1  0.80711164  0.66363517  0.03353647  1
  H  H37  1  0.30686589  0.83812086  0.46598203  1
  H  H38  1  0.29135678  0.14720608  0.84520242  1
  H  H39  1  0.79107706  0.35274914  0.65483628  1
  H  H40  1  0.70904229  0.85283069  0.15491470  1
  H  H41  1  0.20888411  0.64727441  0.34524381  1
  H  H42  1  0.57930490  0.39168247  0.07317250  1
  H  H43  1  0.08077999  0.11007781  0.42874740  1
  H  H44  1  0.41878848  0.61073901  0.92953979  1
  H  H45  1  0.91958232  0.89070138  0.57190959  1
  H  H46  1  0.73593324  0.43738893  -0.00250233  1
  H  H47  1  0.23481312  0.06240104  0.50232043  1
  H  H48  1  0.26529526  0.56242821  1.00250307  1
  H  H49  1  0.76423546  0.93725403  0.49756466  1
  H  H50  1  0.81287095  0.27300712  0.09979890  1
  H  H51  1  0.31223697  0.22667140  0.40019916  1
  H  H52  1  0.18813891  0.72662760  0.90012008  1
  H  H53  1  0.68728454  0.77305367  0.59984672  1
  H  H54  1  0.69417778  0.14009112  0.03604199  1
  H  H55  1  0.19451616  0.36022847  0.46464743  1
  H  H56  1  0.30543964  0.86023361  0.96480047  1
  H  H57  1  0.80576308  0.64001078  0.53588272  1
  H  H58  1  0.77134034  0.30772298  0.80306432  1
  H  H59  1  0.27020674  0.19135877  0.69688300  1
  H  H60  1  0.23001343  0.69096584  0.19683267  1
  H  H61  1  0.72884573  0.80805476  0.30315825  1
  H  H62  1  0.64127090  0.17314010  0.75356597  1
  H  H63  1  0.13993099  0.32580725  0.74639674  1
  H  H64  1  0.36038051  0.82539051  0.24633500  1
  H  H65  1  0.85892641  0.67348571  0.25372381  1
  H  H66  1  0.96535741  0.46139274  0.10745160  1
  H  H67  1  0.46530625  0.03783482  0.39258786  1
  H  H68  1  0.03456862  0.53760306  0.89261488  1
  H  H69  1  0.53459985  0.96120122  0.60741122  1
  H  H70  1  0.96231127  0.34504629  0.89064485  1
  H  H71  1  0.46632640  0.15491415  0.60960690  1
  H  H72  1  0.03208628  0.65445550  0.10985728  1
  H  H73  1  0.53700893  0.84488078  0.39061236  1
  C  C74  1  0.79307161  0.11215554  0.85176351  1
  C  C75  1  0.29218679  0.38636047  0.64814434  1
  C  C76  1  0.20818208  0.88580323  0.14816830  1
  C  C77  1  0.70712902  0.61253663  0.35190306  1
  C  C78  1  0.11437654  0.25866275  0.97408101  1
  C  C79  1  0.61374125  0.24291401  0.52586813  1
  C  C80  1  0.88638870  0.74321930  0.02576926  1
  C  C81  1  0.38567222  0.75827277  0.47421242  1
  C  C82  1  0.67052447  0.34282269  0.99686502  1
  C  C83  1  0.16871483  0.15636375  0.50237435  1
  C  C84  1  0.33144412  0.65628414  0.00233421  1
  C  C85  1  0.83008338  0.84307401  0.49734964  1
  C  C86  1  0.76051876  0.22944650  0.02705097  1
  C  C87  1  0.25998624  0.27006233  0.47309610  1
  C  C88  1  0.24021772  0.76981726  0.97313282  1
  C  C89  1  0.73953166  0.72948696  0.52706956  1
  C  C90  1  0.70172062  0.22590080  0.82140414  1
  C  C91  1  0.20035695  0.27300213  0.67850750  1
  C  C92  1  0.30004489  0.77246265  0.17845566  1
  C  C93  1  0.79851460  0.72634497  0.32162335  1
  C  C94  1  0.98065197  0.26533798  0.93731957  1
  C  C95  1  0.48008191  0.23533150  0.56262707  1
  C  C96  1  0.01991724  0.73538864  0.06261008  1
  C  C97  1  0.51934395  0.76518502  0.43738746  1
  N  N98  1  0.87018256  0.17066110  0.94819366  1
  N  N99  1  0.36859036  0.32659061  0.55225223  1
  N  N100  1  0.13180067  0.82563809  0.05241206  1
  N  N101  1  0.62997255  0.67092714  0.44826558  1
  N  N102  1  0.15999495  0.15576662  0.02387738  1
  N  N103  1  0.66095660  0.34555916  0.47596211  1
  N  N104  1  0.83886868  0.84602850  0.97586540  1
  N  N105  1  0.33967093  0.65552276  0.52401938  1
  N  N106  1  0.60182990  0.29748336  0.90054198  1
  N  N107  1  0.10039948  0.20148357  0.59925808  1
  N  N108  1  0.39999194  0.70091005  0.09927498  1
  N  N109  1  0.89855209  0.79798801  0.40065434  1
  O  O110  1  0.05712278  0.92549825  0.87407908  1
  O  O111  1  0.55893205  0.57738310  0.62568156  1
  O  O112  1  0.94101413  0.07758343  0.12537542  1
  O  O113  1  0.44254897  0.42499900  0.37400726  1
  O  O114  1  -0.01444264  0.94455190  0.64210583  1
  O  O115  1  0.48594631  0.55558595  0.85743442  1
  O  O116  1  1.01422540  0.05538597  0.35741521  1
  O  O117  1  0.51440498  0.44488009  0.14232326  1
  O  O118  1  0.87514838  0.38504621  0.62442936  1
  O  O119  1  0.37554797  0.11478559  0.87542621  1
  O  O120  1  0.12474475  0.61507212  0.37563841  1
  O  O121  1  0.62509113  0.88515014  0.12437139  1
  O  O122  1  0.05933872  0.64952577  0.67820799  1
  O  O123  1  0.55969420  0.85130493  0.82223343  1
  O  O124  1  0.94023341  0.35101209  0.32230336  1
  O  O125  1  0.44075326  0.14950898  0.17803108  1
  O  O126  1  0.28311734  0.83876615  0.70139354  1
  O  O127  1  0.78264947  0.66130404  0.79917258  1
  O  O128  1  0.71715356  0.16115779  0.29909099  1
  O  O129  1  0.21698112  0.33851369  0.20118671  1
  O  O130  1  0.00780307  0.45772803  0.83752540  1
  O  O131  1  0.50819257  1.04119137  0.66257890  1
  O  O132  1  0.99215240  0.54177170  0.16222634  1
  O  O133  1  0.49203499  -0.04206921  0.33749319  1
