# generated using pymatgen
data_FeCo4H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35437060
_cell_length_b   9.71102190
_cell_length_c   13.64824017
_cell_angle_alpha   103.55125406
_cell_angle_beta   89.99998896
_cell_angle_gamma   90.00016215
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCo4H32C12(NO2)6
_chemical_formula_sum   'Fe2 Co8 H64 C24 N12 O24'
_cell_volume   1205.29741034
_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  0.09106412  0.85444457  0.73464677  1
  Co  Co1  1  0.59106835  0.64552424  0.76534230  1
  Co  Co2  1  0.90863895  0.14594112  0.26538887  1
  Co  Co3  1  0.40858334  0.35403171  0.23461151  1
  Co  Co4  1  0.93988672  0.55517047  0.73510458  1
  Co  Co5  1  0.43988191  0.94482070  0.76489433  1
  Co  Co6  1  0.06017632  0.44491462  0.26489618  1
  Co  Co7  1  0.56019172  0.05508781  0.23511273  1
  Fe  Fe8  1  0.00002116  0.99988372  0.99996482  1
  Fe  Fe9  1  0.50000029  0.50010453  0.50003172  1
  H  H10  1  0.19288943  0.20102611  0.08976981  1
  H  H11  1  0.69290039  0.29897559  0.41022582  1
  H  H12  1  0.80722635  0.79887440  0.91020143  1
  H  H13  1  0.30723819  0.70111919  0.58980102  1
  H  H14  1  0.27491569  0.10027166  0.98855464  1
  H  H15  1  0.77492557  0.39972921  0.51144034  1
  H  H16  1  0.72531068  0.89961578  0.01144130  1
  H  H17  1  0.22532530  0.60039440  0.48855993  1
  H  H18  1  0.53551488  0.47111743  0.87581706  1
  H  H19  1  0.03551892  0.02887925  0.62418232  1
  H  H20  1  0.46482478  0.52894467  0.12400052  1
  H  H21  1  0.96473559  0.97108391  0.37590586  1
  H  H22  1  0.53094972  0.21915281  0.89295912  1
  H  H23  1  0.03094825  0.28084601  0.60704752  1
  H  H24  1  0.46892757  0.78083312  0.10714337  1
  H  H25  1  0.96893314  0.71918408  0.39285845  1
  H  H26  1  0.76834865  0.03372309  0.85606999  1
  H  H27  1  0.26833593  0.46626896  0.64393903  1
  H  H28  1  0.23153186  0.96631431  0.14377766  1
  H  H29  1  0.73153542  0.53368778  0.35622414  1
  H  H30  1  0.91607098  0.10865278  0.80788432  1
  H  H31  1  0.41606218  0.39135703  0.69212894  1
  H  H32  1  0.08379302  0.89138918  0.19212442  1
  H  H33  1  0.58379480  0.60861699  0.30786828  1
  H  H34  1  0.21162692  0.32834737  0.96283116  1
  H  H35  1  0.71163131  0.17166903  0.53717698  1
  H  H36  1  0.78849655  0.67128866  0.03696651  1
  H  H37  1  0.28850105  0.82873121  0.46304431  1
  H  H38  1  0.14748267  0.17812651  0.87415591  1
  H  H39  1  0.64747852  0.32189389  0.62584351  1
  H  H40  1  0.85246268  0.82138336  0.12587173  1
  H  H41  1  0.35244962  0.67864937  0.37412954  1
  H  H42  1  0.57695687  0.37812727  0.06372133  1
  H  H43  1  0.07699585  0.12190908  0.43630826  1
  H  H44  1  0.42332946  0.62194946  0.93657545  1
  H  H45  1  0.92332423  0.87805357  0.56343066  1
  H  H46  1  0.73424133  0.43610317  0.00300006  1
  H  H47  1  0.23422451  0.06392378  0.49698956  1
  H  H48  1  0.26592867  0.56384129  0.99711447  1
  H  H49  1  0.76592549  0.93616490  0.50289187  1
  H  H50  1  0.79569109  0.27203897  0.10879579  1
  H  H51  1  0.29570921  0.22797438  0.39120844  1
  H  H52  1  0.20442513  0.72753772  0.89122165  1
  H  H53  1  0.70441815  0.77246027  0.60877948  1
  H  H54  1  0.69024647  0.13621520  0.03333924  1
  H  H55  1  0.19026409  0.36379312  0.46666570  1
  H  H56  1  0.30982864  0.86358782  0.96666537  1
  H  H57  1  0.80982664  0.63641187  0.53333149  1
  H  H58  1  0.78771867  0.32862628  0.81330046  1
  H  H59  1  0.28772149  0.17137103  0.68671431  1
  H  H60  1  0.21210425  0.67167489  0.18688486  1
  H  H61  1  0.71211026  0.82833674  0.31312188  1
  H  H62  1  0.67920336  0.18162861  0.75496469  1
  H  H63  1  0.17921275  0.31835768  0.74503123  1
  H  H64  1  0.32047237  0.81869739  0.24515792  1
  H  H65  1  0.82048114  0.68132187  0.25484701  1
  H  H66  1  0.98228620  0.36387014  0.05392613  1
  H  H67  1  0.48228554  0.13614828  0.44607505  1
  H  H68  1  0.01783558  0.63583124  0.94606682  1
  H  H69  1  0.51784404  0.86417735  0.55393257  1
  H  H70  1  0.96682692  0.36370489  0.92132993  1
  H  H71  1  0.46682902  0.13629487  0.57866957  1
  H  H72  1  0.03328917  0.63612662  0.07875023  1
  H  H73  1  0.53328647  0.86388546  0.42124822  1
  C  C74  1  0.82627255  0.13303777  0.86000646  1
  C  C75  1  0.32626867  0.36695623  0.63999421  1
  C  C76  1  0.17358226  0.86706168  0.13995332  1
  C  C77  1  0.67357873  0.63293843  0.36004508  1
  C  C78  1  0.13738686  0.23835932  0.95250788  1
  C  C79  1  0.63739182  0.26165664  0.54749256  1
  C  C80  1  0.86268801  0.76134399  0.04746324  1
  C  C81  1  0.36269048  0.73867218  0.45254083  1
  C  C82  1  0.66894555  0.34092014  0.99921555  1
  C  C83  1  0.16896547  0.15913015  0.50080815  1
  C  C84  1  0.33110952  0.65908626  0.00096137  1
  C  C85  1  0.83110220  0.84091411  0.49904367  1
  C  C86  1  0.75689933  0.22882018  0.03239933  1
  C  C87  1  0.25688843  0.27117501  0.46760484  1
  C  C88  1  0.24325008  0.77103062  0.96762127  1
  C  C89  1  0.74324185  0.72896632  0.53237968  1
  C  C90  1  0.72601916  0.23841337  0.82679884  1
  C  C91  1  0.22600789  0.26156661  0.67320138  1
  C  C92  1  0.27384410  0.76171026  0.17328621  1
  C  C93  1  0.77384294  0.73829432  0.32671676  1
  C  C94  1  0.98793767  0.29744287  0.97543966  1
  C  C95  1  0.48793818  0.20256682  0.52456237  1
  C  C96  1  0.01213482  0.70231284  0.02457286  1
  C  C97  1  0.51213658  0.79769735  0.47542323  1
  N  N98  1  0.87989192  0.18213854  0.96453883  1
  N  N99  1  0.37987388  0.31785735  0.53546345  1
  N  N100  1  0.12006651  0.81772273  0.03538327  1
  N  N101  1  0.62005746  0.68227858  0.46461409  1
  N  N102  1  0.17839158  0.14276246  0.01655698  1
  N  N103  1  0.67840111  0.35723635  0.48343366  1
  N  N104  1  0.82178983  0.85707439  0.98349277  1
  N  N105  1  0.32180595  0.64292575  0.51650074  1
  N  N106  1  0.61274762  0.29368783  0.89892205  1
  N  N107  1  0.11274399  0.20629817  0.60108138  1
  N  N108  1  0.38732832  0.70643257  0.10129220  1
  N  N109  1  0.88731998  0.79356764  0.39871099  1
  O  O110  1  0.04255043  0.94066587  0.86062295  1
  O  O111  1  0.54256157  0.55928716  0.63937130  1
  O  O112  1  0.95620844  0.06164242  0.13862296  1
  O  O113  1  0.45620217  0.43815459  0.36142335  1
  O  O114  1  -0.00466368  0.93923682  0.63538790  1
  O  O115  1  0.49533246  0.56075663  0.86461163  1
  O  O116  1  1.00480731  0.06083514  0.36445821  1
  O  O117  1  0.50481540  0.43920180  0.13554372  1
  O  O118  1  0.90155555  0.41447900  0.64286064  1
  O  O119  1  0.40157089  0.08551363  0.85714176  1
  O  O120  1  0.09846873  0.58547708  0.35722840  1
  O  O121  1  0.59843013  0.91455006  0.14274824  1
  O  O122  1  0.04155918  0.66950341  0.68141599  1
  O  O123  1  0.54154806  0.83045610  0.81856600  1
  O  O124  1  0.95866468  0.33086268  0.31876019  1
  O  O125  1  0.45868004  0.16914442  0.18125337  1
  O  O126  1  0.28525787  0.85347908  0.71049822  1
  O  O127  1  0.78526108  0.64650590  0.78949951  1
  O  O128  1  0.71479513  0.14624513  0.28967202  1
  O  O129  1  0.21480355  0.35377020  0.21029594  1
  O  O130  1  0.03037349  0.51704564  0.83067076  1
  O  O131  1  0.53036896  0.98293586  0.66932470  1
  O  O132  1  0.96962376  0.48316903  0.16944023  1
  O  O133  1  0.46963526  0.01681881  0.33055369  1
