# generated using pymatgen
data_V2Fe2CoH32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.36669632
_cell_length_b   9.71992933
_cell_length_c   13.66454067
_cell_angle_alpha   103.40182520
_cell_angle_beta   89.99999882
_cell_angle_gamma   90.00014127
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2Fe2CoH32C12(NO2)6
_chemical_formula_sum   'V4 Fe4 Co2 H64 C24 N12 O24'
_cell_volume   1210.19145373
_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
  V  V0  1  0.09257989  0.86150572  0.72934663  1
  V  V1  1  0.59256627  0.63851853  0.77066180  1
  V  V2  1  0.90731910  0.13850910  0.27066482  1
  V  V3  1  0.40730007  0.36153137  0.22934916  1
  Fe  Fe4  1  0.94560823  0.55090851  0.72949024  1
  Fe  Fe5  1  0.44561256  0.94908918  0.77052926  1
  Fe  Fe6  1  0.05436321  0.44909457  0.27051104  1
  Fe  Fe7  1  0.55436980  0.05091426  0.22950582  1
  Co  Co8  1  0.00076737  0.99942742  1.00036044  1
  Co  Co9  1  0.50076109  0.50055991  0.49966094  1
  H  H10  1  0.18981355  0.19251468  0.08815192  1
  H  H11  1  0.68977539  0.30746745  0.41185240  1
  H  H12  1  0.81056496  0.80768402  0.91188842  1
  H  H13  1  0.31051925  0.69230386  0.58812282  1
  H  H14  1  0.27742651  0.09669158  0.98962387  1
  H  H15  1  0.77739738  0.40330145  0.51037536  1
  H  H16  1  0.72301409  0.90365073  0.01044716  1
  H  H17  1  0.22297985  0.59633920  0.48955966  1
  H  H18  1  0.58198661  0.38141213  0.87037942  1
  H  H19  1  0.08200632  0.11859596  0.62961528  1
  H  H20  1  0.41791041  0.61864298  0.12960234  1
  H  H21  1  0.91792073  0.88137454  0.37039236  1
  H  H22  1  0.48260319  0.17261959  0.88807606  1
  H  H23  1  -0.01739456  0.32739573  0.61192472  1
  H  H24  1  0.51741300  0.82743941  0.11191072  1
  H  H25  1  1.01742000  0.67259006  0.38808407  1
  H  H26  1  0.76689299  0.02964152  0.85181313  1
  H  H27  1  0.26692777  0.47036600  0.64817446  1
  H  H28  1  0.23297850  0.97041416  0.14814584  1
  H  H29  1  0.73300797  0.52959019  0.35183526  1
  H  H30  1  0.91775180  0.09703146  0.80110322  1
  H  H31  1  0.41778417  0.40296971  0.69888050  1
  H  H32  1  0.08210952  0.90299026  0.19887845  1
  H  H33  1  0.58213671  0.59701057  0.30110318  1
  H  H34  1  0.20827028  0.33005934  0.96951447  1
  H  H35  1  0.70825654  0.16990183  0.53046714  1
  H  H36  1  0.79162401  0.66982405  0.03043229  1
  H  H37  1  0.29161630  0.83013724  0.46955335  1
  H  H38  1  0.16865395  0.18097923  0.87265857  1
  H  H39  1  0.66863900  0.31896111  0.62735133  1
  H  H40  1  0.83138283  0.81880771  0.12735571  1
  H  H41  1  0.33137198  0.68113027  0.37265717  1
  H  H42  1  0.58332614  0.36707766  0.04536640  1
  H  H43  1  0.08334709  0.13292526  0.45462191  1
  H  H44  1  0.41659738  0.63292439  0.95460230  1
  H  H45  1  0.91661254  0.86708478  0.54538732  1
  H  H46  1  0.74074547  0.44027313  0.00887934  1
  H  H47  1  0.24076563  0.05972792  0.49110881  1
  H  H48  1  0.25917298  0.55972064  0.99108554  1
  H  H49  1  0.75918009  0.94027554  0.50890299  1
  H  H50  1  0.79675880  0.26203190  0.10430326  1
  H  H51  1  0.29678433  0.23796317  0.39568717  1
  H  H52  1  0.20317746  0.73792070  0.89561578  1
  H  H53  1  0.70320177  0.76206560  0.60437014  1
  H  H54  1  0.69496273  0.13136292  0.02263256  1
  H  H55  1  0.19498536  0.36863439  0.47735365  1
  H  H56  1  0.30501706  0.86860235  0.97729062  1
  H  H57  1  0.80504155  0.63139372  0.52269326  1
  H  H58  1  0.80898515  0.32053730  0.80215373  1
  H  H59  1  0.30901092  0.17946987  0.69783450  1
  H  H60  1  0.19091556  0.67952094  0.19781302  1
  H  H61  1  0.69093145  0.82048715  0.30217563  1
  H  H62  1  0.68757110  0.18380037  0.74976079  1
  H  H63  1  0.18760059  0.31620929  0.75023072  1
  H  H64  1  0.31232829  0.81625914  0.25018481  1
  H  H65  1  0.81234995  0.68375283  0.24980395  1
  H  H66  1  0.96700400  0.42297938  0.10458173  1
  H  H67  1  0.46699116  0.07701699  0.39544596  1
  H  H68  1  0.03298457  0.57705729  0.89548721  1
  H  H69  1  0.53296542  0.92293764  0.60453593  1
  H  H70  1  0.96613362  0.37408624  0.93133043  1
  H  H71  1  0.46609386  0.12589472  0.56867130  1
  H  H72  1  0.03408466  0.62592519  0.06871946  1
  H  H73  1  0.53404174  0.87405203  0.43128134  1
  C  C74  1  0.82873774  0.12591460  0.85368255  1
  C  C75  1  0.32876371  0.37409022  0.64630749  1
  C  C76  1  0.17114002  0.87414248  0.14628923  1
  C  C77  1  0.67116181  0.62586013  0.35369708  1
  C  C78  1  0.14183804  0.23406214  0.95096023  1
  C  C79  1  0.64182892  0.26590067  0.54904317  1
  C  C80  1  0.85814900  0.76575249  0.04903236  1
  C  C81  1  0.35813675  0.73420418  0.45097609  1
  C  C82  1  0.67681853  0.34200075  0.99575414  1
  C  C83  1  0.17683862  0.15800003  0.50423621  1
  C  C84  1  0.32308512  0.65800165  0.00420449  1
  C  C85  1  0.82310067  0.84200039  0.49578480  1
  C  C86  1  0.76080470  0.22541948  0.02652494  1
  C  C87  1  0.26082565  0.27457920  0.47346350  1
  C  C88  1  0.23915360  0.77456727  0.97340064  1
  C  C89  1  0.73917467  0.72542885  0.52658489  1
  C  C90  1  0.73991770  0.23746328  0.82003918  1
  C  C91  1  0.23994033  0.26254272  0.67995026  1
  C  C92  1  0.25997531  0.76258578  0.17990851  1
  C  C93  1  0.75999165  0.73742265  0.32007968  1
  C  C94  1  0.99175019  0.27920217  0.96001145  1
  C  C95  1  0.49174170  0.22077049  0.53999096  1
  C  C96  1  0.00821042  0.72060037  0.03992387  1
  C  C97  1  0.50819974  0.77936813  0.46007900  1
  N  N98  1  0.88384175  0.17823633  0.95824255  1
  N  N99  1  0.38386159  0.32176258  0.54174768  1
  N  N100  1  0.11604742  0.82180616  0.04170507  1
  N  N101  1  0.61606328  0.67818208  0.45828352  1
  N  N102  1  0.17833452  0.13647120  0.01475702  1
  N  N103  1  0.67830844  0.36350587  0.48525132  1
  N  N104  1  0.82199060  0.86351254  0.98533436  1
  N  N105  1  0.32195832  0.63646388  0.51468079  1
  N  N106  1  0.63018802  0.29735334  0.89233028  1
  N  N107  1  0.13020974  0.20265222  0.60766022  1
  N  N108  1  0.36971092  0.70268984  0.10762520  1
  N  N109  1  0.86972653  0.79732162  0.39236393  1
  O  O110  1  0.05267999  0.90604784  0.85668580  1
  O  O111  1  0.55262526  0.59398943  0.64332775  1
  O  O112  1  0.94690489  0.09408080  0.14324773  1
  O  O113  1  0.44682747  0.40597684  0.35677422  1
  O  O114  1  0.01247371  0.97615666  0.67026937  1
  O  O115  1  0.51247207  0.52387217  0.82974854  1
  O  O116  1  0.98749230  0.02378332  0.32963925  1
  O  O117  1  0.48749745  0.47626195  0.17038903  1
  O  O118  1  0.90226244  0.39655900  0.62327301  1
  O  O119  1  0.40226435  0.10345077  0.87673589  1
  O  O120  1  0.09777541  0.60343769  0.37669545  1
  O  O121  1  0.59776689  0.89659295  0.12329955  1
  O  O122  1  0.03713256  0.68802942  0.67270872  1
  O  O123  1  0.53715180  0.81199529  0.82732681  1
  O  O124  1  0.96287006  0.31194182  0.32728889  1
  O  O125  1  0.46288690  0.18810050  0.17275516  1
  O  O126  1  0.27923518  0.85753194  0.70778392  1
  O  O127  1  0.77922360  0.64247970  0.79220301  1
  O  O128  1  0.72070244  0.14253294  0.29232823  1
  O  O129  1  0.22068918  0.35749854  0.20765361  1
  O  O130  1  0.04718110  0.49995790  0.83579749  1
  O  O131  1  0.54719217  1.00002933  0.66422199  1
  O  O132  1  0.95273394  0.50007141  0.16424683  1
  O  O133  1  0.45275029  -0.00007465  0.33577012  1
