# generated using pymatgen
data_MnFe2Co2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35733805
_cell_length_b   9.71806219
_cell_length_c   13.65736061
_cell_angle_alpha   103.52707676
_cell_angle_beta   90.00001689
_cell_angle_gamma   90.00014314
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnFe2Co2H32C12(NO2)6
_chemical_formula_sum   'Mn2 Fe4 Co4 H64 C24 N12 O24'
_cell_volume   1207.48282259
_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  0.09578299  0.85496220  0.73205105  1
  Fe  Fe1  1  0.59579984  0.64505461  0.76796181  1
  Fe  Fe2  1  0.90420521  0.14504967  0.26795371  1
  Fe  Fe3  1  0.40421355  0.35497146  0.23206193  1
  Co  Co4  1  0.94545973  0.55204701  0.73210324  1
  Co  Co5  1  0.44546180  0.94793964  0.76788619  1
  Co  Co6  1  0.05454176  0.44795919  0.26789664  1
  Co  Co7  1  0.55454340  0.05205322  0.23209495  1
  Mn  Mn8  1  -0.00002853  1.00003784  0.99998946  1
  Mn  Mn9  1  0.50002574  0.50003550  0.49999913  1
  H  H10  1  0.18290177  0.19822747  0.09131835  1
  H  H11  1  0.68287795  0.30176831  0.40867274  1
  H  H12  1  0.81711516  0.80176743  0.90867564  1
  H  H13  1  0.31710070  0.69822840  0.59132105  1
  H  H14  1  0.26959389  0.09772841  0.99214963  1
  H  H15  1  0.76960067  0.40224353  0.50783136  1
  H  H16  1  0.73039930  0.90223486  0.00783883  1
  H  H17  1  0.23040935  0.59773417  0.49215020  1
  H  H18  1  0.53098119  0.46365574  0.87387690  1
  H  H19  1  0.03096844  0.03634790  0.62612961  1
  H  H20  1  0.46904036  0.53636398  0.12614970  1
  H  H21  1  0.96901304  0.96365465  0.37387583  1
  H  H22  1  0.53276352  0.21805879  0.89269222  1
  H  H23  1  0.03275996  0.28191420  0.60729104  1
  H  H24  1  0.46723408  0.78192205  0.10728952  1
  H  H25  1  0.96722928  0.71808384  0.39271125  1
  H  H26  1  0.77299314  0.03377384  0.85257975  1
  H  H27  1  0.27298951  0.46620436  0.64741225  1
  H  H28  1  0.22700266  0.96621382  0.14740441  1
  H  H29  1  0.72701282  0.53377583  0.35258766  1
  H  H30  1  0.91933971  0.11318602  0.80666376  1
  H  H31  1  0.41933019  0.38679508  0.69333769  1
  H  H32  1  0.08066025  0.88680489  0.19332729  1
  H  H33  1  0.58066636  0.61317992  0.30666619  1
  H  H34  1  0.21337187  0.32806481  0.96740248  1
  H  H35  1  0.71338068  0.17195104  0.53261416  1
  H  H36  1  0.78663070  0.67194082  0.03260554  1
  H  H37  1  0.28663911  0.82807285  0.46741507  1
  H  H38  1  0.15151581  0.18095648  0.87513127  1
  H  H39  1  0.65149459  0.31906888  0.62486459  1
  H  H40  1  0.84850848  0.81905382  0.12486583  1
  H  H41  1  0.34848473  0.68096836  0.37513485  1
  H  H42  1  0.57824698  0.38531186  0.06261195  1
  H  H43  1  0.07829503  0.11479654  0.43748322  1
  H  H44  1  0.42170197  0.61479208  0.93747989  1
  H  H45  1  0.92171238  0.88523490  0.56255143  1
  H  H46  1  0.73818110  0.43389426  -0.00019939  1
  H  H47  1  0.23816783  0.06609599  0.50021466  1
  H  H48  1  0.26182737  0.56610016  1.00021561  1
  H  H49  1  0.76181108  0.93389542  0.49979682  1
  H  H50  1  0.79563423  0.26699068  0.10708131  1
  H  H51  1  0.29562476  0.23298670  0.39291759  1
  H  H52  1  0.20437219  0.73298376  0.89291311  1
  H  H53  1  0.70435176  0.76700195  0.60708621  1
  H  H54  1  0.69057163  0.13408184  0.02955281  1
  H  H55  1  0.19056752  0.36589227  0.47045697  1
  H  H56  1  0.30942999  0.86589422  0.97044886  1
  H  H57  1  0.80942949  0.63409913  0.52955787  1
  H  H58  1  0.78785256  0.32962827  0.81228219  1
  H  H59  1  0.28782990  0.17036197  0.68772671  1
  H  H60  1  0.21215866  0.67037688  0.18772541  1
  H  H61  1  0.71214581  0.82962111  0.31227738  1
  H  H62  1  0.68048981  0.18241687  0.75350359  1
  H  H63  1  0.18047143  0.31758387  0.74649448  1
  H  H64  1  0.31951688  0.81759881  0.24649555  1
  H  H65  1  0.81951796  0.68241338  0.25350382  1
  H  H66  1  0.98151578  0.36326905  0.05270856  1
  H  H67  1  0.48152765  0.13671829  0.44728813  1
  H  H68  1  0.01847839  0.63670750  0.94728485  1
  H  H69  1  0.51849648  0.86328609  0.55271282  1
  H  H70  1  0.96866982  0.36669677  0.92060010  1
  H  H71  1  0.46869061  0.13326807  0.57939084  1
  H  H72  1  0.03131399  0.63327511  0.07939335  1
  H  H73  1  0.53133366  0.86669458  0.42059741  1
  C  C74  1  0.82864564  0.13457968  0.85820553  1
  C  C75  1  0.32863616  0.36539555  0.64179062  1
  C  C76  1  0.17135775  0.86540571  0.14178359  1
  C  C77  1  0.67135913  0.63457842  0.35820868  1
  C  C78  1  0.13757711  0.23933181  0.95351007  1
  C  C79  1  0.63757299  0.26067176  0.54648977  1
  C  C80  1  0.86243279  0.76066553  0.04648844  1
  C  C81  1  0.36242832  0.73933695  0.45351463  1
  C  C82  1  0.67000562  0.34133038  0.99803089  1
  C  C83  1  0.16999081  0.15863632  0.50195531  1
  C  C84  1  0.33000643  0.65864004  0.00195566  1
  C  C85  1  0.82998613  0.84134669  0.49804283  1
  C  C86  1  0.75679059  0.22752082  0.03031944  1
  C  C87  1  0.25679283  0.27245623  0.46968581  1
  C  C88  1  0.24320599  0.77245722  0.96968086  1
  C  C89  1  0.74320091  0.72752888  0.53032289  1
  C  C90  1  0.72694581  0.23894915  0.82538271  1
  C  C91  1  0.22693089  0.26103681  0.67461723  1
  C  C92  1  0.27306299  0.76105023  0.17461550  1
  C  C93  1  0.77305575  0.73894893  0.32538466  1
  C  C94  1  0.98778239  0.29911516  0.97424135  1
  C  C95  1  0.48778680  0.20086348  0.52575429  1
  C  C96  1  0.01221878  0.70085988  0.02574726  1
  C  C97  1  0.51222287  0.79912531  0.47425158  1
  N  N98  1  0.87984889  0.18428913  0.96256566  1
  N  N99  1  0.37984239  0.31567729  0.53743274  1
  N  N100  1  0.12015587  0.81568018  0.03742554  1
  N  N101  1  0.62015421  0.68429420  0.46256901  1
  N  N102  1  0.17251519  0.14145689  0.01728285  1
  N  N103  1  0.67250851  0.35853460  0.48271058  1
  N  N104  1  0.82748753  0.85853641  0.98271706  1
  N  N105  1  0.32748758  0.64145686  0.51728385  1
  N  N106  1  0.61350725  0.29339063  0.89778023  1
  N  N107  1  0.11348219  0.20657566  0.60222779  1
  N  N108  1  0.38651460  0.70658020  0.10222990  1
  N  N109  1  0.88649836  0.79340936  0.39777837  1
  O  O110  1  0.04597336  0.93021710  0.86616119  1
  O  O111  1  0.54607270  0.56988886  0.63381516  1
  O  O112  1  0.95394268  0.06988004  0.13381124  1
  O  O113  1  0.45401994  0.43021556  0.36616813  1
  O  O114  1  -0.00416336  0.94299409  0.63455494  1
  O  O115  1  0.49585946  0.55699926  0.86543620  1
  O  O116  1  1.00413132  0.05700627  0.36543705  1
  O  O117  1  0.50418694  0.44301260  0.13455131  1
  O  O118  1  0.90193421  0.41339318  0.63993532  1
  O  O119  1  0.40193224  0.08660587  0.86004578  1
  O  O120  1  0.09808039  0.58660727  0.36006701  1
  O  O121  1  0.59806498  0.91340777  0.13992092  1
  O  O122  1  0.04978212  0.66392599  0.67864988  1
  O  O123  1  0.54978433  0.83608929  0.82136298  1
  O  O124  1  0.95022055  0.33608520  0.32135172  1
  O  O125  1  0.45022365  0.16394866  0.17865203  1
  O  O126  1  0.29387934  0.85595780  0.71010825  1
  O  O127  1  0.79389586  0.64404618  0.78989038  1
  O  O128  1  0.70610717  0.14405025  0.28988323  1
  O  O129  1  0.20612172  0.35597773  0.21010476  1
  O  O130  1  0.03672670  0.50386787  0.82329351  1
  O  O131  1  0.53673075  0.99608488  0.67668269  1
  O  O132  1  0.96326822  0.49615848  0.17672152  1
  O  O133  1  0.46327143  0.00385238  0.32327197  1
