# generated using pymatgen
data_Mn4CoH32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.36242894
_cell_length_b   9.72060990
_cell_length_c   13.66374279
_cell_angle_alpha   103.42471803
_cell_angle_beta   90.00003122
_cell_angle_gamma   90.00012251
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn4CoH32C12(NO2)6
_chemical_formula_sum   'Mn8 Co2 H64 C24 N12 O24'
_cell_volume   1209.53890620
_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
  Mn  Mn0  1  0.09502960  0.85130692  0.73189652  1
  Mn  Mn1  1  0.59503568  0.64868235  0.76810773  1
  Mn  Mn2  1  0.90496855  0.14869459  0.26810388  1
  Mn  Mn3  1  0.40496594  0.35131889  0.23189153  1
  Mn  Mn4  1  0.95402273  0.54946487  0.72248475  1
  Mn  Mn5  1  0.45402375  0.95052914  0.77751955  1
  Mn  Mn6  1  0.04597705  0.45053549  0.27751641  1
  Mn  Mn7  1  0.54597314  0.04947306  0.22247942  1
  Co  Co8  1  -0.00000515  1.00000729  0.99999874  1
  Co  Co9  1  0.49999869  0.50000166  0.50000055  1
  H  H10  1  0.17507671  0.19357097  0.09556863  1
  H  H11  1  0.67506492  0.30642551  0.40442583  1
  H  H12  1  0.82492608  0.80642817  0.90443087  1
  H  H13  1  0.32492886  0.69357822  0.59557355  1
  H  H14  1  0.26799904  0.09573852  0.99967632  1
  H  H15  1  0.76799611  0.40425955  0.50031205  1
  H  H16  1  0.73200306  0.90426023  0.00032258  1
  H  H17  1  0.23200188  0.59574141  0.49968526  1
  H  H18  1  0.53214606  0.46357596  0.88011073  1
  H  H19  1  0.03215548  0.03641674  0.61989112  1
  H  H20  1  0.46786260  0.53642458  0.11988870  1
  H  H21  1  0.96784457  0.96358341  0.38010932  1
  H  H22  1  0.53924667  0.22623892  0.89428395  1
  H  H23  1  0.03924654  0.27375149  0.60571797  1
  H  H24  1  0.46074850  0.77376362  0.10571733  1
  H  H25  1  0.96075214  0.72624914  0.39428303  1
  H  H26  1  0.77131858  0.03775722  0.85251861  1
  H  H27  1  0.27132054  0.46224057  0.64748601  1
  H  H28  1  0.22868134  0.96224189  0.14747906  1
  H  H29  1  0.72868211  0.53775955  0.35251572  1
  H  H30  1  0.92096150  0.11309954  0.80757938  1
  H  H31  1  0.42096063  0.38690083  0.69242854  1
  H  H32  1  0.07903731  0.88690321  0.19241814  1
  H  H33  1  0.57904066  0.61309633  0.30757253  1
  H  H34  1  0.21624526  0.32395016  0.96815732  1
  H  H35  1  0.71624605  0.17605150  0.53183892  1
  H  H36  1  0.78375470  0.67605081  0.03184226  1
  H  H37  1  0.28375486  0.82394924  0.46815739  1
  H  H38  1  0.15052707  0.17595282  0.87824563  1
  H  H39  1  0.65053170  0.32405088  0.62175037  1
  H  H40  1  0.84947522  0.82404775  0.12175340  1
  H  H41  1  0.34947081  0.67594707  0.37824888  1
  H  H42  1  0.57937993  0.39518139  0.06742681  1
  H  H43  1  0.07938107  0.10482608  0.43257990  1
  H  H44  1  0.42062296  0.60481768  0.93257828  1
  H  H45  1  0.92061889  0.89517511  0.56742051  1
  H  H46  1  0.74369612  0.43843050  0.00432664  1
  H  H47  1  0.24370030  0.06157170  0.49567511  1
  H  H48  1  0.25630407  0.56156800  0.99567541  1
  H  H49  1  0.75629933  0.93842875  0.50432599  1
  H  H50  1  0.79625673  0.26806644  0.10794235  1
  H  H51  1  0.29625734  0.23193046  0.39205880  1
  H  H52  1  0.20374610  0.73192616  0.89205757  1
  H  H53  1  0.70374287  0.76806689  0.60794163  1
  H  H54  1  0.68936001  0.13707795  0.03003051  1
  H  H55  1  0.18936657  0.36292536  0.46997354  1
  H  H56  1  0.31063974  0.86291861  0.96996807  1
  H  H57  1  0.81063629  0.63707605  0.53002627  1
  H  H58  1  0.79652624  0.33541917  0.81507392  1
  H  H59  1  0.29652267  0.16458001  0.68492677  1
  H  H60  1  0.20347134  0.66458453  0.18492803  1
  H  H61  1  0.70347583  0.83541720  0.31507144  1
  H  H62  1  0.68631734  0.19244626  0.75432844  1
  H  H63  1  0.18631881  0.30755368  0.74567916  1
  H  H64  1  0.31367835  0.80755892  0.24567406  1
  H  H65  1  0.81368210  0.69244398  0.25432179  1
  H  H66  1  0.98351001  0.36039259  0.05505939  1
  H  H67  1  0.48350424  0.13960649  0.44494160  1
  H  H68  1  0.01649005  0.63960528  0.94493975  1
  H  H69  1  0.51649559  0.86039342  0.55505779  1
  H  H70  1  0.96983741  0.36594662  0.92419366  1
  H  H71  1  0.46984174  0.13405163  0.57580908  1
  H  H72  1  0.03016164  0.63405005  0.07580606  1
  H  H73  1  0.53015996  0.86594702  0.42419048  1
  C  C74  1  0.83044743  0.13669564  0.85904151  1
  C  C75  1  0.33044757  0.36330384  0.64096408  1
  C  C76  1  0.16955256  0.86330434  0.14095718  1
  C  C77  1  0.66955358  0.63669526  0.35903707  1
  C  C78  1  0.13893929  0.23664167  0.95601321  1
  C  C79  1  0.63893969  0.26335930  0.54398357  1
  C  C80  1  0.86106232  0.76335792  0.04398608  1
  C  C81  1  0.36106053  0.73664061  0.45601527  1
  C  C82  1  0.67614075  0.34481927  0.99915832  1
  C  C83  1  0.17613731  0.15517338  0.50083954  1
  C  C84  1  0.32386166  0.65517562  0.00084147  1
  C  C85  1  0.82386157  0.84482683  0.49916088  1
  C  C86  1  0.75820946  0.22869903  0.03119025  1
  C  C87  1  0.25820899  0.27129895  0.46881342  1
  C  C88  1  0.24179270  0.77129634  0.96880999  1
  C  C89  1  0.74179145  0.72870076  0.53118712  1
  C  C90  1  0.73345983  0.24515217  0.82670890  1
  C  C91  1  0.23345837  0.25484535  0.67329431  1
  C  C92  1  0.26653797  0.75484832  0.17329217  1
  C  C93  1  0.76654092  0.74515396  0.32670566  1
  C  C94  1  0.98991334  0.29734946  0.97671573  1
  C  C95  1  0.48991348  0.20264885  0.52328643  1
  C  C96  1  0.01008693  0.70264819  0.02328401  1
  C  C97  1  0.51008682  0.79735068  0.47671353  1
  N  N98  1  0.88198087  0.18184886  0.96407926  1
  N  N99  1  0.38197929  0.31814666  0.53592670  1
  N  N100  1  0.11802198  0.81814525  0.03592031  1
  N  N101  1  0.61802143  0.68185302  0.46407427  1
  N  N102  1  0.16974670  0.13925423  0.02114561  1
  N  N103  1  0.66974201  0.36074391  0.47884840  1
  N  N104  1  0.83025548  0.86074499  0.97885350  1
  N  N105  1  0.33025517  0.63925797  0.52115149  1
  N  N106  1  0.62015257  0.30025574  0.89940945  1
  N  N107  1  0.12015137  0.19973989  0.60059487  1
  N  N108  1  0.37984760  0.69974382  0.10059367  1
  N  N109  1  0.87984776  0.80026083  0.39940552  1
  O  O110  1  0.04001857  0.94752045  0.87355137  1
  O  O111  1  0.54002964  0.55248835  0.62644980  1
  O  O112  1  0.95997503  0.05248818  0.12644634  1
  O  O113  1  0.45997088  0.44751819  0.37355335  1
  O  O114  1  -0.00769057  0.94753003  0.63284687  1
  O  O115  1  0.49229658  0.55245653  0.86714885  1
  O  O116  1  1.00769095  0.05246963  0.36715253  1
  O  O117  1  0.50771116  0.44754735  0.13285457  1
  O  O118  1  0.90097415  0.40800354  0.63623116  1
  O  O119  1  0.40097874  0.09199038  0.86376909  1
  O  O120  1  0.09902542  0.59199536  0.36377218  1
  O  O121  1  0.59901965  0.90800915  0.13622840  1
  O  O122  1  0.06434125  0.64483866  0.66369301  1
  O  O123  1  0.56433168  0.85514901  0.83631266  1
  O  O124  1  0.93565182  0.35516510  0.33630565  1
  O  O125  1  0.43566845  0.14485171  0.16368331  1
  O  O126  1  0.31272978  0.84345748  0.72907078  1
  O  O127  1  0.81273620  0.65654433  0.77093446  1
  O  O128  1  0.68726654  0.15654190  0.27092815  1
  O  O129  1  0.18726466  0.34345327  0.22907093  1
  O  O130  1  0.04029361  0.50629011  0.81770431  1
  O  O131  1  0.54030167  0.99370021  0.68230058  1
  O  O132  1  0.95971145  0.49371425  0.18229582  1
  O  O133  1  0.45969096  0.00630019  0.31769520  1
