# generated using pymatgen
data_Mn2FeCo2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35915074
_cell_length_b   9.71907997
_cell_length_c   13.66483687
_cell_angle_alpha   103.43454654
_cell_angle_beta   90.00001475
_cell_angle_gamma   90.00015672
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2FeCo2H32C12(NO2)6
_chemical_formula_sum   'Mn4 Fe2 Co4 H64 C24 N12 O24'
_cell_volume   1208.97236915
_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  0.09366777  0.85821099  0.73479668  1
  Co  Co1  1  0.59366496  0.64180133  0.76521092  1
  Co  Co2  1  0.90607804  0.14170652  0.26511013  1
  Co  Co3  1  0.40607654  0.35833209  0.23490298  1
  Mn  Mn4  1  0.94705371  0.55701725  0.72693145  1
  Mn  Mn5  1  0.44705832  0.94297355  0.77306940  1
  Mn  Mn6  1  0.05288946  0.44295063  0.27297554  1
  Mn  Mn7  1  0.55289762  0.05706316  0.22701868  1
  Fe  Fe8  1  0.00016429  0.99979755  1.00004321  1
  Fe  Fe9  1  0.50015899  0.50016179  0.49996269  1
  H  H10  1  0.18866730  0.19866445  0.09230099  1
  H  H11  1  0.68866001  0.30132620  0.40769932  1
  H  H12  1  0.81130833  0.80123866  0.90775444  1
  H  H13  1  0.31128405  0.69876991  0.59226089  1
  H  H14  1  0.27539451  0.09945999  0.99347457  1
  H  H15  1  0.77538484  0.40053354  0.50652104  1
  H  H16  1  0.72479117  0.90058888  0.00663084  1
  H  H17  1  0.22479116  0.59940485  0.49337747  1
  H  H18  1  0.54026631  0.46640827  0.86767601  1
  H  H19  1  0.04025444  0.03358311  0.63230712  1
  H  H20  1  0.45945982  0.53386922  0.13273467  1
  H  H21  1  0.95945260  0.96615368  0.36727396  1
  H  H22  1  0.54124789  0.22045916  0.88836726  1
  H  H23  1  0.04125846  0.27953738  0.61162933  1
  H  H24  1  0.45886680  0.77956712  0.11153869  1
  H  H25  1  0.95887508  0.72044255  0.38846323  1
  H  H26  1  0.77453961  0.03444266  0.85116290  1
  H  H27  1  0.27456747  0.46554766  0.64882998  1
  H  H28  1  0.22563121  0.96556869  0.14885531  1
  H  H29  1  0.72566581  0.53443082  0.35113663  1
  H  H30  1  0.92508740  0.11003817  0.80686115  1
  H  H31  1  0.42510650  0.38994574  0.69313868  1
  H  H32  1  0.07500757  0.89005301  0.19313229  1
  H  H33  1  0.57502947  0.60993872  0.30686874  1
  H  H34  1  0.21536399  0.32923628  0.96697726  1
  H  H35  1  0.71538619  0.17073458  0.53299941  1
  H  H36  1  0.78474352  0.67059016  0.03303756  1
  H  H37  1  0.28477064  0.82937275  0.46693899  1
  H  H38  1  0.15378934  0.18056259  0.87609023  1
  H  H39  1  0.65380985  0.31938556  0.62390326  1
  H  H40  1  0.84623210  0.81927760  0.12393897  1
  H  H41  1  0.34625868  0.68065483  0.37606104  1
  H  H42  1  0.58170558  0.37707480  0.05692450  1
  H  H43  1  0.08170639  0.12292257  0.44307455  1
  H  H44  1  0.41837195  0.62267154  0.94282736  1
  H  H45  1  0.91837006  0.87733535  0.55717744  1
  H  H46  1  0.74117216  0.43247246  0.00118589  1
  H  H47  1  0.24117533  0.06751438  0.49881442  1
  H  H48  1  0.25883031  0.56752719  0.99878129  1
  H  H49  1  0.75881898  0.93246826  0.50122029  1
  H  H50  1  0.79560068  0.26245737  0.10646903  1
  H  H51  1  0.29560291  0.23752778  0.39352991  1
  H  H52  1  0.20442109  0.73741479  0.89348220  1
  H  H53  1  0.70442945  0.76256845  0.60651798  1
  H  H54  1  0.69158665  0.13108266  0.02652790  1
  H  H55  1  0.19160543  0.36891013  0.47347709  1
  H  H56  1  0.30844666  0.86890385  0.97332512  1
  H  H57  1  0.80847175  0.63109752  0.52667436  1
  H  H58  1  0.80086949  0.33205903  0.81419214  1
  H  H59  1  0.30086879  0.16793542  0.68581096  1
  H  H60  1  0.19927076  0.66791020  0.18574103  1
  H  H61  1  0.69926944  0.83209184  0.31426238  1
  H  H62  1  0.69373952  0.18842133  0.75136395  1
  H  H63  1  0.19374493  0.31158070  0.74863540  1
  H  H64  1  0.30643130  0.81151740  0.24855345  1
  H  H65  1  0.80644187  0.68849425  0.25144859  1
  H  H66  1  0.98368163  0.35886328  0.05411015  1
  H  H67  1  0.48369161  0.14110552  0.44588829  1
  H  H68  1  0.01643504  0.64107581  0.94593409  1
  H  H69  1  0.51644544  0.85889289  0.55406386  1
  H  H70  1  0.96885229  0.36517156  0.92358856  1
  H  H71  1  0.46886902  0.13480845  0.57641675  1
  H  H72  1  0.03138366  0.63486051  0.07646301  1
  H  H73  1  0.53139818  0.86511448  0.42354012  1
  C  C74  1  0.83370610  0.13342410  0.85762147  1
  C  C75  1  0.33372408  0.36656314  0.64237759  1
  C  C76  1  0.16638832  0.86662507  0.14237344  1
  C  C77  1  0.66640996  0.63336934  0.35762551  1
  C  C78  1  0.14116545  0.23923933  0.95439156  1
  C  C79  1  0.64117908  0.26072483  0.54559952  1
  C  C80  1  0.85889318  0.76063289  0.04564224  1
  C  C81  1  0.35891133  0.73933018  0.45435910  1
  C  C82  1  0.67239047  0.33982019  0.99774705  1
  C  C83  1  0.17239651  0.16016992  0.50225392  1
  C  C84  1  0.32765397  0.66017609  0.00219395  1
  C  C85  1  0.82765030  0.83982467  0.49780597  1
  C  C86  1  0.75868530  0.22437878  0.02932217  1
  C  C87  1  0.25869379  0.27560701  0.47067790  1
  C  C88  1  0.24137390  0.77559784  0.97061624  1
  C  C89  1  0.74138529  0.72439367  0.52938446  1
  C  C90  1  0.73707242  0.24168898  0.82485010  1
  C  C91  1  0.23707905  0.25830870  0.67515073  1
  C  C92  1  0.26304131  0.75831573  0.17508170  1
  C  C93  1  0.76305093  0.74169007  0.32491974  1
  C  C94  1  0.99081873  0.29660001  0.97575771  1
  C  C95  1  0.49083078  0.20337057  0.52424116  1
  C  C96  1  0.00927624  0.70336880  0.02427445  1
  C  C97  1  0.50929007  0.79660035  0.47572132  1
  N  N98  1  0.88358216  0.18023211  0.96291498  1
  N  N99  1  0.38360045  0.31974577  0.53708267  1
  N  N100  1  0.11644968  0.81985441  0.03706232  1
  N  N101  1  0.61646973  0.68012462  0.46293632  1
  N  N102  1  0.17815081  0.14235172  0.01871867  1
  N  N103  1  0.67814002  0.35762923  0.48128085  1
  N  N104  1  0.82196863  0.85749251  0.98130227  1
  N  N105  1  0.32195056  0.64248976  0.51870582  1
  N  N106  1  0.62103536  0.29559388  0.89497099  1
  N  N107  1  0.12104487  0.20440076  0.60502848  1
  N  N108  1  0.37898336  0.70443410  0.10490715  1
  N  N109  1  0.87898775  0.79557735  0.39509716  1
  O  O110  1  0.05305996  0.92836132  0.86330934  1
  O  O111  1  0.55299899  0.57185034  0.63668296  1
  O  O112  1  0.94556208  0.07234957  0.13635179  1
  O  O113  1  0.44542256  0.42789961  0.36365125  1
  O  O114  1  -0.00007140  0.94110815  0.63802654  1
  O  O115  1  0.49992879  0.55888140  0.86195807  1
  O  O116  1  0.99994846  0.05853035  0.36148570  1
  O  O117  1  0.49997185  0.44150103  0.13852855  1
  O  O118  1  0.90258670  0.41974074  0.63443927  1
  O  O119  1  0.40260260  0.08027106  0.86554931  1
  O  O120  1  0.09734733  0.58024051  0.36545224  1
  O  O121  1  0.59736882  0.91979789  0.13452626  1
  O  O122  1  0.05296625  0.66735439  0.67501656  1
  O  O123  1  0.55296766  0.83266382  0.82500441  1
  O  O124  1  0.94705808  0.33258844  0.32489162  1
  O  O125  1  0.44705117  0.16745584  0.17513494  1
  O  O126  1  0.29775761  0.84923474  0.71983188  1
  O  O127  1  0.79774343  0.65076647  0.78017195  1
  O  O128  1  0.70207831  0.15079350  0.28039722  1
  O  O129  1  0.20205458  0.34922026  0.21960478  1
  O  O130  1  0.03850144  0.50694107  0.81705852  1
  O  O131  1  0.53850794  0.99305019  0.68294359  1
  O  O132  1  0.96137486  0.49313979  0.18291720  1
  O  O133  1  0.46140592  0.00686778  0.31708287  1
