# generated using pymatgen
data_Mn2FeCoH28(C7N8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11781478
_cell_length_b   10.13498686
_cell_length_c   12.55809589
_cell_angle_alpha   90.03572614
_cell_angle_beta   89.98980539
_cell_angle_gamma   106.43718571
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2FeCoH28(C7N8)4
_chemical_formula_sum   'Mn2 Fe1 Co1 H28 C28 N32'
_cell_volume   990.97740732
_cell_formula_units_Z   1
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  0.16415128  0.12720158  0.55807166  1
  Co  Co1  1  0.34361027  0.86962201  0.05646003  1
  Mn  Mn2  1  0.84146431  0.86648577  0.44449863  1
  Mn  Mn3  1  0.65941380  0.13089793  0.94667884  1
  H  H4  1  0.11310098  0.45017655  0.57918898  1
  H  H5  1  0.38520830  0.54948605  0.07986221  1
  H  H6  1  0.88428833  0.54978065  0.41972521  1
  H  H7  1  0.61389061  0.44940847  0.92142595  1
  H  H8  1  0.18629213  0.64892034  0.46011252  1
  H  H9  1  0.31144604  0.35034455  0.96058888  1
  H  H10  1  0.81137511  0.34986817  0.54004462  1
  H  H11  1  0.68775757  0.64974909  0.04092515  1
  H  H12  1  0.38791497  0.65382675  0.30342182  1
  H  H13  1  0.11145221  0.34620760  0.80353656  1
  H  H14  1  0.61196952  0.34605560  0.69675893  1
  H  H15  1  0.89043982  0.65526499  0.19659591  1
  H  H16  1  0.50311980  0.45012760  0.27847340  1
  H  H17  1  0.99721818  0.55047425  0.77826471  1
  H  H18  1  0.49742722  0.54985696  0.72210547  1
  H  H19  1  0.00469506  0.45145673  0.22179858  1
  H  H20  1  0.52530847  0.22860380  0.34515291  1
  H  H21  1  0.97487265  0.76929554  0.84484092  1
  H  H22  1  0.47391965  0.76870795  0.65586377  1
  H  H23  1  0.02751279  0.23247301  0.15644758  1
  H  H24  1  0.50164648  0.00786279  0.37722383  1
  H  H25  1  0.99981058  0.99450275  0.87804830  1
  H  H26  1  0.49849536  0.99445649  0.62236378  1
  H  H27  1  0.00302923  0.00588248  0.12314406  1
  H  H28  1  0.33238696  0.90274874  0.45549299  1
  H  H29  1  0.17005427  0.09702230  0.95777932  1
  H  H30  1  0.66812436  0.09652368  0.54274668  1
  H  H31  1  0.83323522  0.90372084  0.04332324  1
  C  C32  1  0.19441869  0.44892696  0.51010833  1
  C  C33  1  0.30412630  0.55082008  0.01075539  1
  C  C34  1  0.80426414  0.55022245  0.48942788  1
  C  C35  1  0.69487059  0.44922480  0.99068887  1
  C  C36  1  0.23894600  0.56349469  0.44321659  1
  C  C37  1  0.25966815  0.43619134  0.94368504  1
  C  C38  1  0.75975497  0.43592403  0.55654443  1
  C  C39  1  0.73995777  0.56400575  0.05741042  1
  C  C40  1  0.35061109  0.56625802  0.35744843  1
  C  C41  1  0.14872159  0.43376148  0.85764643  1
  C  C42  1  0.64903061  0.43361064  0.64272326  1
  C  C43  1  0.85208312  0.56724701  0.14295987  1
  C  C44  1  0.41550619  0.45522879  0.34303004  1
  C  C45  1  0.08422978  0.54498836  0.84305399  1
  C  C46  1  0.58455291  0.54487375  0.65722618  1
  C  C47  1  0.91661025  0.45605734  0.15740226  1
  C  C48  1  0.36217064  0.34178324  0.41260861  1
  C  C49  1  0.13729479  0.65812399  0.91295115  1
  C  C50  1  0.63760096  0.65796609  0.58759732  1
  C  C51  1  0.86287547  0.34238406  0.08822339  1
  C  C52  1  0.42297787  0.22270797  0.40334245  1
  C  C53  1  0.07669623  0.77778792  0.90367413  1
  C  C54  1  0.57600606  0.77666240  0.59701620  1
  C  C55  1  0.92489309  0.22390853  0.09780769  1
  C  C56  1  0.43538563  -0.00034400  0.45449544  1
  C  C57  1  0.06601531  1.00083178  0.95524387  1
  C  C58  1  0.56416880  1.00021122  0.54512358  1
  C  C59  1  0.93716225  0.00000525  0.04600128  1
  N  N60  1  0.24893117  0.33681770  0.49443582  1
  N  N61  1  0.24913800  0.66248285  0.99485152  1
  N  N62  1  0.75205112  0.66349115  0.50624682  1
  N  N63  1  0.74783188  0.33630794  0.00713421  1
  N  N64  1  0.35706322  0.11367127  0.46134660  1
  N  N65  1  0.14269193  0.88604607  0.96139554  1
  N  N66  1  0.64091259  0.88513897  0.53872736  1
  N  N67  1  0.86009738  0.11472409  0.04021532  1
  N  N68  1  0.02951791  0.91736949  0.57395303  1
  N  N69  1  0.47215697  0.08271871  0.07468582  1
  N  N70  1  0.97754569  0.08702475  0.43017630  1
  N  N71  1  0.52460897  0.91488940  0.92812884  1
  N  N72  1  0.09295498  0.83435653  0.61459962  1
  N  N73  1  0.40566347  0.16400433  0.11411904  1
  N  N74  1  0.91752271  0.17247531  0.39056915  1
  N  N75  1  0.58312823  0.82752650  0.89065792  1
  N  N76  1  0.15323808  0.75132860  0.64791353  1
  N  N77  1  0.34554234  0.24730842  0.14782328  1
  N  N78  1  0.85094055  0.24943715  0.35350071  1
  N  N79  1  0.64831086  0.74864136  0.85469096  1
  N  N80  1  0.97031740  0.20032540  0.64941530  1
  N  N81  1  0.52713956  0.80043504  0.14933255  1
  N  N82  1  0.03419189  0.80159920  0.34577189  1
  N  N83  1  0.45883987  0.19571357  0.84332157  1
  N  N84  1  0.87923655  0.15750219  0.72332668  1
  N  N85  1  0.61999018  0.84261681  0.22235817  1
  N  N86  1  0.12712435  0.84058623  0.27180104  1
  N  N87  1  0.36954839  0.15908778  0.76820083  1
  N  N88  1  0.78077862  0.11551597  0.79301769  1
  N  N89  1  0.71972929  0.88380351  0.29172877  1
  N  N90  1  0.22425364  0.88575390  0.20218008  1
  N  N91  1  0.27377838  0.12144012  0.69600890  1
