# generated using pymatgen
data_Mn3CoH28(C7N8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11918341
_cell_length_b   10.13529856
_cell_length_c   12.56177381
_cell_angle_alpha   90.03045288
_cell_angle_beta   89.99308257
_cell_angle_gamma   106.43364048
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3CoH28(C7N8)4
_chemical_formula_sum   'Mn3 Co1 H28 C28 N32'
_cell_volume   991.48340051
_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
  Co  Co0  1  0.15732791  0.13239874  0.55540681  1
  Mn  Mn1  1  0.33979507  0.86552084  0.05356326  1
  Mn  Mn2  1  0.84196959  0.86793026  0.44733434  1
  Mn  Mn3  1  0.65961206  0.13392041  0.94413185  1
  H  H4  1  0.11265186  0.44899699  0.57897354  1
  H  H5  1  0.38403867  0.54951908  0.07929465  1
  H  H6  1  0.88409845  0.54987673  0.42030079  1
  H  H7  1  0.61386441  0.44961825  0.92185825  1
  H  H8  1  0.18662075  0.64872956  0.46030539  1
  H  H9  1  0.31063371  0.34932487  0.95941913  1
  H  H10  1  0.81105177  0.34973013  0.53989933  1
  H  H11  1  0.68777182  0.65014238  0.04113023  1
  H  H12  1  0.38814520  0.65350540  0.30367776  1
  H  H13  1  0.11079789  0.34534289  0.80266498  1
  H  H14  1  0.61093677  0.34572626  0.69686664  1
  H  H15  1  0.88987465  0.65508058  0.19717450  1
  H  H16  1  0.50391452  0.45017387  0.27848887  1
  H  H17  1  0.99617799  0.54903078  0.77756268  1
  H  H18  1  0.49645195  0.54935023  0.72215559  1
  H  H19  1  0.00502690  0.45173056  0.22213415  1
  H  H20  1  0.52637994  0.23166313  0.34437030  1
  H  H21  1  0.97391802  0.76884579  0.84271409  1
  H  H22  1  0.47278563  0.76828741  0.65635875  1
  H  H23  1  0.02676567  0.23196378  0.15722505  1
  H  H24  1  0.50227989  0.00773564  0.37732087  1
  H  H25  1  0.99746034  0.99376494  0.87758907  1
  H  H26  1  0.49673412  0.99377168  0.62243473  1
  H  H27  1  0.00362646  0.00715321  0.12280446  1
  H  H28  1  0.33230354  0.90354210  0.45576230  1
  H  H29  1  0.16829249  0.09570731  0.95600462  1
  H  H30  1  0.66704149  0.09602390  0.54351101  1
  H  H31  1  0.83299705  0.90479903  0.04429964  1
  C  C32  1  0.19462021  0.44828864  0.51023334  1
  C  C33  1  0.30314802  0.54979840  0.01002749  1
  C  C34  1  0.80349011  0.55016440  0.48972622  1
  C  C35  1  0.69572397  0.44988858  0.99076645  1
  C  C36  1  0.23902718  0.56310339  0.44347361  1
  C  C37  1  0.25858569  0.43524566  0.94305581  1
  C  C38  1  0.75912157  0.43564505  0.55665927  1
  C  C39  1  0.74057498  0.56466623  0.05758057  1
  C  C40  1  0.35095558  0.56604890  0.35780399  1
  C  C41  1  0.14762506  0.43270886  0.85696937  1
  C  C42  1  0.64810585  0.43315397  0.64269155  1
  C  C43  1  0.85252364  0.56748859  0.14315957  1
  C  C44  1  0.41650497  0.45534587  0.34316047  1
  C  C45  1  0.08293729  0.54388610  0.84255316  1
  C  C46  1  0.58336041  0.54426859  0.65717955  1
  C  C47  1  0.91754122  0.45644970  0.15743843  1
  C  C48  1  0.36338417  0.34202199  0.41261144  1
  C  C49  1  0.13579154  0.65717758  0.91205474  1
  C  C50  1  0.63620804  0.65752223  0.58772311  1
  C  C51  1  0.86420882  0.34299985  0.08809368  1
  C  C52  1  0.42442721  0.22274227  0.40315783  1
  C  C53  1  0.07495776  0.77611593  0.90215974  1
  C  C54  1  0.57484021  0.77625941  0.59747960  1
  C  C55  1  0.92542734  0.22413147  0.09785722  1
  C  C56  1  0.43554708  0.00008219  0.45437087  1
  C  C57  1  0.06406760  0.99972242  0.95453943  1
  C  C58  1  0.56318202  0.99981411  0.54548107  1
  C  C59  1  0.93706628  0.00088739  0.04584363  1
  N  N60  1  0.25092087  0.33719279  0.49429112  1
  N  N61  1  0.24982202  0.66267667  0.99360691  1
  N  N62  1  0.75048026  0.66308595  0.50635259  1
  N  N63  1  0.74980435  0.33738402  0.00675331  1
  N  N64  1  0.35842938  0.11460801  0.46096030  1
  N  N65  1  0.14011483  0.88431305  0.96088233  1
  N  N66  1  0.64001170  0.88488543  0.53942652  1
  N  N67  1  0.86045034  0.11591022  0.03928495  1
  N  N68  1  0.02799049  0.91744252  0.57488867  1
  N  N69  1  0.46868734  0.08535824  0.07342125  1
  N  N70  1  0.97500628  0.08506003  0.42800109  1
  N  N71  1  0.53068121  0.91399168  0.92669170  1
  N  N72  1  0.09349305  0.83545946  0.61412996  1
  N  N73  1  0.40943559  0.17027200  0.11411551  1
  N  N74  1  0.91665530  0.17217749  0.39015745  1
  N  N75  1  0.59019338  0.82901696  0.88623012  1
  N  N76  1  0.15222892  0.75110099  0.64726347  1
  N  N77  1  0.34833217  0.25255758  0.14828515  1
  N  N78  1  0.85169907  0.25088393  0.35372014  1
  N  N79  1  0.65183414  0.74710874  0.85204958  1
  N  N80  1  0.97239164  0.19916717  0.64896902  1
  N  N81  1  0.52812948  0.79887758  0.15057909  1
  N  N82  1  0.03083167  0.80077377  0.35062821  1
  N  N83  1  0.46732992  0.20029707  0.84487472  1
  N  N84  1  0.88009701  0.15791025  0.72232646  1
  N  N85  1  0.62352729  0.83965748  0.22297511  1
  N  N86  1  0.12413110  0.84041439  0.27715765  1
  N  N87  1  0.37319887  0.16085151  0.77153470  1
  N  N88  1  0.78082571  0.11572845  0.79175125  1
  N  N89  1  0.72297791  0.88405501  0.29175308  1
  N  N90  1  0.22147634  0.88427657  0.20720815  1
  N  N91  1  0.27451899  0.11298677  0.70315440  1
