# generated using pymatgen
data_MnCoH14(C7N8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11687212
_cell_length_b   10.13485779
_cell_length_c   12.55519220
_cell_angle_alpha   90.02427405
_cell_angle_beta   90.00639261
_cell_angle_gamma   106.44044456
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCoH14(C7N8)2
_chemical_formula_sum   'Mn2 Co2 H28 C28 N32'
_cell_volume   990.60405922
_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  0.15403198  0.12582002  0.55576425  1
  Mn  Mn1  1  0.34148797  0.86615500  0.05588077  1
  Co  Co2  1  0.84580301  0.87359308  0.44380460  1
  Mn  Mn3  1  0.65841388  0.13365617  0.94453304  1
  H  H4  1  0.11268380  0.44909976  0.58012678  1
  H  H5  1  0.38399440  0.54903332  0.08069425  1
  H  H6  1  0.88544976  0.54989726  0.41893723  1
  H  H7  1  0.61419948  0.45001447  0.92034217  1
  H  H8  1  0.18568030  0.64831367  0.46132936  1
  H  H9  1  0.31098097  0.34942163  0.95979522  1
  H  H10  1  0.81256517  0.35099715  0.53800879  1
  H  H11  1  0.68754560  0.65014676  0.04103072  1
  H  H12  1  0.38781076  0.65342290  0.30483751  1
  H  H13  1  0.11069137  0.34564259  0.80363220  1
  H  H14  1  0.61208615  0.34691118  0.69521605  1
  H  H15  1  0.88982256  0.65492058  0.19626747  1
  H  H16  1  0.50151163  0.44893869  0.27902602  1
  H  H17  1  0.99856823  0.55055932  0.77768636  1
  H  H18  1  0.49935175  0.55186511  0.72118252  1
  H  H19  1  0.00268743  0.45039981  0.22204070  1
  H  H20  1  0.52671225  0.23157736  0.34664472  1
  H  H21  1  0.97459922  0.76897359  0.84459996  1
  H  H22  1  0.47375803  0.76896096  0.65311175  1
  H  H23  1  0.02623317  0.23177543  0.15551822  1
  H  H24  1  0.49841061  0.00362261  0.37688393  1
  H  H25  1  1.00130044  0.99672015  0.87781983  1
  H  H26  1  0.50220506  0.99700576  0.62221393  1
  H  H27  1  -0.00054909  0.00379207  0.12284342  1
  H  H28  1  0.33122034  0.90175020  0.45901266  1
  H  H29  1  0.17031676  0.09665801  0.95905554  1
  H  H30  1  0.66961217  0.09835264  0.53997659  1
  H  H31  1  0.83060649  0.90362175  0.04162392  1
  C  C32  1  0.19336810  0.44766597  0.51085212  1
  C  C33  1  0.30477099  0.55001076  0.01066218  1
  C  C34  1  0.80539913  0.55173663  0.48844801  1
  C  C35  1  0.69421714  0.44962435  0.99009158  1
  C  C36  1  0.23778142  0.56259990  0.44416754  1
  C  C37  1  0.25986924  0.43575661  0.94337109  1
  C  C38  1  0.76110767  0.43700910  0.55534278  1
  C  C39  1  0.73933922  0.56409585  0.05718363  1
  C  C40  1  0.34936538  0.56535463  0.35841366  1
  C  C41  1  0.14920014  0.43372575  0.85715329  1
  C  C42  1  0.65037339  0.43479076  0.64146557  1
  C  C43  1  0.85094948  0.56661182  0.14297896  1
  C  C44  1  0.41385065  0.45415894  0.34358549  1
  C  C45  1  0.08573148  0.54549438  0.84250310  1
  C  C46  1  0.58639778  0.54624082  0.65637399  1
  C  C47  1  0.91484341  0.45503412  0.15751057  1
  C  C48  1  0.36050357  0.34065876  0.41315586  1
  C  C49  1  0.13904083  0.65856094  0.91226363  1
  C  C50  1  0.63941916  0.65944200  0.58651265  1
  C  C51  1  0.86118428  0.34171670  0.08801374  1
  C  C52  1  0.42254479  0.22146421  0.40415462  1
  C  C53  1  0.07725504  0.77726690  0.90312991  1
  C  C54  1  0.57764916  0.77877358  0.59546069  1
  C  C55  1  0.92326990  0.22313380  0.09713296  1
  C  C56  1  0.43455782  -0.00181459  0.45475019  1
  C  C57  1  0.06568036  1.00088373  0.95541223  1
  C  C58  1  0.56599676  1.00208717  0.54435612  1
  C  C59  1  0.93509343  -0.00051344  0.04523047  1
  N  N60  1  0.24782887  0.33584103  0.49453741  1
  N  N61  1  0.25286086  0.66351106  0.99391986  1
  N  N62  1  0.75153400  0.66383262  0.50486476  1
  N  N63  1  0.74675642  0.33638087  0.00665154  1
  N  N64  1  0.35600003  0.11203445  0.46030003  1
  N  N65  1  0.14214667  0.88567600  0.96153080  1
  N  N66  1  0.64405065  0.88791681  0.53895815  1
  N  N67  1  0.85831689  0.11451537  0.03898473  1
  N  N68  1  0.02134436  0.91977670  0.57316225  1
  N  N69  1  0.46757797  0.08478590  0.07397855  1
  N  N70  1  0.97851501  0.08010221  0.42660185  1
  N  N71  1  0.53246628  0.91470807  0.92708530  1
  N  N72  1  0.08581547  0.83555967  0.60981844  1
  N  N73  1  0.40711381  0.16911706  0.11455076  1
  N  N74  1  0.91380942  0.16418013  0.38996401  1
  N  N75  1  0.59255744  0.83038216  0.88611281  1
  N  N76  1  0.15137879  0.75564543  0.64379650  1
  N  N77  1  0.34543165  0.25091195  0.14899308  1
  N  N78  1  0.84814196  0.24394064  0.35581881  1
  N  N79  1  0.65451254  0.74896073  0.85134119  1
  N  N80  1  0.96963995  0.19599561  0.64759196  1
  N  N81  1  0.53242896  0.80212925  0.15648348  1
  N  N82  1  0.03093575  0.80361451  0.35267415  1
  N  N83  1  0.46681170  0.19698520  0.84405700  1
  N  N84  1  0.88125077  0.15602435  0.72279303  1
  N  N85  1  0.62610219  0.84147594  0.23005468  1
  N  N86  1  0.11904005  0.84359466  0.27728970  1
  N  N87  1  0.37431365  0.15816730  0.76987992  1
  N  N88  1  0.78762319  0.12018470  0.79586069  1
  N  N89  1  0.72456176  0.88554294  0.29928680  1
  N  N90  1  0.21281616  0.87983391  0.20441593  1
  N  N91  1  0.27777239  0.11549987  0.69953751  1
