# generated using pymatgen
data_MnCo2H8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.90360605
_cell_length_b   10.89810031
_cell_length_c   10.87180302
_cell_angle_alpha   89.23011671
_cell_angle_beta   89.02715211
_cell_angle_gamma   63.64204861
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCo2H8C14(NO)6
_chemical_formula_sum   'Mn2 Co4 H16 C28 N12 O12'
_cell_volume   1157.38234958
_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  0.89395944  0.10641490  0.25026971  1
  Mn  Mn1  1  0.10603890  0.89358844  0.74972803  1
  Co  Co2  1  0.85930283  0.98346239  -0.00503134  1
  Co  Co3  1  0.01651014  0.14075391  0.50519429  1
  Co  Co4  1  0.14069939  0.01653555  1.00503062  1
  Co  Co5  1  0.98348581  0.85925139  0.49480515  1
  H  H6  1  0.53755769  0.16766763  0.41155542  1
  H  H7  1  0.83117501  0.46285385  0.08950241  1
  H  H8  1  0.46244554  0.83232170  0.58844900  1
  H  H9  1  0.16882891  0.53714693  0.91049439  1
  H  H10  1  0.33327692  0.15668448  0.51068103  1
  H  H11  1  0.84153795  0.66704022  0.99003721  1
  H  H12  1  0.66672108  0.84331340  0.48932078  1
  H  H13  1  0.15847046  0.33295936  0.00996070  1
  H  H14  1  0.42404102  0.07466530  0.05629558  1
  H  H15  1  0.92863879  0.57601205  0.44309933  1
  H  H16  1  0.57595870  0.92533202  0.94370666  1
  H  H17  1  0.07135212  0.42399353  0.55690092  1
  H  H18  1  0.87419280  0.21052106  0.02495881  1
  H  H19  1  0.78962531  0.12567972  0.47572236  1
  H  H20  1  0.12580767  0.78947858  0.97503679  1
  H  H21  1  0.21037211  0.87432405  0.52427528  1
  C  C22  1  0.62076618  0.11940188  0.17163205  1
  C  C23  1  0.88130332  0.37966027  0.32896010  1
  C  C24  1  0.37923578  0.88059103  0.82837153  1
  C  C25  1  0.11869240  0.62034396  0.67103892  1
  C  C26  1  0.49472918  0.11924204  0.22834183  1
  C  C27  1  0.88151454  0.50546778  0.27201598  1
  C  C28  1  0.50527294  0.88075083  0.77166183  1
  C  C29  1  0.11848302  0.49453561  0.72798273  1
  C  C30  1  0.46768183  0.14478158  0.35626518  1
  C  C31  1  0.85476937  0.53264775  0.14443221  1
  C  C32  1  0.53232015  0.85521041  0.64373842  1
  C  C33  1  0.14523303  0.46735351  0.85556566  1
  C  C34  1  0.35468593  0.13922134  0.41256571  1
  C  C35  1  0.85992260  0.64563822  0.08791632  1
  C  C36  1  0.64531328  0.86077497  0.58743652  1
  C  C37  1  0.14008246  0.35436192  0.91208187  1
  C  C38  1  0.26862346  0.10882834  0.33818234  1
  C  C39  1  0.89122152  0.73170041  0.16171691  1
  C  C40  1  0.73137439  0.89117100  0.66181865  1
  C  C41  1  0.10878386  0.26829871  0.83828221  1
  C  C42  1  0.29490207  0.08390736  0.21160092  1
  C  C43  1  0.91774192  0.70494075  0.28785373  1
  C  C44  1  0.70509770  0.91609050  0.78840045  1
  C  C45  1  0.08225792  0.29506161  0.71214627  1
  C  C46  1  0.40684125  0.09141464  0.15464807  1
  C  C47  1  0.91061121  0.59312731  0.34504831  1
  C  C48  1  0.59316016  0.90858057  0.84535433  1
  C  C49  1  0.08938426  0.40687681  0.65495147  1
  N  N50  1  0.15653694  0.08629654  0.36524785  1
  N  N51  1  0.91336107  0.84397015  0.13463811  1
  N  N52  1  0.84345685  0.91370911  0.63475051  1
  N  N53  1  0.08665046  0.15602502  0.86535928  1
  N  N54  1  0.12315506  0.03968214  0.26498075  1
  N  N55  1  0.96159962  0.87674928  0.23418670  1
  N  N56  1  0.87683880  0.96032458  0.73501678  1
  N  N57  1  0.03840628  0.12324968  0.76581223  1
  N  N58  1  0.19853320  0.04583605  0.16887788  1
  N  N59  1  0.95659884  0.80095144  0.33020178  1
  N  N60  1  0.80146439  0.95416643  0.83112130  1
  N  N61  1  0.04340310  0.19904985  0.66979753  1
  O  O62  1  0.92503979  0.11742946  0.05614520  1
  O  O63  1  0.88278205  0.07492409  0.44424143  1
  O  O64  1  0.07496108  0.88257111  0.94385237  1
  O  O65  1  0.11721586  0.92508027  0.55575716  1
  O  O66  1  0.68830797  0.15770532  0.24243164  1
  O  O67  1  0.84191363  0.31235403  0.25880323  1
  O  O68  1  0.31169177  0.84229205  0.75757009  1
  O  O69  1  0.15808251  0.68764992  0.74119509  1
  O  O70  1  0.65174160  0.07985668  0.06055031  1
  O  O71  1  0.92173498  0.34863381  0.43955726  1
  O  O72  1  0.34826145  0.92013322  0.93945407  1
  O  O73  1  0.07825895  0.65137100  0.56044226  1
