# generated using pymatgen
data_Mn2CoH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.96820571
_cell_length_b   10.96442087
_cell_length_c   10.93665839
_cell_angle_alpha   89.11405798
_cell_angle_beta   88.94778355
_cell_angle_gamma   63.34986414
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2CoH8C14(NO)6
_chemical_formula_sum   'Mn4 Co2 H16 C28 N12 O12'
_cell_volume   1175.27751131
_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  0.89014176  0.10515010  0.24490107  1
  Mn  Mn1  1  0.10985651  0.89485294  0.75509697  1
  Co  Co2  1  0.85941959  0.98320356  -0.00760971  1
  Mn  Mn3  1  0.00039079  0.14828685  0.50588645  1
  Co  Co4  1  0.14058239  0.01679414  1.00760900  1
  Mn  Mn5  1  0.99960586  0.85171684  0.49411393  1
  H  H6  1  0.53623183  0.17184640  0.40202978  1
  H  H7  1  0.82522505  0.46113595  0.09062422  1
  H  H8  1  0.46377237  0.82814300  0.59797369  1
  H  H9  1  0.17477836  0.53886450  0.90937295  1
  H  H10  1  0.33664067  0.15704163  0.50461972  1
  H  H11  1  0.83447321  0.66210910  0.98605805  1
  H  H12  1  0.66335942  0.84295516  0.49538194  1
  H  H13  1  0.16553598  0.33788874  0.01393925  1
  H  H14  1  0.42046159  0.07690319  0.05190544  1
  H  H15  1  0.93021265  0.57745894  0.43627175  1
  H  H16  1  0.57954102  0.92309126  0.94809682  1
  H  H17  1  0.06977817  0.42254711  0.56372877  1
  H  H18  1  0.87509739  0.20736361  0.01859845  1
  H  H19  1  0.78351149  0.10398896  0.46616388  1
  H  H20  1  0.12490379  0.79263585  0.98139625  1
  H  H21  1  0.21648774  0.89601367  0.53383409  1
  C  C22  1  0.61820000  0.12123613  0.16456198  1
  C  C23  1  0.88231809  0.38018950  0.32950670  1
  C  C24  1  0.38180188  0.87875845  0.83544095  1
  C  C25  1  0.11767705  0.61981412  0.67049258  1
  C  C26  1  0.49296886  0.12108947  0.22165426  1
  C  C27  1  0.87954175  0.50497748  0.26942363  1
  C  C28  1  0.50703308  0.87890455  0.77834842  1
  C  C29  1  0.12045605  0.49502513  0.73057529  1
  C  C30  1  0.46732861  0.14697386  0.34876758  1
  C  C31  1  0.84995419  0.53100095  0.14281647  1
  C  C32  1  0.53267377  0.85301917  0.65123492  1
  C  C33  1  0.15004815  0.46899984  0.85718149  1
  C  C34  1  0.35742612  0.13889426  0.40714582  1
  C  C35  1  0.85452431  0.64224350  0.08335703  1
  C  C36  1  0.64257377  0.86110239  0.59285612  1
  C  C37  1  0.14548132  0.35775574  0.91664059  1
  C  C38  1  0.27343944  0.10459031  0.33530289  1
  C  C39  1  0.88945439  0.72747722  0.15300281  1
  C  C40  1  0.72655834  0.89541020  0.66469788  1
  C  C41  1  0.11054988  0.27252217  0.84699566  1
  C  C42  1  0.29695292  0.08136206  0.20900856  1
  C  C43  1  0.92055284  0.70026039  0.27766560  1
  C  C44  1  0.70304652  0.91863709  0.79099244  1
  C  C45  1  0.07944663  0.29974136  0.72233406  1
  C  C46  1  0.40530937  0.09230601  0.14994950  1
  C  C47  1  0.91085946  0.59264985  0.33880934  1
  C  C48  1  0.59469258  0.90768964  0.85005220  1
  C  C49  1  0.08913636  0.40735379  0.66119036  1
  N  N50  1  0.16565263  0.07859448  0.36609588  1
  N  N51  1  0.91419451  0.83738401  0.12347936  1
  N  N52  1  0.83434206  0.92141082  0.63390359  1
  N  N53  1  0.08581152  0.16261405  0.87651919  1
  N  N54  1  0.12600498  0.03840532  0.26670850  1
  N  N55  1  0.96490343  0.86948833  0.22163542  1
  N  N56  1  0.87398955  0.96160098  0.73329072  1
  N  N57  1  0.03509981  0.13051139  0.77836417  1
  N  N58  1  0.20082587  0.04204039  0.16961054  1
  N  N59  1  0.96797027  0.78975012  0.31539040  1
  N  N60  1  0.79917137  0.95796258  0.83038920  1
  N  N61  1  0.03202922  0.21025152  0.68460990  1
  O  O62  1  0.92390414  0.11726577  0.05581085  1
  O  O63  1  0.87758867  0.06525800  0.43650930  1
  O  O64  1  0.07609679  0.88273489  0.94418650  1
  O  O65  1  0.12241038  0.93474515  0.56348859  1
  O  O66  1  0.68288652  0.16422652  0.23287940  1
  O  O67  1  0.84165127  0.31082201  0.26522336  1
  O  O68  1  0.31711389  0.83577005  0.76712340  1
  O  O69  1  0.15834431  0.68918145  0.73477548  1
  O  O70  1  0.65187729  0.07680342  0.05586394  1
  O  O71  1  0.92804879  0.35036909  0.43845622  1
  O  O72  1  0.34812586  0.92319049  0.94413929  1
  O  O73  1  0.07194404  0.64963588  0.56154338  1
