# generated using pymatgen
data_Mn2CoH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.96520344
_cell_length_b   10.95722176
_cell_length_c   10.93212975
_cell_angle_alpha   89.15249694
_cell_angle_beta   88.91901004
_cell_angle_gamma   63.37405561
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2CoH8C14(NO)6
_chemical_formula_sum   'Mn4 Co2 H16 C28 N12 O12'
_cell_volume   1173.94463351
_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  0.89534068  0.10952858  0.25520541  1
  Mn  Mn1  1  0.10465806  0.89047461  0.74479284  1
  Mn  Mn2  1  0.85182879  0.99967875  -0.00573378  1
  Co  Co3  1  0.01643515  0.14071924  0.50763571  1
  Mn  Mn4  1  0.14817211  0.00032099  1.00573349  1
  Co  Co5  1  0.98356009  0.85928485  0.49236404  1
  H  H6  1  0.53919310  0.17306805  0.41129224  1
  H  H7  1  0.82761762  0.46367701  0.09830982  1
  H  H8  1  0.46081059  0.82692257  0.58871158  1
  H  H9  1  0.17238591  0.53632318  0.90168777  1
  H  H10  1  0.33799959  0.16286684  0.51527777  1
  H  H11  1  0.84148283  0.66365916  0.99579296  1
  H  H12  1  0.66199974  0.83713029  0.48472396  1
  H  H13  1  0.15852615  0.33633808  0.00420416  1
  H  H14  1  0.42213794  0.07384866  0.06314439  1
  H  H15  1  0.92574533  0.57904750  0.44748440  1
  H  H16  1  0.57786589  0.92614519  0.93685788  1
  H  H17  1  0.07424596  0.42095849  0.55251574  1
  H  H18  1  0.89501321  0.21722346  0.03468528  1
  H  H19  1  0.79274447  0.12475975  0.48169776  1
  H  H20  1  0.10498685  0.78277731  0.96531128  1
  H  H21  1  0.20725204  0.87524447  0.51830005  1
  C  C22  1  0.61980195  0.11894593  0.17153284  1
  C  C23  1  0.87952252  0.38170122  0.33553884  1
  C  C24  1  0.38020007  0.88104773  0.82846932  1
  C  C25  1  0.12047354  0.61830241  0.66445994  1
  C  C26  1  0.49470675  0.12180437  0.23131430  1
  C  C27  1  0.87985546  0.50668370  0.27828038  1
  C  C28  1  0.50529583  0.87818930  0.76868867  1
  C  C29  1  0.12014276  0.49331910  0.72171824  1
  C  C30  1  0.46897344  0.14955614  0.35846928  1
  C  C31  1  0.85297234  0.53254952  0.15138676  1
  C  C32  1  0.53102903  0.85043721  0.64153376  1
  C  C33  1  0.14703025  0.46745105  0.84861113  1
  C  C34  1  0.35773384  0.14433917  0.41760559  1
  C  C35  1  0.86043950  0.64276290  0.09306896  1
  C  C36  1  0.64226648  0.85565759  0.58239599  1
  C  C37  1  0.13956635  0.35723584  0.90692895  1
  C  C38  1  0.27217733  0.11091890  0.34697185  1
  C  C39  1  0.89519888  0.72683424  0.16464080  1
  C  C40  1  0.72782124  0.88908142  0.65302894  1
  C  C41  1  0.10480566  0.27316480  0.83535743  1
  C  C42  1  0.29842495  0.08280105  0.22145872  1
  C  C43  1  0.92008576  0.70268490  0.29056498  1
  C  C44  1  0.70157504  0.91719729  0.77854230  1
  C  C45  1  0.07991338  0.29731716  0.70943422  1
  C  C46  1  0.40662249  0.09228777  0.16088998  1
  C  C47  1  0.90959185  0.59418946  0.34960557  1
  C  C48  1  0.59337992  0.90770700  0.83911214  1
  C  C49  1  0.09040368  0.40581438  0.65039400  1
  N  N50  1  0.16292132  0.08497717  0.37620867  1
  N  N51  1  0.92021752  0.83526329  0.13387346  1
  N  N52  1  0.83707326  0.91502890  0.62379070  1
  N  N53  1  0.07979073  0.16473377  0.86612501  1
  N  N54  1  0.13019099  0.03626441  0.27702657  1
  N  N55  1  0.96211314  0.87417489  0.23272849  1
  N  N56  1  0.86980439  0.96374091  0.72297279  1
  N  N57  1  0.03789003  0.12582458  0.76727165  1
  N  N58  1  0.20832653  0.03670562  0.18280183  1
  N  N59  1  0.95978237  0.79875352  0.32971173  1
  N  N60  1  0.79167047  0.96329688  0.81719840  1
  N  N61  1  0.04021634  0.20124850  0.67028830  1
  O  O62  1  0.93406115  0.12297716  0.06362128  1
  O  O63  1  0.88302035  0.07593631  0.44436158  1
  O  O64  1  0.06593890  0.87702415  0.93637631  1
  O  O65  1  0.11697673  0.92406720  0.55563774  1
  O  O66  1  0.68986536  0.15778622  0.23681029  1
  O  O67  1  0.83585013  0.31699138  0.26787342  1
  O  O68  1  0.31013472  0.84221143  0.76319053  1
  O  O69  1  0.16414673  0.68301214  0.73212465  1
  O  O70  1  0.64909964  0.07480597  0.06174687  1
  O  O71  1  0.92468338  0.34803902  0.44386706  1
  O  O72  1  0.35090364  0.92518533  0.93825619  1
  O  O73  1  0.07531030  0.65196543  0.55613225  1
