# generated using pymatgen
data_MnVCoH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.87984958
_cell_length_b   10.88014952
_cell_length_c   10.89942556
_cell_angle_alpha   89.23592894
_cell_angle_beta   89.01080839
_cell_angle_gamma   63.71104028
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnVCoH8C14(NO)6
_chemical_formula_sum   'Mn2 V2 Co2 H16 C28 N12 O12'
_cell_volume   1156.57276116
_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  0.91753838  0.07813490  0.24925059  1
  Co  Co1  1  0.08247882  0.92186006  0.75075040  1
  V  V2  1  0.85367407  0.99020357  0.00087820  1
  Mn  Mn3  1  -0.00072029  0.14939635  0.50397193  1
  V  V4  1  0.14632599  0.00979642  0.99912003  1
  Mn  Mn5  1  1.00071662  0.85060884  0.49603040  1
  H  H6  1  0.53680488  0.16857734  0.40845479  1
  H  H7  1  0.82706129  0.46003560  0.08445532  1
  H  H8  1  0.46319680  0.83141188  0.59154946  1
  H  H9  1  0.17294313  0.53996518  0.91554183  1
  H  H10  1  0.33277771  0.15473284  0.50477488  1
  H  H11  1  0.83738950  0.66311874  0.98292057  1
  H  H12  1  0.66721878  0.84526376  0.49522562  1
  H  H13  1  0.16261972  0.33688012  0.01707728  1
  H  H14  1  0.42497329  0.07945625  0.05155807  1
  H  H15  1  0.92926878  0.57443703  0.43445055  1
  H  H16  1  0.57502740  0.92053776  0.94844408  1
  H  H17  1  0.07072192  0.42556938  0.56555031  1
  H  H18  1  0.87543738  0.21451425  0.04814566  1
  H  H19  1  0.77896214  0.11274153  0.44213693  1
  H  H20  1  0.12456280  0.78548530  0.95185426  1
  H  H21  1  0.22103808  0.88726202  0.55785269  1
  C  C22  1  0.62532450  0.11882253  0.17170495  1
  C  C23  1  0.88500837  0.37327509  0.32133070  1
  C  C24  1  0.37467892  0.88116878  0.82829731  1
  C  C25  1  0.11498819  0.62672965  0.67866838  1
  C  C26  1  0.49785673  0.11892167  0.22488297  1
  C  C27  1  0.88155060  0.50139730  0.26478872  1
  C  C28  1  0.50214541  0.88107117  0.77511993  1
  C  C29  1  0.11844809  0.49860607  0.73521007  1
  C  C30  1  0.46877882  0.14379378  0.35233586  1
  C  C31  1  0.85243069  0.52931213  0.13825784  1
  C  C32  1  0.53122283  0.85619853  0.64766677  1
  C  C33  1  0.14757258  0.47068858  0.86174042  1
  C  C34  1  0.35558575  0.13673624  0.40720277  1
  C  C35  1  0.85622812  0.64295104  0.08067721  1
  C  C36  1  0.64441271  0.86325975  0.59279791  1
  C  C37  1  0.14377760  0.35704871  0.91932049  1
  C  C38  1  0.27072669  0.10415190  0.33235385  1
  C  C39  1  0.88845037  0.72957668  0.15281145  1
  C  C40  1  0.72926979  0.89584774  0.66764727  1
  C  C41  1  0.11155373  0.27042348  0.84718835  1
  C  C42  1  0.29665666  0.08290984  0.20580019  1
  C  C43  1  0.91822306  0.70247165  0.27785869  1
  C  C44  1  0.70334178  0.91708707  0.79420110  1
  C  C45  1  0.08177546  0.29753150  0.72214123  1
  C  C46  1  0.40859960  0.09240093  0.15003059  1
  C  C47  1  0.91086778  0.59066677  0.33660851  1
  C  C48  1  0.59140084  0.90759309  0.84997170  1
  C  C49  1  0.08912802  0.40933787  0.66339220  1
  N  N50  1  0.15752654  0.08413774  0.36011352  1
  N  N51  1  0.90250631  0.84706626  0.12666808  1
  N  N52  1  0.84246325  0.91587215  0.63988536  1
  N  N53  1  0.09749895  0.15293316  0.87333148  1
  N  N54  1  0.11482167  0.04901491  0.25926600  1
  N  N55  1  0.94738636  0.88546859  0.22971306  1
  N  N56  1  0.88516503  0.95100020  0.74073088  1
  N  N57  1  0.05261938  0.11452972  0.77028595  1
  N  N58  1  0.19570437  0.05047508  0.16219180  1
  N  N59  1  0.95535561  0.79939628  0.32009117  1
  N  N60  1  0.80428997  0.94952960  0.83780689  1
  N  N61  1  0.04464186  0.20060715  0.67991017  1
  O  O62  1  0.93028516  0.11510014  0.05183032  1
  O  O63  1  0.87851396  0.06421201  0.43709507  1
  O  O64  1  0.06971614  0.88489951  0.94816620  1
  O  O65  1  0.12148679  0.93579011  0.56290500  1
  O  O66  1  0.70107117  0.14577646  0.24238556  1
  O  O67  1  0.85887674  0.29538978  0.25151512  1
  O  O68  1  0.29893724  0.85420843  0.75761675  1
  O  O69  1  0.14111879  0.70461590  0.74848359  1
  O  O70  1  0.65299781  0.08818189  0.05677100  1
  O  O71  1  0.91744583  0.35053881  0.43465377  1
  O  O72  1  0.34700262  0.91181332  0.94323036  1
  O  O73  1  0.08254812  0.64946690  0.56534606  1
