# generated using pymatgen
data_MnCrCoH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.96189940
_cell_length_b   10.93995175
_cell_length_c   10.91822360
_cell_angle_alpha   88.93376010
_cell_angle_beta   88.87734416
_cell_angle_gamma   63.35903583
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCrCoH8C14(NO)6
_chemical_formula_sum   'Mn2 Cr2 Co2 H16 C28 N12 O12'
_cell_volume   1170.03917668
_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  0.89391979  0.10027493  0.23629871  1
  Mn  Mn1  1  0.10607967  0.89972804  0.76369916  1
  Co  Co2  1  0.86094867  0.97684754  -0.00342960  1
  Cr  Cr3  1  0.00683579  0.14126267  0.50908911  1
  Co  Co4  1  0.13905228  0.02315115  1.00343004  1
  Cr  Cr5  1  0.99315968  0.85874135  0.49091089  1
  H  H6  1  0.53158935  0.17246792  0.40514194  1
  H  H7  1  0.82906258  0.45278628  0.09590400  1
  H  H8  1  0.46841401  0.82752355  0.59485989  1
  H  H9  1  0.17094050  0.54721389  0.90409440  1
  H  H10  1  0.33064239  0.15753299  0.50579608  1
  H  H11  1  0.83722604  0.65504744  0.99165229  1
  H  H12  1  0.66935852  0.84246373  0.49420529  1
  H  H13  1  0.16278284  0.34495038  0.00834595  1
  H  H14  1  0.42095163  0.07611466  0.05313473  1
  H  H15  1  0.92203545  0.57425478  0.44507636  1
  H  H16  1  0.57904899  0.92388086  0.94686734  1
  H  H17  1  0.07795716  0.42575099  0.55492487  1
  H  H18  1  0.86759011  0.20948108  0.00961818  1
  H  H19  1  0.79270083  0.10204014  0.46120249  1
  H  H20  1  0.13240924  0.79051891  0.99037887  1
  H  H21  1  0.20729447  0.89796349  0.53879174  1
  C  C22  1  0.61918032  0.11612254  0.16883326  1
  C  C23  1  0.88077124  0.37160918  0.33277132  1
  C  C24  1  0.38082192  0.88387346  0.83116894  1
  C  C25  1  0.11922489  0.62839428  0.66722750  1
  C  C26  1  0.49198094  0.11892949  0.22435340  1
  C  C27  1  0.87943211  0.49749006  0.27606547  1
  C  C28  1  0.50802032  0.88106551  0.77564838  1
  C  C29  1  0.12056640  0.50251244  0.72393505  1
  C  C30  1  0.46385977  0.14647065  0.35122422  1
  C  C31  1  0.85233296  0.52331007  0.14862065  1
  C  C32  1  0.53614209  0.85352330  0.64877752  1
  C  C33  1  0.14766976  0.47669036  0.85137878  1
  C  C34  1  0.35288052  0.13856101  0.40838880  1
  C  C35  1  0.85652092  0.63497557  0.08920259  1
  C  C36  1  0.64711965  0.86143533  0.59161298  1
  C  C37  1  0.14348483  0.36502338  0.91079471  1
  C  C38  1  0.27052981  0.10308865  0.33560453  1
  C  C39  1  0.88796514  0.72196087  0.15989474  1
  C  C40  1  0.72946842  0.89691086  0.66439685  1
  C  C41  1  0.11204003  0.27803849  0.84010462  1
  C  C42  1  0.29530255  0.08002343  0.20937243  1
  C  C43  1  0.91173976  0.69842109  0.28620869  1
  C  C44  1  0.70469566  0.91997531  0.79062902  1
  C  C45  1  0.08826045  0.30158088  0.71379128  1
  C  C46  1  0.40448941  0.09111381  0.15137840  1
  C  C47  1  0.90575551  0.58809195  0.34695870  1
  C  C48  1  0.59551092  0.90888238  0.84862332  1
  C  C49  1  0.09424045  0.41191177  0.65304006  1
  N  N50  1  0.16348687  0.07426510  0.36489119  1
  N  N51  1  0.91229048  0.83252105  0.12978348  1
  N  N52  1  0.83650887  0.92573860  0.63510869  1
  N  N53  1  0.08771678  0.16747668  0.87021532  1
  N  N54  1  0.12585333  0.03296326  0.26468147  1
  N  N55  1  0.95842940  0.86727228  0.22847625  1
  N  N56  1  0.87414293  0.96704031  0.73531860  1
  N  N57  1  0.04157456  0.13272739  0.77152307  1
  N  N58  1  0.20033620  0.03948028  0.16861665  1
  N  N59  1  0.94823378  0.79559529  0.32555091  1
  N  N60  1  0.79966152  0.96052203  0.83138252  1
  N  N61  1  0.05176627  0.20440644  0.67444787  1
  O  O62  1  0.92071674  0.12024176  0.04767072  1
  O  O63  1  0.88689653  0.05988590  0.43125048  1
  O  O64  1  0.07928270  0.87975953  0.95232644  1
  O  O65  1  0.11310075  0.94011709  0.56874833  1
  O  O66  1  0.68715321  0.15351488  0.23904338  1
  O  O67  1  0.83811338  0.30579659  0.26639704  1
  O  O68  1  0.31284687  0.84648298  0.76095623  1
  O  O69  1  0.16188331  0.69420720  0.73360268  1
  O  O70  1  0.65232698  0.07374990  0.05933782  1
  O  O71  1  0.92585452  0.33644050  0.44250669  1
  O  O72  1  0.34767637  0.92624231  0.94066441  1
  O  O73  1  0.07414144  0.66356256  0.55749514  1
