# generated using pymatgen
data_Mn2Co2NiH32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35624990
_cell_length_b   9.71288975
_cell_length_c   13.66729175
_cell_angle_alpha   103.38839631
_cell_angle_beta   90.00003386
_cell_angle_gamma   90.00014541
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2Co2NiH32C12(NO2)6
_chemical_formula_sum   'Mn4 Co4 Ni2 H64 C24 N12 O24'
_cell_volume   1208.27690533
_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  0.09547768  0.85866399  0.73310362  1
  Co  Co1  1  0.59548327  0.64132554  0.76689115  1
  Co  Co2  1  0.90452042  0.14133430  0.26689469  1
  Co  Co3  1  0.40451478  0.35867743  0.23311151  1
  Mn  Mn4  1  0.95019411  0.55858308  0.72739657  1
  Mn  Mn5  1  0.45019283  0.94140694  0.77260512  1
  Mn  Mn6  1  0.04980503  0.44141749  0.27260387  1
  Mn  Mn7  1  0.54980580  0.05859353  0.22739415  1
  Ni  Ni8  1  -0.00000019  1.00000006  0.99999933  1
  Ni  Ni9  1  0.50000041  0.50000017  0.50000098  1
  H  H10  1  0.18456220  0.19574649  0.09213187  1
  H  H11  1  0.68455806  0.30425383  0.40786611  1
  H  H12  1  0.81543880  0.80425426  0.90786851  1
  H  H13  1  0.31544294  0.69574691  0.59213516  1
  H  H14  1  0.27635705  0.09945014  0.99555884  1
  H  H15  1  0.77635690  0.40055042  0.50443684  1
  H  H16  1  0.72364245  0.90055096  0.00444003  1
  H  H17  1  0.22364378  0.59944988  0.49556490  1
  H  H18  1  0.54143535  0.46615631  0.87031770  1
  H  H19  1  0.04142835  0.03382183  0.62966836  1
  H  H20  1  0.45856054  0.53385022  0.12968834  1
  H  H21  1  0.95857051  0.96617679  0.37032948  1
  H  H22  1  0.54338108  0.21922883  0.88773770  1
  H  H23  1  0.04337934  0.28075957  0.61225787  1
  H  H24  1  0.45661781  0.78077120  0.11225957  1
  H  H25  1  0.95662065  0.71924190  0.38774340  1
  H  H26  1  0.77731440  0.03273871  0.85289609  1
  H  H27  1  0.27731207  0.46725537  0.64710661  1
  H  H28  1  0.22268571  0.96726160  0.14710296  1
  H  H29  1  0.72268989  0.53274446  0.35289532  1
  H  H30  1  0.92795287  0.10743511  0.80821149  1
  H  H31  1  0.42794985  0.39255564  0.69179024  1
  H  H32  1  0.07204689  0.89256545  0.19178754  1
  H  H33  1  0.57205125  0.60744196  0.30821126  1
  H  H34  1  0.21604480  0.32856520  0.96707327  1
  H  H35  1  0.71604356  0.17143489  0.53292444  1
  H  H36  1  0.78395567  0.67143322  0.03292510  1
  H  H37  1  0.28395724  0.82856518  0.46707608  1
  H  H38  1  0.15408061  0.18048242  0.87611305  1
  H  H39  1  0.65408123  0.31951882  0.62388430  1
  H  H40  1  0.84591884  0.81951680  0.12388532  1
  H  H41  1  0.34591931  0.68048010  0.37611684  1
  H  H42  1  0.58095711  0.37558760  0.05670637  1
  H  H43  1  0.08093894  0.12438928  0.44327348  1
  H  H44  1  0.41904801  0.62440536  0.94328719  1
  H  H45  1  0.91906287  0.87561499  0.55672887  1
  H  H46  1  0.74188762  0.43084478  0.00251538  1
  H  H47  1  0.24189133  0.06914952  0.49748360  1
  H  H48  1  0.25811068  0.56915477  0.99748465  1
  H  H49  1  0.75810775  0.93085138  0.50251619  1
  H  H50  1  0.79695006  0.25886079  0.10680142  1
  H  H51  1  0.29694663  0.24113790  0.39319942  1
  H  H52  1  0.20305072  0.74113778  0.89319749  1
  H  H53  1  0.70305467  0.75886394  0.60680169  1
  H  H54  1  0.69337260  0.12835808  0.02630789  1
  H  H55  1  0.19336689  0.37163608  0.47369421  1
  H  H56  1  0.30662865  0.87164020  0.97369079  1
  H  H57  1  0.80663454  0.62836592  0.52630734  1
  H  H58  1  0.80373862  0.33000427  0.81433824  1
  H  H59  1  0.30373456  0.16998711  0.68565990  1
  H  H60  1  0.19626054  0.66999615  0.18566035  1
  H  H61  1  0.69626411  0.83001124  0.31434044  1
  H  H62  1  0.69676169  0.18618803  0.75194512  1
  H  H63  1  0.19675666  0.31380255  0.74805245  1
  H  H64  1  0.30323797  0.81381208  0.24805356  1
  H  H65  1  0.80324327  0.68619660  0.25194844  1
  H  H66  1  0.98473972  0.35689384  0.05510168  1
  H  H67  1  0.48473741  0.14310317  0.44489731  1
  H  H68  1  0.01526086  0.64310530  0.94489741  1
  H  H69  1  0.51526316  0.85689527  0.55510259  1
  H  H70  1  0.96961879  0.36477092  0.92491608  1
  H  H71  1  0.46962042  0.13522736  0.57508274  1
  H  H72  1  0.03038190  0.63522888  0.07508293  1
  H  H73  1  0.53038058  0.86477149  0.42491633  1
  C  C74  1  0.83655400  0.13148549  0.85890053  1
  C  C75  1  0.33655120  0.36850791  0.64110025  1
  C  C76  1  0.16344576  0.86851487  0.14109827  1
  C  C77  1  0.66344973  0.63149108  0.35890120  1
  C  C78  1  0.14205919  0.23813661  0.95461374  1
  C  C79  1  0.64205835  0.26186346  0.54538405  1
  C  C80  1  0.85794092  0.76186226  0.04538512  1
  C  C81  1  0.35794222  0.73813623  0.45461675  1
  C  C82  1  0.67350269  0.33765414  0.99815520  1
  C  C83  1  0.17350496  0.16233960  0.50184455  1
  C  C84  1  0.32649615  0.66234504  0.00184439  1
  C  C85  1  0.82649459  0.83766173  0.49815563  1
  C  C86  1  0.76013279  0.22202588  0.02963193  1
  C  C87  1  0.26012751  0.27796820  0.47036876  1
  C  C88  1  0.23986822  0.77797257  0.97036694  1
  C  C89  1  0.73987341  0.72203342  0.52963228  1
  C  C90  1  0.74015368  0.23966860  0.82531636  1
  C  C91  1  0.24014994  0.26032284  0.67468169  1
  C  C92  1  0.25984601  0.76033163  0.17468233  1
  C  C93  1  0.75984993  0.73967644  0.32531908  1
  C  C94  1  0.99169906  0.29532280  0.97657527  1
  C  C95  1  0.49169753  0.20467548  0.52342288  1
  C  C96  1  0.00830158  0.70467663  0.02342332  1
  C  C97  1  0.50830314  0.79532399  0.47657670  1
  N  N98  1  0.88505200  0.17933388  0.96369780  1
  N  N99  1  0.38504884  0.32066321  0.53630280  1
  N  N100  1  0.11494806  0.82066619  0.03630091  1
  N  N101  1  0.61495202  0.67933694  0.46369830  1
  N  N102  1  0.17807936  0.14105887  0.01816726  1
  N  N103  1  0.67807752  0.35894019  0.48182977  1
  N  N104  1  0.82192181  0.85893992  0.98183169  1
  N  N105  1  0.32192339  0.64106023  0.51817168  1
  N  N106  1  0.62367903  0.29391016  0.89505632  1
  N  N107  1  0.12367672  0.20607814  0.60493841  1
  N  N108  1  0.37632016  0.70608993  0.10494161  1
  N  N109  1  0.87632296  0.79392266  0.39506240  1
  O  O110  1  0.05258043  0.91718313  0.85871707  1
  O  O111  1  0.55259438  0.58282037  0.64127513  1
  O  O112  1  0.94741915  0.08281863  0.14128128  1
  O  O113  1  0.44740607  0.41717741  0.35872749  1
  O  O114  1  0.00182856  0.94100982  0.63564118  1
  O  O115  1  0.50183440  0.55896052  0.86433372  1
  O  O116  1  0.99816961  0.05898809  0.36435541  1
  O  O117  1  0.49816193  0.44104862  0.13567535  1
  O  O118  1  0.90574970  0.41884740  0.63733016  1
  O  O119  1  0.40575183  0.08114025  0.86267464  1
  O  O120  1  0.09424943  0.58115131  0.36267187  1
  O  O121  1  0.59424487  0.91886158  0.13732294  1
  O  O122  1  0.05394269  0.66578686  0.67208161  1
  O  O123  1  0.55394196  0.83420108  0.82791610  1
  O  O124  1  0.94605456  0.33421259  0.32791618  1
  O  O125  1  0.44605739  0.16580170  0.17208547  1
  O  O126  1  0.30096750  0.84939511  0.71946696  1
  O  O127  1  0.80097288  0.65059782  0.78053501  1
  O  O128  1  0.69903107  0.15060367  0.28053314  1
  O  O129  1  0.19902551  0.34940225  0.21946585  1
  O  O130  1  0.04298078  0.51151092  0.81805809  1
  O  O131  1  0.54297808  0.98848300  0.68194454  1
  O  O132  1  0.95702178  0.48849354  0.18194248  1
  O  O133  1  0.45702171  0.01151578  0.31805447  1
