# generated using pymatgen
data_Mn2CoNi2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35024827
_cell_length_b   9.70937299
_cell_length_c   13.64693008
_cell_angle_alpha   103.47898121
_cell_angle_beta   90.00001819
_cell_angle_gamma   90.00013349
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2CoNi2H32C12(NO2)6
_chemical_formula_sum   'Mn4 Co2 Ni4 H64 C24 N12 O24'
_cell_volume   1204.81128950
_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
  Ni  Ni0  1  0.09432907  0.85558120  0.73589599  1
  Ni  Ni1  1  0.59433108  0.64441003  0.76410478  1
  Ni  Ni2  1  0.90567555  0.14442224  0.26409802  1
  Ni  Ni3  1  0.40567160  0.35558596  0.23590014  1
  Mn  Mn4  1  0.94779459  0.55798986  0.72494991  1
  Mn  Mn5  1  0.44779306  0.94200583  0.77505050  1
  Mn  Mn6  1  0.05221090  0.44201656  0.27505310  1
  Mn  Mn7  1  0.55221041  0.05798800  0.22494208  1
  Co  Co8  1  -0.00001771  1.00000899  0.99999296  1
  Co  Co9  1  0.49991203  0.49994177  0.50002131  1
  H  H10  1  0.18145654  0.19546366  0.09587999  1
  H  H11  1  0.68145987  0.30453148  0.40411352  1
  H  H12  1  0.81854348  0.80453948  0.90412152  1
  H  H13  1  0.31855603  0.69546059  0.59587721  1
  H  H14  1  0.27035439  0.09422091  0.99856003  1
  H  H15  1  0.77034919  0.40578524  0.50143579  1
  H  H16  1  0.72964567  0.90577785  0.00144249  1
  H  H17  1  0.22964062  0.59423152  0.49856241  1
  H  H18  1  0.53196546  0.46708391  0.87636932  1
  H  H19  1  0.03196923  0.03290956  0.62363251  1
  H  H20  1  0.46803456  0.53291716  0.12363959  1
  H  H21  1  0.96802452  0.96709198  0.37636402  1
  H  H22  1  0.54013308  0.22297373  0.89385632  1
  H  H23  1  0.04013459  0.27702008  0.60614929  1
  H  H24  1  0.45986401  0.77702555  0.10614892  1
  H  H25  1  0.95986434  0.72297976  0.39384967  1
  H  H26  1  0.77163526  0.03516237  0.85192958  1
  H  H27  1  0.27163252  0.46483458  0.64807847  1
  H  H28  1  0.22835816  0.96483941  0.14806719  1
  H  H29  1  0.72836124  0.53516018  0.35193222  1
  H  H30  1  0.92174516  0.10940560  0.80652014  1
  H  H31  1  0.42174649  0.39058921  0.69348387  1
  H  H32  1  0.07824700  0.89059747  0.19347516  1
  H  H33  1  0.57824945  0.60939796  0.30652185  1
  H  H34  1  0.21731728  0.32321686  0.96642259  1
  H  H35  1  0.71731933  0.17678151  0.53357774  1
  H  H36  1  0.78268350  0.67678071  0.03356987  1
  H  H37  1  0.28268683  0.82321757  0.46643721  1
  H  H38  1  0.15122342  0.17312774  0.87789808  1
  H  H39  1  0.65123255  0.32687921  0.62209935  1
  H  H40  1  0.84877681  0.82686254  0.12210104  1
  H  H41  1  0.34877428  0.67314321  0.37789875  1
  H  H42  1  0.57656095  0.39106693  0.07381734  1
  H  H43  1  0.07656049  0.10893736  0.42618821  1
  H  H44  1  0.42343153  0.60893724  0.92619665  1
  H  H45  1  0.92343172  0.89105942  0.57380214  1
  H  H46  1  0.74279745  0.43565847  0.00611943  1
  H  H47  1  0.24279849  0.06434416  0.49387975  1
  H  H48  1  0.25720380  0.56433985  0.99388629  1
  H  H49  1  0.75720365  0.93566150  0.50611439  1
  H  H50  1  0.79786707  0.26305453  0.10792862  1
  H  H51  1  0.29786389  0.23695560  0.39207398  1
  H  H52  1  0.20213813  0.73693817  0.89207056  1
  H  H53  1  0.70213713  0.76306040  0.60792685  1
  H  H54  1  0.69019239  0.13265099  0.02919966  1
  H  H55  1  0.19018621  0.36735146  0.47080661  1
  H  H56  1  0.30980754  0.86734615  0.97080139  1
  H  H57  1  0.80980383  0.63265277  0.52919588  1
  H  H58  1  0.79773088  0.33417160  0.81588693  1
  H  H59  1  0.29773487  0.16582366  0.68411618  1
  H  H60  1  0.20226077  0.66583428  0.18411617  1
  H  H61  1  0.70225843  0.83416644  0.31588398  1
  H  H62  1  0.68781494  0.19145714  0.75392924  1
  H  H63  1  0.18781912  0.30854127  0.74607454  1
  H  H64  1  0.31217622  0.80855111  0.24607314  1
  H  H65  1  0.81217773  0.69145555  0.25392555  1
  H  H66  1  0.98403099  0.35866096  0.05471721  1
  H  H67  1  0.48402769  0.14134507  0.44528392  1
  H  H68  1  0.01596972  0.64133315  0.94527865  1
  H  H69  1  0.51597148  0.85866779  0.55471501  1
  H  H70  1  0.97025037  0.36349680  0.92344271  1
  H  H71  1  0.47025235  0.13650405  0.57655697  1
  H  H72  1  0.02974975  0.63650153  0.07655547  1
  H  H73  1  0.52974829  0.86349685  0.42343921  1
  C  C74  1  0.83141533  0.13389064  0.85832512  1
  C  C75  1  0.33141546  0.36610724  0.64167905  1
  C  C76  1  0.16857935  0.86611069  0.14167264  1
  C  C77  1  0.66858160  0.63388788  0.35832535  1
  C  C78  1  0.14048619  0.23518461  0.95561774  1
  C  C79  1  0.64049100  0.26481591  0.54438158  1
  C  C80  1  0.85951727  0.76481068  0.04437952  1
  C  C81  1  0.35951968  0.73518666  0.45562092  1
  C  C82  1  0.67631247  0.34062148  0.99960043  1
  C  C83  1  0.17631251  0.15937944  0.50040159  1
  C  C84  1  0.32368831  0.65937649  0.00040249  1
  C  C85  1  0.82368581  0.84062312  0.49959634  1
  C  C86  1  0.75946808  0.22434523  0.03101766  1
  C  C87  1  0.25946259  0.27565711  0.46898590  1
  C  C88  1  0.24053225  0.77565140  0.96898338  1
  C  C89  1  0.74052695  0.72434591  0.53101363  1
  C  C90  1  0.73452411  0.24339084  0.82667556  1
  C  C91  1  0.23452731  0.25660370  0.67332760  1
  C  C92  1  0.26546885  0.75661367  0.17332653  1
  C  C93  1  0.76546835  0.74338777  0.32667232  1
  C  C94  1  0.99081547  0.29538701  0.97632195  1
  C  C95  1  0.49081774  0.20461346  0.52367757  1
  C  C96  1  0.00918566  0.70461100  0.02367798  1
  C  C97  1  0.50918911  0.79538591  0.47631798  1
  N  N98  1  0.88327180  0.17915525  0.96345230  1
  N  N99  1  0.38327255  0.32084756  0.53655186  1
  N  N100  1  0.11672790  0.82084018  0.03654551  1
  N  N101  1  0.61672932  0.67915921  0.46345051  1
  N  N102  1  0.17309265  0.13953335  0.02184923  1
  N  N103  1  0.67309322  0.36046084  0.47814515  1
  N  N104  1  0.82690847  0.86046885  0.97815210  1
  N  N105  1  0.32691248  0.63952636  0.52184840  1
  N  N106  1  0.62047958  0.29781001  0.89938087  1
  N  N107  1  0.12048147  0.20218463  0.60062120  1
  N  N108  1  0.37951759  0.70218907  0.10062347  1
  N  N109  1  0.87951683  0.79781486  0.39937590  1
  O  O110  1  0.04674628  0.94256566  0.87399133  1
  O  O111  1  0.54677511  0.55746046  0.62599895  1
  O  O112  1  0.95328053  0.05742820  0.12600847  1
  O  O113  1  0.45329697  0.44259366  0.37398543  1
  O  O114  1  -0.01284186  0.94818623  0.63952700  1
  O  O115  1  0.48715530  0.55180508  0.86047179  1
  O  O116  1  1.01283974  0.05181735  0.36047345  1
  O  O117  1  0.51285266  0.44819804  0.13953540  1
  O  O118  1  0.90127407  0.41721572  0.63609312  1
  O  O119  1  0.40127456  0.08277556  0.86391023  1
  O  O120  1  0.09873415  0.58278514  0.36391352  1
  O  O121  1  0.59873181  0.91722012  0.13608157  1
  O  O122  1  0.05446662  0.66081753  0.66910754  1
  O  O123  1  0.55446346  0.83917355  0.83088994  1
  O  O124  1  0.94553912  0.33918374  0.33089021  1
  O  O125  1  0.44554372  0.16082580  0.16910517  1
  O  O126  1  0.30169457  0.84284527  0.72481944  1
  O  O127  1  0.80169598  0.65715159  0.77517751  1
  O  O128  1  0.69831079  0.15714029  0.27517748  1
  O  O129  1  0.19830874  0.34285624  0.22482252  1
  O  O130  1  0.03573500  0.51227072  0.81832361  1
  O  O131  1  0.53573443  0.98773124  0.68167946  1
  O  O132  1  0.96427089  0.48774211  0.18168136  1
  O  O133  1  0.46426298  0.01225966  0.31831030  1
