# generated using pymatgen
data_Mn2V2CoH32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.36738998
_cell_length_b   9.71591354
_cell_length_c   13.65767603
_cell_angle_alpha   103.38568736
_cell_angle_beta   89.99999497
_cell_angle_gamma   90.00014615
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2V2CoH32C12(NO2)6
_chemical_formula_sum   'Mn4 V4 Co2 H64 C24 N12 O24'
_cell_volume   1209.25439140
_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  0.09730720  0.85664164  0.73416690  1
  Mn  Mn1  1  0.59759934  0.64303968  0.76602965  1
  Mn  Mn2  1  0.90246171  0.14309822  0.26599900  1
  Mn  Mn3  1  0.40271105  0.35665588  0.23417509  1
  V  V4  1  0.95180897  0.56311459  0.71818908  1
  V  V5  1  0.45179811  0.93681270  0.78170075  1
  V  V6  1  0.04820235  0.43683928  0.28171295  1
  V  V7  1  0.54821595  0.06311015  0.21819868  1
  Co  Co8  1  0.00004760  0.99998952  1.00007830  1
  Co  Co9  1  0.50002779  0.50007920  0.50007024  1
  H  H10  1  0.18960842  0.19646616  0.09517561  1
  H  H11  1  0.68945304  0.30368799  0.40479568  1
  H  H12  1  0.81050754  0.80371744  0.90479923  1
  H  H13  1  0.31037100  0.69643047  0.59517026  1
  H  H14  1  0.26959056  0.09553813  0.99397920  1
  H  H15  1  0.76962492  0.40444698  0.50599619  1
  H  H16  1  0.73037723  0.90449021  0.00601988  1
  H  H17  1  0.23041313  0.59549274  0.49396156  1
  H  H18  1  0.52720149  0.46417388  0.86221073  1
  H  H19  1  0.02728680  0.03564620  0.63759402  1
  H  H20  1  0.47271384  0.53565292  0.13757766  1
  H  H21  1  0.97281226  0.96420238  0.36226646  1
  H  H22  1  0.53996698  0.22396029  0.88988939  1
  H  H23  1  0.03996325  0.27609028  0.61014498  1
  H  H24  1  0.46003025  0.77610472  0.11015001  1
  H  H25  1  0.96002976  0.72396845  0.38990062  1
  H  H26  1  0.77496820  0.03459408  0.85274742  1
  H  H27  1  0.27500384  0.46542969  0.64729478  1
  H  H28  1  0.22500149  0.96543630  0.14729268  1
  H  H29  1  0.72503880  0.53459771  0.35274800  1
  H  H30  1  0.92441435  0.11107424  0.80856263  1
  H  H31  1  0.42443954  0.38889601  0.69147288  1
  H  H32  1  0.07556287  0.88890271  0.19147116  1
  H  H33  1  0.57559126  0.61108067  0.30856512  1
  H  H34  1  0.21477304  0.32596234  0.96597886  1
  H  H35  1  0.71479021  0.17405215  0.53398245  1
  H  H36  1  0.78519578  0.67405495  0.03397901  1
  H  H37  1  0.28521712  0.82595079  0.46598711  1
  H  H38  1  0.14781532  0.17573927  0.87906898  1
  H  H39  1  0.64785801  0.32424769  0.62093273  1
  H  H40  1  0.85212581  0.82424789  0.12093169  1
  H  H41  1  0.35217379  0.67573606  0.37906870  1
  H  H42  1  0.58590918  0.37978748  0.06026465  1
  H  H43  1  0.08594775  0.12028767  0.43976516  1
  H  H44  1  0.41405622  0.62029719  0.93976941  1
  H  H45  1  0.91408740  0.87978814  0.56028103  1
  H  H46  1  0.74322924  0.43340838  0.00226983  1
  H  H47  1  0.24323989  0.06664043  0.49780939  1
  H  H48  1  0.25674430  0.56665171  0.99782240  1
  H  H49  1  0.75676300  0.93341078  0.50227943  1
  H  H50  1  0.79407985  0.26351603  0.10687742  1
  H  H51  1  0.29410787  0.23644960  0.39317005  1
  H  H52  1  0.20588180  0.73646040  0.89316565  1
  H  H53  1  0.70590738  0.76348584  0.60688269  1
  H  H54  1  0.69036051  0.13201443  0.02674430  1
  H  H55  1  0.19038988  0.36803265  0.47326070  1
  H  H56  1  0.30960929  0.86804038  0.97325705  1
  H  H57  1  0.80964470  0.63201283  0.52674538  1
  H  H58  1  0.79922920  0.32958909  0.81112374  1
  H  H59  1  0.29921336  0.17039922  0.68888572  1
  H  H60  1  0.20077934  0.67040639  0.18888589  1
  H  H61  1  0.70076920  0.82959711  0.31113339  1
  H  H62  1  0.68966208  0.18498137  0.75296409  1
  H  H63  1  0.18969451  0.31502945  0.74707302  1
  H  H64  1  0.31029628  0.81503413  0.24707562  1
  H  H65  1  0.81034071  0.68499529  0.25297087  1
  H  H66  1  0.98188570  0.36157670  0.05603931  1
  H  H67  1  0.48189100  0.13844833  0.44397649  1
  H  H68  1  0.01809765  0.63846723  0.94397621  1
  H  H69  1  0.51810686  0.86156377  0.55604664  1
  H  H70  1  0.96913210  0.36498910  0.92390787  1
  H  H71  1  0.46916935  0.13502428  0.57611217  1
  H  H72  1  0.03082475  0.63503630  0.07610866  1
  H  H73  1  0.53085924  0.86497725  0.42391409  1
  C  C74  1  0.83302774  0.13413972  0.85904204  1
  C  C75  1  0.33304541  0.36586739  0.64099625  1
  C  C76  1  0.16695872  0.86587519  0.14099658  1
  C  C77  1  0.66697735  0.63414253  0.35904212  1
  C  C78  1  0.13855138  0.23781356  0.95669995  1
  C  C79  1  0.63857212  0.26220566  0.54329053  1
  C  C80  1  0.86141140  0.76221088  0.04328881  1
  C  C81  1  0.36143792  0.73780105  0.45670242  1
  C  C82  1  0.67301374  0.34172650  0.99847389  1
  C  C83  1  0.17307046  0.15833835  0.50158418  1
  C  C84  1  0.32690029  0.65835200  0.00159985  1
  C  C85  1  0.82697685  0.84172717  0.49848354  1
  C  C86  1  0.75788676  0.22511734  0.02958483  1
  C  C87  1  0.25791806  0.27493795  0.47045929  1
  C  C88  1  0.24207901  0.77494723  0.97045402  1
  C  C89  1  0.74211110  0.72511275  0.52959170  1
  C  C90  1  0.73531557  0.24109032  0.82528375  1
  C  C91  1  0.23530013  0.25892136  0.67474875  1
  C  C92  1  0.26469936  0.75892602  0.17475018  1
  C  C93  1  0.76468746  0.74110035  0.32529119  1
  C  C94  1  0.98948965  0.29767977  0.97751232  1
  C  C95  1  0.48950816  0.20233582  0.52250732  1
  C  C96  1  0.01048083  0.70234855  0.02250517  1
  C  C97  1  0.51050042  0.79766885  0.47751851  1
  N  N98  1  0.88259347  0.18138808  0.96407387  1
  N  N99  1  0.38261396  0.31863651  0.53596232  1
  N  N100  1  0.11737987  0.81865527  0.03596246  1
  N  N101  1  0.61740328  0.68137631  0.46407363  1
  N  N102  1  0.17456350  0.14187943  0.02154237  1
  N  N103  1  0.67455316  0.35818443  0.47846825  1
  N  N104  1  0.82542804  0.85820248  0.97847472  1
  N  N105  1  0.32542682  0.64185317  0.52153602  1
  N  N106  1  0.62073095  0.29841258  0.89601581  1
  N  N107  1  0.12073609  0.20162039  0.60402227  1
  N  N108  1  0.37925933  0.70162281  0.10402672  1
  N  N109  1  0.87926424  0.79842069  0.39602696  1
  O  O110  1  0.05632210  0.95697885  0.86999744  1
  O  O111  1  0.55640951  0.54310891  0.63010363  1
  O  O112  1  0.94362504  0.04301063  0.13012227  1
  O  O113  1  0.44372476  0.45701057  0.36998065  1
  O  O114  1  -0.02083648  0.94921378  0.64860542  1
  O  O115  1  0.47896190  0.55045810  0.85105750  1
  O  O116  1  1.02101696  0.05052696  0.35114692  1
  O  O117  1  0.52082435  0.44921262  0.14859090  1
  O  O118  1  0.90522247  0.41461406  0.63155054  1
  O  O119  1  0.40536656  0.08528222  0.86843151  1
  O  O120  1  0.09463490  0.58532136  0.36842760  1
  O  O121  1  0.59474813  0.91460204  0.13154643  1
  O  O122  1  0.06293400  0.67086520  0.65860819  1
  O  O123  1  0.56272916  0.82878248  0.84125693  1
  O  O124  1  0.93729071  0.32882371  0.34128441  1
  O  O125  1  0.43708896  0.17087640  0.15863003  1
  O  O126  1  0.29761226  0.82926169  0.73617311  1
  O  O127  1  0.79781654  0.67109680  0.76357836  1
  O  O128  1  0.70222956  0.17106750  0.26356321  1
  O  O129  1  0.20239163  0.32930205  0.23617426  1
  O  O130  1  0.03795150  0.52174149  0.81700838  1
  O  O131  1  0.53805658  0.97830672  0.68296824  1
  O  O132  1  0.96191559  0.47830949  0.18298489  1
  O  O133  1  0.46207542  0.02174440  0.31702129  1
