# generated using pymatgen
data_VCo2Ni2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35304533
_cell_length_b   9.70987289
_cell_length_c   13.64681669
_cell_angle_alpha   103.61551527
_cell_angle_beta   89.99994939
_cell_angle_gamma   90.00009694
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCo2Ni2H32C12(NO2)6
_chemical_formula_sum   'V2 Co4 Ni4 H64 C24 N12 O24'
_cell_volume   1204.53191928
_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  0.10351306  0.83712015  0.74070323  1
  Ni  Ni1  1  0.60349333  0.66286441  0.75926936  1
  Ni  Ni2  1  0.89647715  0.16287659  0.25929452  1
  Ni  Ni3  1  0.39650855  0.33714077  0.24072513  1
  Co  Co4  1  0.94633531  0.55804880  0.73164340  1
  Co  Co5  1  0.44634787  0.94194331  0.76836212  1
  Co  Co6  1  0.05366412  0.44195215  0.26836100  1
  Co  Co7  1  0.55365350  0.05805783  0.23163921  1
  V  V8  1  0.00001562  1.00000804  0.99999437  1
  V  V9  1  0.50001165  0.50000178  0.50001669  1
  H  H10  1  0.18695793  0.20587885  0.09309742  1
  H  H11  1  0.68693480  0.29413697  0.40690697  1
  H  H12  1  0.81306054  0.79411474  0.90688989  1
  H  H13  1  0.31305573  0.70588355  0.59310485  1
  H  H14  1  0.27647059  0.10510100  0.99522677  1
  H  H15  1  0.77647250  0.39489261  0.50476137  1
  H  H16  1  0.72353643  0.89488247  0.00475551  1
  H  H17  1  0.22355231  0.60510491  0.49524032  1
  H  H18  1  0.55101690  0.44698945  0.86054688  1
  H  H19  1  0.05104411  0.05301419  0.63945885  1
  H  H20  1  0.44899445  0.55300436  0.13944652  1
  H  H21  1  0.94894675  0.94697600  0.36053441  1
  H  H22  1  0.53154422  0.21319108  0.88566023  1
  H  H23  1  0.03156231  0.28681255  0.61435046  1
  H  H24  1  0.46845131  0.78680729  0.11434271  1
  H  H25  1  0.96843962  0.71318863  0.38565274  1
  H  H26  1  0.76662384  0.02807474  0.85425581  1
  H  H27  1  0.26663279  0.47193290  0.64574503  1
  H  H28  1  0.23336909  0.97192680  0.14574275  1
  H  H29  1  0.73336684  0.52806915  0.35425490  1
  H  H30  1  0.91813646  0.09792377  0.80502322  1
  H  H31  1  0.41814669  0.40207251  0.69498842  1
  H  H32  1  0.08186291  0.90206393  0.19498772  1
  H  H33  1  0.58185175  0.59791869  0.30501463  1
  H  H34  1  0.21140878  0.32997437  0.96337795  1
  H  H35  1  0.71141928  0.17003667  0.53662635  1
  H  H36  1  0.78858405  0.67002254  0.03661790  1
  H  H37  1  0.28858221  0.82996032  0.46337258  1
  H  H38  1  0.15195515  0.17739302  0.87449583  1
  H  H39  1  0.65196670  0.32261242  0.62550595  1
  H  H40  1  0.84803801  0.82260025  0.12550701  1
  H  H41  1  0.34803874  0.67737803  0.37449033  1
  H  H42  1  0.55082518  0.41882001  0.10348236  1
  H  H43  1  0.05081827  0.08113758  0.39651536  1
  H  H44  1  0.44918119  0.58115708  0.89650434  1
  H  H45  1  0.94917634  0.91885447  0.60348172  1
  H  H46  1  0.72210887  0.43995769  0.00299900  1
  H  H47  1  0.22206429  0.06002267  0.49697725  1
  H  H48  1  0.27790531  0.56003076  0.99699648  1
  H  H49  1  0.77792529  0.93997234  0.50302004  1
  H  H50  1  0.79328696  0.27494332  0.10467404  1
  H  H51  1  0.29329006  0.22509942  0.39532880  1
  H  H52  1  0.20671274  0.72507202  0.89532715  1
  H  H53  1  0.70671276  0.77491205  0.60466945  1
  H  H54  1  0.68964284  0.13433521  0.03280270  1
  H  H55  1  0.18966876  0.36570235  0.46721531  1
  H  H56  1  0.31034966  0.86567910  0.96720103  1
  H  H57  1  0.81033601  0.63430256  0.53278830  1
  H  H58  1  0.79244941  0.31915223  0.80524395  1
  H  H59  1  0.29245543  0.18086497  0.69476149  1
  H  H60  1  0.20755052  0.68085781  0.19475954  1
  H  H61  1  0.70754482  0.81913590  0.30524091  1
  H  H62  1  0.68234348  0.17252787  0.74854874  1
  H  H63  1  0.18235014  0.32748402  0.75146382  1
  H  H64  1  0.31765274  0.82747989  0.25145755  1
  H  H65  1  0.81765459  0.67251810  0.24854008  1
  H  H66  1  0.97985449  0.36015274  0.05236559  1
  H  H67  1  0.47985662  0.13985014  0.44763967  1
  H  H68  1  0.02014556  0.63984674  0.94763295  1
  H  H69  1  0.52014206  0.86014754  0.55235861  1
  H  H70  1  0.96276227  0.36094435  0.92024729  1
  H  H71  1  0.46277121  0.13906955  0.57975730  1
  H  H72  1  0.03723217  0.63905905  0.07975276  1
  H  H73  1  0.53722988  0.86093079  0.42024234  1
  C  C74  1  0.82792503  0.12527693  0.85640401  1
  C  C75  1  0.32793904  0.37473703  0.64360564  1
  C  C76  1  0.17207117  0.87472845  0.14360025  1
  C  C77  1  0.67206543  0.62526237  0.35639901  1
  C  C78  1  0.13839893  0.23880644  0.95233106  1
  C  C79  1  0.63840523  0.26119830  0.54766996  1
  C  C80  1  0.86160539  0.76117456  0.04765746  1
  C  C81  1  0.36160071  0.73880663  0.45233517  1
  C  C82  1  0.67444380  0.33330081  0.98879660  1
  C  C83  1  0.17444322  0.16669158  0.51119800  1
  C  C84  1  0.32555990  0.66669425  0.01120418  1
  C  C85  1  0.82555793  0.83330606  0.48879990  1
  C  C86  1  0.75432253  0.22727097  0.02864758  1
  C  C87  1  0.25432775  0.27274699  0.47136050  1
  C  C88  1  0.24567420  0.77273217  0.97135434  1
  C  C89  1  0.74567087  0.72725929  0.52864227  1
  C  C90  1  0.73103899  0.22926811  0.81964172  1
  C  C91  1  0.23105333  0.27074669  0.68036541  1
  C  C92  1  0.26895566  0.77073724  0.18036132  1
  C  C93  1  0.76894721  0.72925742  0.31963638  1
  C  C94  1  0.98707927  0.29454605  0.97354994  1
  C  C95  1  0.48708862  0.20546297  0.52645543  1
  C  C96  1  0.01291863  0.70545588  0.02645168  1
  C  C97  1  0.51291429  0.79453725  0.47354442  1
  N  N98  1  0.88083826  0.17648158  0.96198815  1
  N  N99  1  0.38084133  0.32351616  0.53801955  1
  N  N100  1  0.11916246  0.82351906  0.03801581  1
  N  N101  1  0.61916054  0.67648179  0.46197904  1
  N  N102  1  0.17765017  0.14583218  0.01923555  1
  N  N103  1  0.67765702  0.35418270  0.48077287  1
  N  N104  1  0.82231220  0.85421457  0.98080577  1
  N  N105  1  0.32232423  0.64579259  0.51920395  1
  N  N106  1  0.61693265  0.28628510  0.89280885  1
  N  N107  1  0.11693917  0.21372643  0.60718818  1
  N  N108  1  0.38306621  0.71371602  0.10718942  1
  N  N109  1  0.88306031  0.78627636  0.39281056  1
  O  O110  1  0.04734026  0.93642581  0.87300452  1
  O  O111  1  0.54738827  0.56363148  0.62705635  1
  O  O112  1  0.95265095  0.06359473  0.12699253  1
  O  O113  1  0.45260814  0.43637932  0.37293757  1
  O  O114  1  0.00693495  0.97109635  0.66112329  1
  O  O115  1  0.50689295  0.52892844  0.83888157  1
  O  O116  1  0.99304715  0.02888575  0.33886378  1
  O  O117  1  0.49312105  0.47104711  0.16111276  1
  O  O118  1  0.89947544  0.40874650  0.65018326  1
  O  O119  1  0.39946237  0.09124472  0.84981505  1
  O  O120  1  0.10052332  0.59125620  0.34982043  1
  O  O121  1  0.60053830  0.90875971  0.15018801  1
  O  O122  1  0.05148437  0.65281275  0.66772556  1
  O  O123  1  0.55148910  0.84718200  0.83227207  1
  O  O124  1  0.94853232  0.34718229  0.33227447  1
  O  O125  1  0.44850300  0.15282076  0.16773222  1
  O  O126  1  0.30379162  0.83608892  0.71793686  1
  O  O127  1  0.80377070  0.66387301  0.78205841  1
  O  O128  1  0.69620524  0.16391211  0.28205767  1
  O  O129  1  0.19623617  0.33612802  0.21793734  1
  O  O130  1  0.03582559  0.52466438  0.82893928  1
  O  O131  1  0.53582216  0.97533652  0.67106585  1
  O  O132  1  0.96417734  0.47533983  0.17106509  1
  O  O133  1  0.46417791  0.02466956  0.32893819  1
