# generated using pymatgen
data_V2Cr3H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35461997
_cell_length_b   9.70747695
_cell_length_c   13.67141684
_cell_angle_alpha   103.32235091
_cell_angle_beta   90.00001217
_cell_angle_gamma   90.00012955
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2Cr3H32C12(NO2)6
_chemical_formula_sum   'V4 Cr6 H64 C24 N12 O24'
_cell_volume   1208.08816685
_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
  V  V0  1  0.10428891  0.86456673  0.73171104  1
  V  V1  1  0.60429321  0.63542476  0.76828821  1
  V  V2  1  0.89570913  0.13543266  0.26828824  1
  V  V3  1  0.39570570  0.36457792  0.23171410  1
  Cr  Cr4  1  0.95900162  0.55053739  0.71837110  1
  Cr  Cr5  1  0.45900022  0.94945297  0.78163139  1
  Cr  Cr6  1  0.04099652  0.44946438  0.28163046  1
  Cr  Cr7  1  0.54099698  0.05054594  0.21836727  1
  Cr  Cr8  1  -0.00000002  0.99999989  0.99999955  1
  Cr  Cr9  1  0.50000049  0.49999989  0.50000102  1
  H  H10  1  0.19341582  0.18893051  0.08786735  1
  H  H11  1  0.69341172  0.31106725  0.41213019  1
  H  H12  1  0.80658534  0.81106928  0.91213162  1
  H  H13  1  0.30658963  0.68893383  0.58787176  1
  H  H14  1  0.27792646  0.09528455  0.98632215  1
  H  H15  1  0.77792535  0.40471358  0.51367372  1
  H  H16  1  0.72207353  0.90471454  0.01367658  1
  H  H17  1  0.22207509  0.59528704  0.48632856  1
  H  H18  1  0.57794868  0.37568930  0.86626498  1
  H  H19  1  0.07795205  0.12430160  0.63373595  1
  H  H20  1  0.42205080  0.62431201  0.13373577  1
  H  H21  1  0.92204653  0.87569885  0.36626265  1
  H  H22  1  0.54719182  0.20721830  0.88399133  1
  H  H23  1  0.04719109  0.29277174  0.61601093  1
  H  H24  1  0.45280694  0.79278218  0.11600769  1
  H  H25  1  0.95280913  0.70722992  0.38398925  1
  H  H26  1  0.77741167  0.03220376  0.84757169  1
  H  H27  1  0.27741104  0.46779231  0.65243111  1
  H  H28  1  0.22258767  0.96779721  0.15242661  1
  H  H29  1  0.72258988  0.53220622  0.34757153  1
  H  H30  1  0.93127448  0.10809312  0.80592218  1
  H  H31  1  0.43127496  0.39190418  0.69407975  1
  H  H32  1  0.06872448  0.89190789  0.19407577  1
  H  H33  1  0.56872535  0.60809272  0.30592212  1
  H  H34  1  0.21708580  0.32774474  0.96619281  1
  H  H35  1  0.71708514  0.17225388  0.53380441  1
  H  H36  1  0.78291521  0.67225422  0.03380524  1
  H  H37  1  0.28291634  0.82774607  0.46619694  1
  H  H38  1  0.15050362  0.18283246  0.87410059  1
  H  H39  1  0.65050702  0.31716601  0.62589798  1
  H  H40  1  0.84949692  0.81716605  0.12589813  1
  H  H41  1  0.34949372  0.68283331  0.37410355  1
  H  H42  1  0.57752006  0.36268274  0.04282351  1
  H  H43  1  0.07752173  0.13731030  0.45717852  1
  H  H44  1  0.42248032  0.63731684  0.95717671  1
  H  H45  1  0.92247886  0.86269235  0.54282031  1
  H  H46  1  0.73638207  0.43216110  0.00105290  1
  H  H47  1  0.23638530  0.06783455  0.49894863  1
  H  H48  1  0.26361802  0.56783824  0.99894668  1
  H  H49  1  0.76361413  0.93216660  0.50105045  1
  H  H50  1  0.79061192  0.25776855  0.10405216  1
  H  H51  1  0.29061012  0.24223078  0.39594952  1
  H  H52  1  0.20938907  0.74223017  0.89594653  1
  H  H53  1  0.70939247  0.75777104  0.60405144  1
  H  H54  1  0.68897657  0.12603738  0.02113942  1
  H  H55  1  0.18897363  0.37395842  0.47886403  1
  H  H56  1  0.31102474  0.87396160  0.97885939  1
  H  H57  1  0.81102952  0.62604393  0.52113677  1
  H  H58  1  0.80926294  0.33515925  0.81624240  1
  H  H59  1  0.30926532  0.16483723  0.68376020  1
  H  H60  1  0.19073593  0.66484247  0.18375764  1
  H  H61  1  0.69073361  0.83515833  0.31623709  1
  H  H62  1  0.70577649  0.19298012  0.74488987  1
  H  H63  1  0.20577771  0.30701527  0.75511166  1
  H  H64  1  0.29422230  0.80702219  0.25510943  1
  H  H65  1  0.79422260  0.69297916  0.24488865  1
  H  H66  1  0.98371829  0.35139438  0.05617088  1
  H  H67  1  0.48371595  0.14860387  0.44383028  1
  H  H68  1  0.01628268  0.64860532  0.94382746  1
  H  H69  1  0.51628533  0.85139671  0.55617063  1
  H  H70  1  0.96517283  0.36761418  0.92880325  1
  H  H71  1  0.46517363  0.13238556  0.57119862  1
  H  H72  1  0.03482803  0.63238538  0.07119505  1
  H  H73  1  0.53482702  0.86761332  0.42880176  1
  C  C74  1  0.83790411  0.13105096  0.85506148  1
  C  C75  1  0.33790441  0.36894579  0.64494058  1
  C  C76  1  0.16209521  0.86895001  0.14493699  1
  C  C77  1  0.66209612  0.63105234  0.35506108  1
  C  C78  1  0.14153925  0.23871937  0.95324403  1
  C  C79  1  0.64153925  0.26127954  0.54675464  1
  C  C80  1  0.85846130  0.76127994  0.04675452  1
  C  C81  1  0.35846171  0.73872008  0.45324688  1
  C  C82  1  0.67216086  0.33597846  0.99510388  1
  C  C83  1  0.17216286  0.16401612  0.50489794  1
  C  C84  1  0.32783904  0.66402096  0.00489574  1
  C  C85  1  0.82783727  0.83598547  0.49510150  1
  C  C86  1  0.75632515  0.21981900  0.02606651  1
  C  C87  1  0.25632440  0.28017823  0.47393562  1
  C  C88  1  0.24367547  0.78018028  0.97393225  1
  C  C89  1  0.74367748  0.71982337  0.52606519  1
  C  C90  1  0.74758322  0.24028390  0.81994661  1
  C  C91  1  0.24758466  0.25971141  0.68005521  1
  C  C92  1  0.25241580  0.75971743  0.18005286  1
  C  C93  1  0.75241516  0.74028561  0.31994449  1
  C  C94  1  0.99099757  0.29436197  0.97701153  1
  C  C95  1  0.49099725  0.20563701  0.52298940  1
  C  C96  1  0.00900305  0.70563767  0.02298684  1
  C  C97  1  0.50900398  0.79436278  0.47701156  1
  N  N98  1  0.88430476  0.17651457  0.96172019  1
  N  N99  1  0.38430453  0.32348438  0.53828173  1
  N  N100  1  0.11569557  0.82348542  0.03827831  1
  N  N101  1  0.61569673  0.67651568  0.46171996  1
  N  N102  1  0.18033764  0.13635014  0.01404167  1
  N  N103  1  0.68033578  0.36364803  0.48595596  1
  N  N104  1  0.81966269  0.86365004  0.98595758  1
  N  N105  1  0.31966491  0.63635192  0.51404582  1
  N  N106  1  0.62469120  0.28825683  0.88877252  1
  N  N107  1  0.12469300  0.21173578  0.61122938  1
  N  N108  1  0.37530791  0.71174363  0.11122721  1
  N  N109  1  0.87530657  0.78826504  0.38876999  1
  O  O110  1  0.04951662  0.91085899  0.85664006  1
  O  O111  1  0.54952374  0.58913731  0.64335847  1
  O  O112  1  0.95048245  0.08914126  0.14335941  1
  O  O113  1  0.45047621  0.41086268  0.35664375  1
  O  O114  1  0.03942226  0.98263028  0.66997004  1
  O  O115  1  0.53942382  0.51735822  0.83002598  1
  O  O116  1  0.96057928  0.01737136  0.33003009  1
  O  O117  1  0.46057689  0.48264479  0.16997745  1
  O  O118  1  0.92316251  0.41982345  0.61731893  1
  O  O119  1  0.42316603  0.08016335  0.88268682  1
  O  O120  1  0.07683582  0.58017583  0.38268379  1
  O  O121  1  0.57682953  0.91983953  0.11730937  1
  O  O122  1  0.04108451  0.69627734  0.66882973  1
  O  O123  1  0.54108575  0.80371181  0.83117011  1
  O  O124  1  0.95890789  0.30372471  0.33116884  1
  O  O125  1  0.45891190  0.19629059  0.16883201  1
  O  O126  1  0.29365467  0.85616645  0.72093654  1
  O  O127  1  0.79365845  0.64382681  0.77906682  1
  O  O128  1  0.70634372  0.14382782  0.27906328  1
  O  O129  1  0.20634040  0.35617617  0.22093543  1
  O  O130  1  0.06345237  0.51364479  0.80625744  1
  O  O131  1  0.56344688  0.98635014  0.69374436  1
  O  O132  1  0.93654993  0.48636241  0.19374444  1
  O  O133  1  0.43655148  0.01364453  0.30625347  1
