# generated using pymatgen
data_V2CrNi2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35621363
_cell_length_b   9.71177402
_cell_length_c   13.64806842
_cell_angle_alpha   103.45549041
_cell_angle_beta   89.99999905
_cell_angle_gamma   90.00012206
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2CrNi2H32C12(NO2)6
_chemical_formula_sum   'V4 Cr2 Ni4 H64 C24 N12 O24'
_cell_volume   1206.09707292
_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  0.09227366  0.86065352  0.73092606  1
  V  V1  1  0.59227487  0.63933833  0.76907301  1
  V  V2  1  0.90773017  0.13934544  0.26907156  1
  V  V3  1  0.40772771  0.36066268  0.23092995  1
  Ni  Ni4  1  0.94145093  0.54965950  0.73133888  1
  Ni  Ni5  1  0.44145709  0.95033468  0.76865858  1
  Ni  Ni6  1  0.05857275  0.45034485  0.26868289  1
  Ni  Ni7  1  0.55855616  0.04966168  0.23132704  1
  Cr  Cr8  1  0.00000044  0.99999805  0.99999681  1
  Cr  Cr9  1  0.50000070  0.50000084  0.50000222  1
  H  H10  1  0.19380887  0.19599931  0.08691571  1
  H  H11  1  0.69381264  0.30400497  0.41308168  1
  H  H12  1  0.80618327  0.80400683  0.91308095  1
  H  H13  1  0.30618838  0.69599153  0.58692243  1
  H  H14  1  0.27787713  0.09989258  0.98366708  1
  H  H15  1  0.77787154  0.40010211  0.51633692  1
  H  H16  1  0.72213228  0.90009228  0.01633848  1
  H  H17  1  0.22213593  0.59991084  0.48366565  1
  H  H18  1  0.58096174  0.38203924  0.86945371  1
  H  H19  1  0.08096600  0.11795436  0.63054794  1
  H  H20  1  0.41903651  0.61796137  0.13054937  1
  H  H21  1  0.91903210  0.88204339  0.36944976  1
  H  H22  1  0.47062321  0.16706803  0.89110064  1
  H  H23  1  -0.02937606  0.33292134  0.60890283  1
  H  H24  1  0.52936516  0.83292457  0.10889398  1
  H  H25  1  1.02936825  0.66709276  0.39110586  1
  H  H26  1  0.76243597  0.03201081  0.85251351  1
  H  H27  1  0.26244573  0.46798527  0.64749081  1
  H  H28  1  0.23754725  0.96798689  0.14749229  1
  H  H29  1  0.73754437  0.53201595  0.35250617  1
  H  H30  1  0.91467498  0.09328266  0.79784630  1
  H  H31  1  0.41468716  0.40670495  0.70214463  1
  H  H32  1  0.08530639  0.90670068  0.20213349  1
  H  H33  1  0.58530360  0.59330097  0.29786612  1
  H  H34  1  0.20825107  0.33436204  0.97058711  1
  H  H35  1  0.70824942  0.16563226  0.52940668  1
  H  H36  1  0.79174989  0.66562966  0.02940897  1
  H  H37  1  0.29175249  0.83437114  0.47059580  1
  H  H38  1  0.16843049  0.18641837  0.87224610  1
  H  H39  1  0.66842913  0.31357618  0.62774779  1
  H  H40  1  0.83157654  0.81358129  0.12774714  1
  H  H41  1  0.33157081  0.68641839  0.37225863  1
  H  H42  1  0.58401115  0.36727772  0.04547079  1
  H  H43  1  0.08401115  0.13271258  0.45453153  1
  H  H44  1  0.41598926  0.63271098  0.95453069  1
  H  H45  1  0.91598779  0.86729367  0.54546583  1
  H  H46  1  0.74073560  0.44098276  0.00779400  1
  H  H47  1  0.24073895  0.05901122  0.49220182  1
  H  H48  1  0.25926044  0.55901038  0.99219789  1
  H  H49  1  0.75925847  0.94099422  0.50779921  1
  H  H50  1  0.80012646  0.26428990  0.10271677  1
  H  H51  1  0.30011769  0.23570931  0.39727802  1
  H  H52  1  0.19988452  0.73570434  0.89727164  1
  H  H53  1  0.69988644  0.76429609  0.60272793  1
  H  H54  1  0.69434692  0.13336401  0.02400852  1
  H  H55  1  0.19434081  0.36663659  0.47599636  1
  H  H56  1  0.30566018  0.86663982  0.97599418  1
  H  H57  1  0.80566178  0.63336112  0.52400152  1
  H  H58  1  0.80838045  0.32056839  0.80049226  1
  H  H59  1  0.30838712  0.17942365  0.69950403  1
  H  H60  1  0.19161075  0.67942298  0.19949823  1
  H  H61  1  0.69161382  0.82057718  0.30049713  1
  H  H62  1  0.68486640  0.18404534  0.74893496  1
  H  H63  1  0.18488013  0.31594678  0.75106546  1
  H  H64  1  0.31510934  0.81594693  0.25106418  1
  H  H65  1  0.81510885  0.68405051  0.24893629  1
  H  H66  1  0.97075857  0.42200162  0.10188676  1
  H  H67  1  0.47078070  0.07803589  0.39813112  1
  H  H68  1  0.02921799  0.57806424  0.89813863  1
  H  H69  1  0.52922090  0.92194114  0.60186222  1
  H  H70  1  0.96649595  0.37515365  0.92755233  1
  H  H71  1  0.46648533  0.12484602  0.57243659  1
  H  H72  1  0.03353263  0.62485277  0.07243346  1
  H  H73  1  0.53353117  0.87514978  0.42756846  1
  C  C74  1  0.82706135  0.12585994  0.85196848  1
  C  C75  1  0.32706776  0.37413193  0.64802636  1
  C  C76  1  0.17293011  0.87412896  0.14801886  1
  C  C77  1  0.67292814  0.62587346  0.35198093  1
  C  C78  1  0.14188278  0.23828394  0.95095486  1
  C  C79  1  0.64187809  0.26170959  0.54904090  1
  C  C80  1  0.85812549  0.76170797  0.04904174  1
  C  C81  1  0.35812559  0.73829221  0.45096130  1
  C  C82  1  0.67676800  0.34251663  0.99464738  1
  C  C83  1  0.17677023  0.15747695  0.50535089  1
  C  C84  1  0.32322918  0.65747674  0.00534776  1
  C  C85  1  0.82322653  0.84252628  0.49465033  1
  C  C86  1  0.76098178  0.22640201  0.02570237  1
  C  C87  1  0.26097625  0.27359658  0.47429473  1
  C  C88  1  0.23902653  0.77359705  0.97428915  1
  C  C89  1  0.73902715  0.72640509  0.52571014  1
  C  C90  1  0.73846363  0.23814254  0.81884198  1
  C  C91  1  0.23846926  0.26184963  0.68115474  1
  C  C92  1  0.26152985  0.76184917  0.18114948  1
  C  C93  1  0.76152974  0.73815099  0.31884896  1
  C  C94  1  0.99129506  0.28160583  0.95891482  1
  C  C95  1  0.49129662  0.21839278  0.54108231  1
  C  C96  1  0.00870125  0.71839990  0.04109070  1
  C  C97  1  0.50870098  0.78159813  0.45890660  1
  N  N98  1  0.88351002  0.17858388  0.95627675  1
  N  N99  1  0.38350638  0.32141280  0.54371635  1
  N  N100  1  0.11649982  0.82141510  0.04370840  1
  N  N101  1  0.61650069  0.67858875  0.45629129  1
  N  N102  1  0.17888851  0.13897548  0.01364382  1
  N  N103  1  0.67888370  0.36102033  0.48635368  1
  N  N104  1  0.82112310  0.86101740  0.98635184  1
  N  N105  1  0.32112670  0.63898421  0.51365163  1
  N  N106  1  0.62924848  0.29798168  0.89150676  1
  N  N107  1  0.12925138  0.20201084  0.60849152  1
  N  N108  1  0.37075078  0.70201232  0.10848752  1
  N  N109  1  0.87075104  0.79798777  0.39151006  1
  O  O110  1  0.05398154  0.91207078  0.86329112  1
  O  O111  1  0.55398985  0.58792431  0.63670755  1
  O  O112  1  0.94601195  0.08793060  0.13670889  1
  O  O113  1  0.44600505  0.41207571  0.36329164  1
  O  O114  1  0.01081926  0.97519737  0.67086558  1
  O  O115  1  0.51081799  0.52479465  0.82913222  1
  O  O116  1  0.98917781  0.02480088  0.32913221  1
  O  O117  1  0.48918126  0.47520151  0.17086793  1
  O  O118  1  0.89080040  0.40165100  0.62067525  1
  O  O119  1  0.39079922  0.09833912  0.87932663  1
  O  O120  1  0.10918178  0.59835347  0.37934314  1
  O  O121  1  0.60918592  0.90165688  0.12066388  1
  O  O122  1  0.03476834  0.68977185  0.67768399  1
  O  O123  1  0.53477209  0.81021978  0.82231402  1
  O  O124  1  0.96524157  0.31022974  0.32231727  1
  O  O125  1  0.46522802  0.18977980  0.17768535  1
  O  O126  1  0.27539692  0.85477987  0.70549270  1
  O  O127  1  0.77539959  0.64521306  0.79450957  1
  O  O128  1  0.72460130  0.14521746  0.29450118  1
  O  O129  1  0.22459180  0.35479215  0.20549770  1
  O  O130  1  0.03540249  0.49551951  0.84102072  1
  O  O131  1  0.53539850  1.00448754  0.65897908  1
  O  O132  1  0.96461013  0.50453585  0.15901983  1
  O  O133  1  0.46461520  -0.00450370  0.34100621  1
