# generated using pymatgen
data_Mn2VCr2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.37701170
_cell_length_b   9.73453158
_cell_length_c   13.68768877
_cell_angle_alpha   103.42217816
_cell_angle_beta   90.00003690
_cell_angle_gamma   90.00014884
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2VCr2H32C12(NO2)6
_chemical_formula_sum   'Mn4 V2 Cr4 H64 C24 N12 O24'
_cell_volume   1215.29678186
_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  0.09367657  0.85685112  0.72739251  1
  Mn  Mn1  1  0.59367952  0.64313924  0.77260359  1
  Mn  Mn2  1  0.90632261  0.14314982  0.27260558  1
  Mn  Mn3  1  0.40632150  0.35686423  0.22740060  1
  Cr  Cr4  1  0.95344188  0.55561709  0.71943861  1
  Cr  Cr5  1  0.45344172  0.94437079  0.78056310  1
  Cr  Cr6  1  0.04655829  0.44438576  0.28056238  1
  Cr  Cr7  1  0.54655595  0.05562798  0.21943428  1
  V  V8  1  0.00000109  0.99999924  0.99999947  1
  V  V9  1  0.50000122  0.50000149  0.50000110  1
  H  H10  1  0.18508784  0.19867467  0.09113532  1
  H  H11  1  0.68507875  0.30132104  0.40886190  1
  H  H12  1  0.81491662  0.80132354  0.90886504  1
  H  H13  1  0.31492436  0.69868175  0.59114002  1
  H  H14  1  0.27599017  0.10241535  0.99364731  1
  H  H15  1  0.77598737  0.39758205  0.50634497  1
  H  H16  1  0.72401357  0.89758419  0.00635276  1
  H  H17  1  0.22401533  0.60241882  0.49365761  1
  H  H18  1  0.52220722  0.45836130  0.87913361  1
  H  H19  1  0.02221696  0.04162280  0.62084724  1
  H  H20  1  0.47779416  0.54164316  0.12087693  1
  H  H21  1  0.97778292  0.95838033  0.37915435  1
  H  H22  1  0.54315163  0.22396675  0.89185784  1
  H  H23  1  0.04315285  0.27601406  0.60812115  1
  H  H24  1  0.45684487  0.77603234  0.10813629  1
  H  H25  1  0.95684773  0.72398522  0.39187715  1
  H  H26  1  0.77567512  0.03595814  0.84896813  1
  H  H27  1  0.27566319  0.46403647  0.65102934  1
  H  H28  1  0.22432159  0.96404370  0.15102991  1
  H  H29  1  0.72433812  0.53596160  0.34897152  1
  H  H30  1  0.92479509  0.11524951  0.80518208  1
  H  H31  1  0.42478000  0.38474414  0.69482010  1
  H  H32  1  0.07520227  0.88475076  0.19481462  1
  H  H33  1  0.57522057  0.61525413  0.30518034  1
  H  H34  1  0.21702032  0.33176618  0.96667739  1
  H  H35  1  0.71701784  0.16823272  0.53332085  1
  H  H36  1  0.78297999  0.66822957  0.03332098  1
  H  H37  1  0.28298278  0.83176790  0.46668019  1
  H  H38  1  0.15446375  0.18524228  0.87467221  1
  H  H39  1  0.65446378  0.31475646  0.62532619  1
  H  H40  1  0.84553616  0.81474982  0.12532772  1
  H  H41  1  0.34553576  0.68524445  0.37467477  1
  H  H42  1  0.58684819  0.39508965  0.06297829  1
  H  H43  1  0.08684671  0.10493667  0.43704429  1
  H  H44  1  0.41314746  0.60491544  0.93703018  1
  H  H45  1  0.91315476  0.89506719  0.56295716  1
  H  H46  1  0.75073814  0.43197590  -0.00124623  1
  H  H47  1  0.25077306  0.06801835  0.50124997  1
  H  H48  1  0.24925321  0.56802262  1.00124666  1
  H  H49  1  0.74922965  0.93198198  0.49874986  1
  H  H50  1  0.79690764  0.26162219  0.10580632  1
  H  H51  1  0.29691333  0.23837812  0.39419196  1
  H  H52  1  0.20309094  0.73837545  0.89419101  1
  H  H53  1  0.70308843  0.76162347  0.60580789  1
  H  H54  1  0.69131550  0.13258164  0.02475572  1
  H  H55  1  0.19130302  0.36740088  0.47524160  1
  H  H56  1  0.30868575  0.86741378  0.97524073  1
  H  H57  1  0.80869748  0.63259843  0.52475875  1
  H  H58  1  0.80034997  0.33625179  0.81639878  1
  H  H59  1  0.30034134  0.16374045  0.68359839  1
  H  H60  1  0.19964827  0.66375016  0.18359878  1
  H  H61  1  0.69965630  0.83625627  0.31640045  1
  H  H62  1  0.69304466  0.19450709  0.75187574  1
  H  H63  1  0.19302478  0.30548329  0.74812099  1
  H  H64  1  0.30695576  0.80549474  0.24812249  1
  H  H65  1  0.80697276  0.69451433  0.25187819  1
  H  H66  1  0.98416137  0.35796037  0.05312914  1
  H  H67  1  0.48415687  0.14203695  0.44687268  1
  H  H68  1  0.01583959  0.64203751  0.94686916  1
  H  H69  1  0.51584456  0.85796277  0.55312729  1
  H  H70  1  0.96638173  0.36756688  0.92421342  1
  H  H71  1  0.46638169  0.13243460  0.57579011  1
  H  H72  1  0.03362232  0.63243271  0.07578551  1
  H  H73  1  0.53362017  0.86756437  0.42420946  1
  C  C74  1  0.83362900  0.13577153  0.85629598  1
  C  C75  1  0.33362026  0.36422493  0.64370234  1
  C  C76  1  0.16636888  0.86422981  0.14370119  1
  C  C77  1  0.66638019  0.63577278  0.35629814  1
  C  C78  1  0.14223534  0.24246948  0.95326183  1
  C  C79  1  0.64223363  0.25752940  0.54673685  1
  C  C80  1  0.85776535  0.75752625  0.04673750  1
  C  C81  1  0.35776721  0.74247141  0.45326402  1
  C  C82  1  0.67918559  0.34234743  0.99689033  1
  C  C83  1  0.17920489  0.15763548  0.50310894  1
  C  C84  1  0.32081006  0.65764806  0.00310948  1
  C  C85  1  0.82079637  0.84236369  0.49689009  1
  C  C86  1  0.75958259  0.22538305  0.02854476  1
  C  C87  1  0.25958731  0.27461085  0.47145305  1
  C  C88  1  0.24041620  0.77461443  0.97145246  1
  C  C89  1  0.74041425  0.72538914  0.52854703  1
  C  C90  1  0.73704266  0.24507780  0.82542498  1
  C  C91  1  0.23703543  0.25491774  0.67457415  1
  C  C92  1  0.26295560  0.75492477  0.17457380  1
  C  C93  1  0.76296377  0.74508032  0.32542538  1
  C  C94  1  0.99141408  0.29764727  0.97468286  1
  C  C95  1  0.49141234  0.20235146  0.52531837  1
  C  C96  1  0.00858686  0.70235022  0.02531546  1
  C  C97  1  0.50858899  0.79764834  0.47468157  1
  N  N98  1  0.88502420  0.17986850  0.96171162  1
  N  N99  1  0.38502200  0.32013096  0.53828930  1
  N  N100  1  0.11497488  0.82013081  0.03828541  1
  N  N101  1  0.61497888  0.67986841  0.46171129  1
  N  N102  1  0.17774775  0.14400168  0.01706263  1
  N  N103  1  0.67774291  0.35599565  0.48293399  1
  N  N104  1  0.82225603  0.85599558  0.98293665  1
  N  N105  1  0.32225949  0.64400632  0.51706800  1
  N  N106  1  0.62218773  0.29848117  0.89682586  1
  N  N107  1  0.12219042  0.20150475  0.60316700  1
  N  N108  1  0.37781093  0.70151712  0.10317365  1
  N  N109  1  0.87780938  0.79849380  0.39683184  1
  O  O110  1  0.04464340  0.93029183  0.87368633  1
  O  O111  1  0.54465570  0.56971414  0.62631037  1
  O  O112  1  0.95535147  0.06972339  0.12630875  1
  O  O113  1  0.45533655  0.43027602  0.37369536  1
  O  O114  1  -0.01531540  0.95042382  0.63088008  1
  O  O115  1  0.48467026  0.54955828  0.86910412  1
  O  O116  1  1.01531219  0.04958029  0.36912152  1
  O  O117  1  0.51534332  0.45045178  0.13090849  1
  O  O118  1  0.89583829  0.41389297  0.63709961  1
  O  O119  1  0.39584127  0.08609043  0.86290728  1
  O  O120  1  0.10416238  0.58610434  0.36290696  1
  O  O121  1  0.60415523  0.91391182  0.13708596  1
  O  O122  1  0.05646974  0.64919940  0.65670220  1
  O  O123  1  0.55646752  0.85078452  0.84329715  1
  O  O124  1  0.94351941  0.35080456  0.34329289  1
  O  O125  1  0.44353301  0.14922132  0.15670342  1
  O  O126  1  0.31432530  0.84317956  0.72410805  1
  O  O127  1  0.81432811  0.65681367  0.77589191  1
  O  O128  1  0.68567241  0.15681457  0.27589323  1
  O  O129  1  0.18567137  0.34318660  0.22411039  1
  O  O130  1  0.04926174  0.50824698  0.80611868  1
  O  O131  1  0.54925973  0.99174864  0.69388524  1
  O  O132  1  0.95074786  0.49176552  0.19388185  1
  O  O133  1  0.45073740  0.00824538  0.30610993  1
