# generated using pymatgen
data_MnV4H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.40113056
_cell_length_b   9.76529596
_cell_length_c   13.73481429
_cell_angle_alpha   103.39268813
_cell_angle_beta   90.00001259
_cell_angle_gamma   90.00013199
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnV4H32C12(NO2)6
_chemical_formula_sum   'Mn2 V8 H64 C24 N12 O24'
_cell_volume   1226.63196719
_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  0.10127101  0.86110863  0.72708599  1
  V  V1  1  0.60127348  0.63888442  0.77291435  1
  V  V2  1  0.89872774  0.13889176  0.27291353  1
  V  V3  1  0.39872621  0.36111515  0.22708711  1
  V  V4  1  0.95369030  0.55802285  0.72263684  1
  V  V5  1  0.45368928  0.94196982  0.77736491  1
  V  V6  1  0.04631001  0.44197835  0.27736386  1
  V  V7  1  0.54630996  0.05802899  0.22263399  1
  Mn  Mn8  1  -0.00000058  0.99999935  1.00000002  1
  Mn  Mn9  1  0.50000043  0.50000059  0.50000040  1
  H  H10  1  0.19257047  0.20143556  0.08584609  1
  H  H11  1  0.69256822  0.29856383  0.41415178  1
  H  H12  1  0.80742950  0.79856479  0.91415430  1
  H  H13  1  0.30743262  0.70143686  0.58584917  1
  H  H14  1  0.27944439  0.10728393  0.98673097  1
  H  H15  1  0.77944503  0.39271480  0.51326569  1
  H  H16  1  0.72055510  0.89271583  0.01326936  1
  H  H17  1  0.22055591  0.60728582  0.48673508  1
  H  H18  1  0.57629007  0.38187461  0.86580945  1
  H  H19  1  0.07629333  0.11811822  0.63419110  1
  H  H20  1  0.42370837  0.61812583  0.13419131  1
  H  H21  1  0.92370620  0.88188218  0.36580814  1
  H  H22  1  0.54618369  0.21558515  0.88268806  1
  H  H23  1  0.04618514  0.28440753  0.61731351  1
  H  H24  1  0.45381488  0.78441462  0.11731206  1
  H  H25  1  0.95381529  0.71559311  0.38268642  1
  H  H26  1  0.77463460  0.03912123  0.84848059  1
  H  H27  1  0.27463359  0.46087494  0.65152140  1
  H  H28  1  0.22536477  0.96087866  0.15151866  1
  H  H29  1  0.72536806  0.53912533  0.34847999  1
  H  H30  1  0.92674468  0.11238953  0.80433624  1
  H  H31  1  0.42674496  0.38760848  0.69566502  1
  H  H32  1  0.07325361  0.88761107  0.19566232  1
  H  H33  1  0.57325570  0.61239001  0.30433621  1
  H  H34  1  0.21169613  0.33542395  0.96252522  1
  H  H35  1  0.71169648  0.16457620  0.53747316  1
  H  H36  1  0.78830402  0.66457527  0.03747320  1
  H  H37  1  0.28830445  0.83542335  0.46252664  1
  H  H38  1  0.14963262  0.18776533  0.87229844  1
  H  H39  1  0.64963421  0.31223462  0.62769998  1
  H  H40  1  0.85036750  0.81223216  0.12770036  1
  H  H41  1  0.35036718  0.68776493  0.37230057  1
  H  H42  1  0.57898622  0.37153373  0.04153363  1
  H  H43  1  0.07898841  0.12846107  0.45846718  1
  H  H44  1  0.42101332  0.62846535  0.95846667  1
  H  H45  1  0.92101201  0.87154193  0.54153218  1
  H  H46  1  0.73637545  0.43840010  -0.00242126  1
  H  H47  1  0.23637861  0.06159700  0.50242172  1
  H  H48  1  0.26362361  0.56160026  1.00242149  1
  H  H49  1  0.76362107  0.93840400  0.49757719  1
  H  H50  1  0.79295088  0.26684530  0.10142344  1
  H  H51  1  0.29295032  0.23315382  0.39857767  1
  H  H52  1  0.20704995  0.73315414  0.89857595  1
  H  H53  1  0.70705108  0.76684881  0.60142298  1
  H  H54  1  0.69025648  0.13488611  0.02059440  1
  H  H55  1  0.19025406  0.36510976  0.47940727  1
  H  H56  1  0.30974435  0.86511312  0.97940510  1
  H  H57  1  0.80974755  0.63489225  0.52059407  1
  H  H58  1  0.80472445  0.33709520  0.81106202  1
  H  H59  1  0.30472801  0.16290108  0.68893870  1
  H  H60  1  0.19527328  0.66290561  0.18893747  1
  H  H61  1  0.69527161  0.83709757  0.31106095  1
  H  H62  1  0.69884842  0.19434102  0.74447697  1
  H  H63  1  0.19885096  0.30565274  0.75552426  1
  H  H64  1  0.30114875  0.80565921  0.25552275  1
  H  H65  1  0.80114903  0.69434586  0.24447618  1
  H  H66  1  0.98171438  0.35937180  0.05094059  1
  H  H67  1  0.48171314  0.14062733  0.44905995  1
  H  H68  1  0.01828574  0.64062796  0.94905821  1
  H  H69  1  0.51828771  0.85937363  0.55094041  1
  H  H70  1  0.96687048  0.37096554  0.92292709  1
  H  H71  1  0.46687179  0.12903368  0.57707337  1
  H  H72  1  0.03312990  0.62903413  0.07707152  1
  H  H73  1  0.53312924  0.87096589  0.42292653  1
  C  C74  1  0.83467031  0.13716200  0.85396790  1
  C  C75  1  0.33467109  0.36283511  0.64603349  1
  C  C76  1  0.16532832  0.86283833  0.14603135  1
  C  C77  1  0.66532993  0.63716443  0.35396747  1
  C  C78  1  0.13948918  0.24438625  0.95082087  1
  C  C79  1  0.63948983  0.25561358  0.54917799  1
  C  C80  1  0.86051129  0.75561361  0.04917855  1
  C  C81  1  0.36051142  0.74438617  0.45082252  1
  C  C82  1  0.67215736  0.34334101  0.99326537  1
  C  C83  1  0.17215969  0.15665439  0.50673560  1
  C  C84  1  0.32784170  0.65665826  0.00673451  1
  C  C85  1  0.82784058  0.84334698  0.49326421  1
  C  C86  1  0.75697432  0.22817733  0.02407226  1
  C  C87  1  0.25697390  0.27182021  0.47592900  1
  C  C88  1  0.24302579  0.77182223  0.97592711  1
  C  C89  1  0.74302685  0.72818150  0.52407175  1
  C  C90  1  0.74335194  0.24405792  0.81782388  1
  C  C91  1  0.24335371  0.25593758  0.68217716  1
  C  C92  1  0.25664563  0.75594171  0.18217592  1
  C  C93  1  0.75664562  0.74406208  0.31782280  1
  C  C94  1  0.98916699  0.29968703  0.97285716  1
  C  C95  1  0.48916727  0.20031218  0.52714298  1
  C  C96  1  0.01083336  0.70031251  0.02714135  1
  C  C97  1  0.51083384  0.79968815  0.47285734  1
  N  N98  1  0.88186654  0.18522528  0.95901135  1
  N  N99  1  0.38186680  0.31477347  0.54098982  1
  N  N100  1  0.11813300  0.81477470  0.04098754  1
  N  N101  1  0.61813417  0.68522700  0.45901121  1
  N  N102  1  0.18180303  0.14670162  0.01287701  1
  N  N103  1  0.68180326  0.35329795  0.48712126  1
  N  N104  1  0.81819693  0.85329979  0.98712327  1
  N  N105  1  0.31819832  0.64670257  0.51287956  1
  N  N106  1  0.62325681  0.29502415  0.88784231  1
  N  N107  1  0.12325897  0.20496993  0.61215906  1
  N  N108  1  0.37674187  0.70497561  0.11215801  1
  N  N109  1  0.87674122  0.79503066  0.38784084  1
  O  O110  1  0.05131081  0.90373307  0.84910061  1
  O  O111  1  0.55131746  0.59626271  0.65089871  1
  O  O112  1  0.94868875  0.09626735  0.15089916  1
  O  O113  1  0.44868342  0.40373633  0.34910237  1
  O  O114  1  0.03043097  0.97607231  0.66693635  1
  O  O115  1  0.53042715  0.52391977  0.83306100  1
  O  O116  1  0.96956984  0.02392915  0.33306368  1
  O  O117  1  0.46957093  0.47608103  0.16694070  1
  O  O118  1  0.91762020  0.41537896  0.63072933  1
  O  O119  1  0.41761934  0.08461106  0.86927395  1
  O  O120  1  0.08238060  0.58462051  0.36927235  1
  O  O121  1  0.58237920  0.91538877  0.13072475  1
  O  O122  1  0.04385095  0.68617441  0.66602399  1
  O  O123  1  0.54385563  0.81381994  0.83397545  1
  O  O124  1  0.95614504  0.31382729  0.33397485  1
  O  O125  1  0.45614433  0.18618063  0.16602464  1
  O  O126  1  0.29292744  0.85852184  0.71384352  1
  O  O127  1  0.79292898  0.64146911  0.78616075  1
  O  O128  1  0.70707137  0.14147650  0.28615626  1
  O  O129  1  0.20707061  0.35852978  0.21384131  1
  O  O130  1  0.05879111  0.51213533  0.80665723  1
  O  O131  1  0.55878531  0.98786093  0.69334266  1
  O  O132  1  0.94121239  0.48786830  0.19334236  1
  O  O133  1  0.44121271  0.01213732  0.30665539  1
