# generated using pymatgen
data_Mn2V2CrH32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.36118992
_cell_length_b   9.72249094
_cell_length_c   13.67426756
_cell_angle_alpha   103.45273990
_cell_angle_beta   90.00000527
_cell_angle_gamma   90.00013145
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2V2CrH32C12(NO2)6
_chemical_formula_sum   'Mn4 V4 Cr2 H64 C24 N12 O24'
_cell_volume   1210.40313097
_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  0.09596024  0.85993750  0.73150897  1
  V  V1  1  0.59596216  0.64005740  0.76849036  1
  V  V2  1  0.90403936  0.14006239  0.26849025  1
  V  V3  1  0.40403812  0.35994367  0.23151045  1
  Mn  Mn4  1  0.95449025  0.55230908  0.73277677  1
  Mn  Mn5  1  0.45448970  0.94768450  0.76722386  1
  Mn  Mn6  1  0.04551017  0.44769208  0.26722327  1
  Mn  Mn7  1  0.54550954  0.05231495  0.23277585  1
  Cr  Cr8  1  -0.00000018  0.99999962  0.99999962  1
  Cr  Cr9  1  0.50000032  0.50000014  0.50000051  1
  H  H10  1  0.19051659  0.19514962  0.08711587  1
  H  H11  1  0.69051510  0.30485074  0.41288235  1
  H  H12  1  0.80948394  0.80484956  0.91288326  1
  H  H13  1  0.30948617  0.69515023  0.58711845  1
  H  H14  1  0.27559089  0.10114297  0.98498757  1
  H  H15  1  0.77559103  0.39885751  0.51500974  1
  H  H16  1  0.72440907  0.89885656  0.01501111  1
  H  H17  1  0.22440896  0.60114272  0.48499186  1
  H  H18  1  0.57929995  0.37614003  0.86902591  1
  H  H19  1  0.07930371  0.12385388  0.63097427  1
  H  H20  1  0.42069923  0.62386071  0.13097462  1
  H  H21  1  0.92069625  0.87614556  0.36902477  1
  H  H22  1  0.48942216  0.15643497  0.88938022  1
  H  H23  1  -0.01057896  0.34355687  0.61062134  1
  H  H24  1  0.51057668  0.84356553  0.11061845  1
  H  H25  1  1.01057880  0.65644272  0.38937972  1
  H  H26  1  0.77513253  0.03555978  0.85193316  1
  H  H27  1  0.27513217  0.46443711  0.64806892  1
  H  H28  1  0.22486730  0.96444039  0.14806582  1
  H  H29  1  0.72486861  0.53556239  0.35193271  1
  H  H30  1  0.92837270  0.10713621  0.80683960  1
  H  H31  1  0.42837389  0.39286271  0.69316148  1
  H  H32  1  0.07162710  0.89286462  0.19315970  1
  H  H33  1  0.57162716  0.60713561  0.30683931  1
  H  H34  1  0.21314112  0.33409159  0.96834210  1
  H  H35  1  0.71314215  0.16590938  0.53165609  1
  H  H36  1  0.78685853  0.66590806  0.03165717  1
  H  H37  1  0.28685813  0.83409051  0.46834439  1
  H  H38  1  0.14943798  0.19122769  0.87385198  1
  H  H39  1  0.64944060  0.30877294  0.62614661  1
  H  H40  1  0.85056125  0.80877165  0.12614757  1
  H  H41  1  0.35055877  0.69122664  0.37385384  1
  H  H42  1  0.58069130  0.36663416  0.04435779  1
  H  H43  1  0.08069234  0.13336261  0.45564264  1
  H  H44  1  0.41930831  0.63336521  0.95564240  1
  H  H45  1  0.91930768  0.86663959  0.54435675  1
  H  H46  1  0.73885957  0.43868405  0.00712488  1
  H  H47  1  0.23886320  0.06131476  0.49287456  1
  H  H48  1  0.26114010  0.56131560  0.99287608  1
  H  H49  1  0.76113662  0.93868625  0.50712416  1
  H  H50  1  0.79403548  0.26538679  0.10555690  1
  H  H51  1  0.29403462  0.23461563  0.39444397  1
  H  H52  1  0.20596388  0.73461115  0.89444251  1
  H  H53  1  0.70596611  0.76538733  0.60555661  1
  H  H54  1  0.69038328  0.13294590  0.02603994  1
  H  H55  1  0.19038197  0.36705312  0.47396297  1
  H  H56  1  0.30961645  0.86705306  0.97395894  1
  H  H57  1  0.80961935  0.63294925  0.52603828  1
  H  H58  1  0.81048811  0.32852984  0.80740933  1
  H  H59  1  0.31049216  0.17146646  0.69259076  1
  H  H60  1  0.18951114  0.67147096  0.19259042  1
  H  H61  1  0.68950768  0.82853146  0.30740833  1
  H  H62  1  0.69863140  0.18559589  0.74936257  1
  H  H63  1  0.19863413  0.31439830  0.75063845  1
  H  H64  1  0.30136764  0.81440523  0.25063710  1
  H  H65  1  0.80136604  0.68559950  0.24936183  1
  H  H66  1  0.98049923  0.36410216  0.05573939  1
  H  H67  1  0.48049890  0.13589902  0.44425989  1
  H  H68  1  0.01950094  0.63589680  0.94425990  1
  H  H69  1  0.51950131  0.86410169  0.55574067  1
  H  H70  1  0.96512718  0.36885974  0.92499174  1
  H  H71  1  0.46512914  0.13113884  0.57500728  1
  H  H72  1  0.03487204  0.63114014  0.07500777  1
  H  H73  1  0.53487108  0.86886077  0.42499317  1
  C  C74  1  0.83658118  0.13324452  0.85726322  1
  C  C75  1  0.33658217  0.36675329  0.64273808  1
  C  C76  1  0.16341847  0.86675583  0.14273604  1
  C  C77  1  0.66341848  0.63324605  0.35726291  1
  C  C78  1  0.13880465  0.24411220  0.95358357  1
  C  C79  1  0.63880561  0.25588837  0.54641521  1
  C  C80  1  0.86119482  0.75588733  0.04641565  1
  C  C81  1  0.36119440  0.74411130  0.45358511  1
  C  C82  1  0.67439566  0.34093644  0.99515076  1
  C  C83  1  0.17439747  0.15906086  0.50484957  1
  C  C84  1  0.32560399  0.65906300  0.00484919  1
  C  C85  1  0.82560247  0.84094044  0.49514994  1
  C  C86  1  0.75788421  0.22554989  0.02823978  1
  C  C87  1  0.25788414  0.27444980  0.47176155  1
  C  C88  1  0.24211550  0.77444912  0.97175952  1
  C  C89  1  0.74211647  0.72555211  0.52823921  1
  C  C90  1  0.74420307  0.24128848  0.82181512  1
  C  C91  1  0.24420589  0.25870720  0.67818556  1
  C  C92  1  0.25579629  0.75871227  0.17818456  1
  C  C93  1  0.75579427  0.74129164  0.32181447  1
  C  C94  1  0.98887351  0.30014979  0.97687281  1
  C  C95  1  0.48887418  0.19985012  0.52312691  1
  C  C96  1  0.01112606  0.69984995  0.02312678  1
  C  C97  1  0.51112590  0.80014968  0.47687364  1
  N  N98  1  0.88426419  0.18148081  0.96308672  1
  N  N99  1  0.38426455  0.31851862  0.53691438  1
  N  N100  1  0.11573558  0.81851875  0.03691256  1
  N  N101  1  0.61573604  0.68148174  0.46308663  1
  N  N102  1  0.17742983  0.14127380  0.01328118  1
  N  N103  1  0.67742963  0.35872674  0.48671722  1
  N  N104  1  0.82256898  0.85872643  0.98671918  1
  N  N105  1  0.32257112  0.64127366  0.51328399  1
  N  N106  1  0.62867900  0.29336761  0.89146596  1
  N  N107  1  0.12868235  0.20662758  0.60853450  1
  N  N108  1  0.37132026  0.70663285  0.10853392  1
  N  N109  1  0.87131778  0.79337279  0.39146526  1
  O  O110  1  0.05019213  0.90751042  0.86061772  1
  O  O111  1  0.55019642  0.59248813  0.63938147  1
  O  O112  1  0.94980750  0.09248870  0.13938169  1
  O  O113  1  0.44980388  0.40751209  0.36061943  1
  O  O114  1  0.02084220  0.97581612  0.67207896  1
  O  O115  1  0.52083885  0.52417715  0.82791831  1
  O  O116  1  0.97915860  0.02418491  0.32792107  1
  O  O117  1  0.47916099  0.47582357  0.17208289  1
  O  O118  1  0.91833246  0.42112563  0.61505547  1
  O  O119  1  0.41833341  0.07886621  0.88494640  1
  O  O120  1  0.08166665  0.57887352  0.38494621  1
  O  O121  1  0.58166411  0.92113539  0.11505188  1
  O  O122  1  0.03701458  0.68957600  0.67175121  1
  O  O123  1  0.53701843  0.81041912  0.82824852  1
  O  O124  1  0.96298354  0.31042484  0.32824713  1
  O  O125  1  0.46298197  0.18958211  0.17175227  1
  O  O126  1  0.28257552  0.85244511  0.71136700  1
  O  O127  1  0.78257608  0.64754642  0.78863569  1
  O  O128  1  0.71742434  0.14755285  0.28863243  1
  O  O129  1  0.21742375  0.35245396  0.21136549  1
  O  O130  1  0.03442963  0.51465541  0.83737332  1
  O  O131  1  0.53442359  0.98534555  0.66262764  1
  O  O132  1  0.96557425  0.48535162  0.16262732  1
  O  O133  1  0.46557559  0.01465222  0.33737139  1
