# generated using pymatgen
data_Cr3Co2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.36353879
_cell_length_b   9.72436520
_cell_length_c   13.67958303
_cell_angle_alpha   103.41118372
_cell_angle_beta   90.00002424
_cell_angle_gamma   90.00013647
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr3Co2H32C12(NO2)6
_chemical_formula_sum   'Cr6 Co4 H64 C24 N12 O24'
_cell_volume   1211.62080843
_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
  Co  Co0  1  0.09643702  0.86712778  0.73697840  1
  Co  Co1  1  0.59644379  0.63286545  0.76301846  1
  Co  Co2  1  0.90356182  0.13287270  0.26302016  1
  Co  Co3  1  0.40355514  0.36713516  0.23698365  1
  Cr  Cr4  1  0.95044066  0.56353555  0.72179247  1
  Cr  Cr5  1  0.45043964  0.93645686  0.77821031  1
  Cr  Cr6  1  0.04955909  0.43646612  0.27820866  1
  Cr  Cr7  1  0.54955912  0.06354264  0.22178845  1
  Cr  Cr8  1  -0.00000006  0.99999976  0.99999943  1
  Cr  Cr9  1  0.50000061  0.50000026  0.50000077  1
  H  H10  1  0.18950737  0.19703539  0.09004114  1
  H  H11  1  0.68950613  0.30296465  0.40995662  1
  H  H12  1  0.81049288  0.80296414  0.90995804  1
  H  H13  1  0.31049583  0.69703683  0.59004456  1
  H  H14  1  0.27497477  0.09879832  0.99009774  1
  H  H15  1  0.77497548  0.40120188  0.50989902  1
  H  H16  1  0.72502467  0.90120091  0.00990131  1
  H  H17  1  0.22502553  0.59879842  0.49010294  1
  H  H18  1  0.54533138  0.45758750  0.86396814  1
  H  H19  1  0.04532741  0.04239837  0.63602378  1
  H  H20  1  0.45466709  0.54241541  0.13603527  1
  H  H21  1  0.95467225  0.95760315  0.36397511  1
  H  H22  1  0.54537263  0.21796877  0.88569543  1
  H  H23  1  0.04537131  0.28202366  0.61430455  1
  H  H24  1  0.45462622  0.78203241  0.11430443  1
  H  H25  1  0.95462798  0.71797629  0.38569593  1
  H  H26  1  0.77714540  0.03369438  0.84852274  1
  H  H27  1  0.27714208  0.46630074  0.65147975  1
  H  H28  1  0.22285480  0.96630531  0.15147571  1
  H  H29  1  0.72285973  0.53369906  0.34852211  1
  H  H30  1  0.92769924  0.11079399  0.80510226  1
  H  H31  1  0.42769534  0.38920207  0.69490094  1
  H  H32  1  0.07229992  0.88920717  0.19489598  1
  H  H33  1  0.57230536  0.61079487  0.30510027  1
  H  H34  1  0.21602378  0.33242173  0.96673205  1
  H  H35  1  0.71602360  0.16757841  0.53326509  1
  H  H36  1  0.78397612  0.66757799  0.03326716  1
  H  H37  1  0.28397729  0.83242118  0.46673560  1
  H  H38  1  0.15419150  0.18571885  0.87444034  1
  H  H39  1  0.65419413  0.31428139  0.62555767  1
  H  H40  1  0.84580860  0.81428073  0.12555893  1
  H  H41  1  0.34580635  0.68571778  0.37444322  1
  H  H42  1  0.58294454  0.37225756  0.05160040  1
  H  H43  1  0.08294333  0.12772791  0.44839086  1
  H  H44  1  0.41705559  0.62773827  0.94839736  1
  H  H45  1  0.91705711  0.87227428  0.55160919  1
  H  H46  1  0.74028118  0.43142807  0.00018155  1
  H  H47  1  0.24028619  0.06857119  0.49981969  1
  H  H48  1  0.25971730  0.56857168  0.99981842  1
  H  H49  1  0.75971324  0.93142908  0.50017952  1
  H  H50  1  0.79571717  0.25926806  0.10442259  1
  H  H51  1  0.29571606  0.24073538  0.39557879  1
  H  H52  1  0.20428355  0.74073007  0.89557610  1
  H  H53  1  0.70428552  0.75926664  0.60442215  1
  H  H54  1  0.69254408  0.12886548  0.02296516  1
  H  H55  1  0.19254016  0.37113183  0.47703815  1
  H  H56  1  0.30745652  0.87113283  0.97703352  1
  H  H57  1  0.80746177  0.62886999  0.52296288  1
  H  H58  1  0.80433732  0.33324009  0.81428245  1
  H  H59  1  0.30433793  0.16675491  0.68571820  1
  H  H60  1  0.19566059  0.66676048  0.18571691  1
  H  H61  1  0.69566052  0.83324346  0.31428164  1
  H  H62  1  0.69852123  0.19061415  0.74892977  1
  H  H63  1  0.19851772  0.30937772  0.75106869  1
  H  H64  1  0.30147782  0.80938609  0.25106898  1
  H  H65  1  0.80148167  0.69062103  0.24893170  1
  H  H66  1  0.98317558  0.35766824  0.05263809  1
  H  H67  1  0.48317350  0.14233289  0.44736197  1
  H  H68  1  0.01682401  0.64233180  0.94736053  1
  H  H69  1  0.51682712  0.85766732  0.55263843  1
  H  H70  1  0.96677304  0.36709903  0.92342775  1
  H  H71  1  0.46677562  0.13290071  0.57657248  1
  H  H72  1  0.03322625  0.63290065  0.07657095  1
  H  H73  1  0.53322447  0.86709856  0.42342767  1
  C  C74  1  0.83603634  0.13310835  0.85566478  1
  C  C75  1  0.33603394  0.36688720  0.64433671  1
  C  C76  1  0.16396304  0.86689172  0.14433380  1
  C  C77  1  0.66396670  0.63311169  0.35566438  1
  C  C78  1  0.14204776  0.24219846  0.95313921  1
  C  C79  1  0.64204834  0.25780198  0.54685895  1
  C  C80  1  0.85795203  0.75780141  0.04686000  1
  C  C81  1  0.35795234  0.74219742  0.45314174  1
  C  C82  1  0.67252311  0.33791212  0.99581793  1
  C  C83  1  0.17252274  0.16208251  0.50418061  1
  C  C84  1  0.32747670  0.66208659  0.00418134  1
  C  C85  1  0.82747757  0.83791853  0.49581935  1
  C  C86  1  0.75942355  0.22263796  0.02699848  1
  C  C87  1  0.25942121  0.27736031  0.47300284  1
  C  C88  1  0.24057666  0.77736056  0.97300024  1
  C  C89  1  0.74057988  0.72264097  0.52699805  1
  C  C90  1  0.74055247  0.24191275  0.82311077  1
  C  C91  1  0.24055077  0.25808000  0.67688827  1
  C  C92  1  0.25944631  0.75808722  0.17688810  1
  C  C93  1  0.75944867  0.74191911  0.32311205  1
  C  C94  1  0.99095869  0.29729579  0.97425567  1
  C  C95  1  0.49095822  0.20270473  0.52574446  1
  C  C96  1  0.00904103  0.70270398  0.02574305  1
  C  C97  1  0.50904243  0.79729492  0.47425609  1
  N  N98  1  0.88490482  0.17983617  0.96102459  1
  N  N99  1  0.38490308  0.32016277  0.53897732  1
  N  N100  1  0.11509519  0.82016325  0.03897399  1
  N  N101  1  0.61509793  0.67983736  0.46102381  1
  N  N102  1  0.17853190  0.14317526  0.01623298  1
  N  N103  1  0.67853213  0.35682464  0.48376469  1
  N  N104  1  0.82146778  0.85682443  0.98376618  1
  N  N105  1  0.32146936  0.64317605  0.51623710  1
  N  N106  1  0.62337619  0.29390402  0.89222228  1
  N  N107  1  0.12337488  0.20608827  0.60777569  1
  N  N108  1  0.37662295  0.70609623  0.10777692  1
  N  N109  1  0.87662482  0.79391201  0.39222421  1
  O  O110  1  0.05321860  0.91955118  0.86536089  1
  O  O111  1  0.55322894  0.58045341  0.63463459  1
  O  O112  1  0.94678151  0.08044864  0.13463794  1
  O  O113  1  0.44677207  0.41954735  0.36536734  1
  O  O114  1  0.00395499  0.95082950  0.64384277  1
  O  O115  1  0.50395008  0.54914700  0.85613615  1
  O  O116  1  0.99604464  0.04917170  0.35615565  1
  O  O117  1  0.49605217  0.45085941  0.14387138  1
  O  O118  1  0.90422643  0.42867236  0.63018244  1
  O  O119  1  0.40422862  0.07131686  0.86982320  1
  O  O120  1  0.09577276  0.57132628  0.36982071  1
  O  O121  1  0.59576902  0.92868359  0.13017445  1
  O  O122  1  0.05395513  0.67346165  0.67175267  1
  O  O123  1  0.55395817  0.82653002  0.82824641  1
  O  O124  1  0.94603909  0.32654033  0.32824498  1
  O  O125  1  0.44604070  0.17347123  0.17175376  1
  O  O126  1  0.30271970  0.84872968  0.72135547  1
  O  O127  1  0.80272245  0.65126284  0.77864938  1
  O  O128  1  0.69727942  0.15126809  0.27864384  1
  O  O129  1  0.19727686  0.34873655  0.22135262  1
  O  O130  1  0.04342853  0.50620337  0.80547831  1
  O  O131  1  0.54342249  0.99379405  0.69452417  1
  O  O132  1  0.95657661  0.49380323  0.19452243  1
  O  O133  1  0.45657692  0.00620378  0.30547404  1
