# generated using pymatgen
data_Cr3Co2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.37787155
_cell_length_b   9.74076268
_cell_length_c   13.68323648
_cell_angle_alpha   103.51478106
_cell_angle_beta   89.99995799
_cell_angle_gamma   90.00012459
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr3Co2H32C12(NO2)6
_chemical_formula_sum   'Cr6 Co4 H64 C24 N12 O24'
_cell_volume   1215.32009037
_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
  Cr  Cr0  1  0.09233744  0.85675006  0.73161879  1
  Cr  Cr1  1  0.59234774  0.64321869  0.76837753  1
  Cr  Cr2  1  0.90769011  0.14318429  0.26832284  1
  Cr  Cr3  1  0.40767539  0.35685818  0.23166743  1
  Co  Co4  1  0.93477478  0.55511483  0.72952697  1
  Co  Co5  1  0.43474757  0.94484899  0.77049074  1
  Co  Co6  1  0.06511952  0.44493990  0.27041302  1
  Co  Co7  1  0.56518625  0.05513404  0.22954222  1
  Cr  Cr8  1  0.00002987  0.99997626  0.99998964  1
  Cr  Cr9  1  0.50000941  0.50000419  0.50000656  1
  H  H10  1  0.19378139  0.19183476  0.08518390  1
  H  H11  1  0.69372694  0.30812926  0.41481839  1
  H  H12  1  0.80636248  0.80809762  0.91482355  1
  H  H13  1  0.30641411  0.69192503  0.58519636  1
  H  H14  1  0.27545618  0.09669059  0.98240095  1
  H  H15  1  0.77542929  0.40331533  0.51757124  1
  H  H16  1  0.72457118  0.90326236  0.01755239  1
  H  H17  1  0.22456000  0.59676759  0.48248162  1
  H  H18  1  0.57717179  0.37491360  0.86776845  1
  H  H19  1  0.07717966  0.12508573  0.63222469  1
  H  H20  1  0.42283206  0.62509309  0.13222552  1
  H  H21  1  0.92282651  0.87491892  0.36778075  1
  H  H22  1  0.47192786  0.16113851  0.88744214  1
  H  H23  1  -0.02808294  0.33886254  0.61255287  1
  H  H24  1  0.52812679  0.83881827  0.11247579  1
  H  H25  1  1.02817873  0.66124577  0.38760478  1
  H  H26  1  0.75941514  0.03052315  0.85226945  1
  H  H27  1  0.25948195  0.46953170  0.64780260  1
  H  H28  1  0.24049134  0.96960545  0.14785854  1
  H  H29  1  0.74049204  0.53038379  0.35213571  1
  H  H30  1  0.91201648  0.09245017  0.79935986  1
  H  H31  1  0.41206896  0.40749606  0.70060330  1
  H  H32  1  0.08790842  0.90746306  0.20058425  1
  H  H33  1  0.58791111  0.59254054  0.29941928  1
  H  H34  1  0.20478049  0.33421354  0.97155249  1
  H  H35  1  0.70474480  0.16575644  0.52846231  1
  H  H36  1  0.79531151  0.66574231  0.02849837  1
  H  H37  1  0.29531763  0.83425622  0.47151838  1
  H  H38  1  0.16561813  0.18783099  0.87175418  1
  H  H39  1  0.66573192  0.31217675  0.62824222  1
  H  H40  1  0.83416583  0.81220493  0.12827020  1
  H  H41  1  0.33411801  0.68777791  0.37174569  1
  H  H42  1  0.58297167  0.36658810  0.04323900  1
  H  H43  1  0.08293703  0.13340661  0.45676359  1
  H  H44  1  0.41708335  0.63339331  0.95677168  1
  H  H45  1  0.91707614  0.86661430  0.54323319  1
  H  H46  1  0.73883637  0.43797351  0.00260806  1
  H  H47  1  0.23882196  0.06200807  0.49735357  1
  H  H48  1  0.26116140  0.56200221  0.99733619  1
  H  H49  1  0.76115332  0.93800783  0.50266719  1
  H  H50  1  0.79834790  0.26738798  0.10184035  1
  H  H51  1  0.29832307  0.23261425  0.39813199  1
  H  H52  1  0.20168582  0.73261985  0.89812383  1
  H  H53  1  0.70168161  0.76737885  0.60187802  1
  H  H54  1  0.69272874  0.13412191  0.02543693  1
  H  H55  1  0.19273498  0.36591194  0.47458645  1
  H  H56  1  0.30725880  0.86592548  0.97459957  1
  H  H57  1  0.80726498  0.63408622  0.52540461  1
  H  H58  1  0.80721974  0.32098305  0.80490132  1
  H  H59  1  0.30723855  0.17901631  0.69506950  1
  H  H60  1  0.19276523  0.67902076  0.19505328  1
  H  H61  1  0.69276204  0.82097728  0.30495137  1
  H  H62  1  0.68854409  0.18463971  0.74691247  1
  H  H63  1  0.18855915  0.31533343  0.75308778  1
  H  H64  1  0.31145159  0.81531894  0.25309460  1
  H  H65  1  0.81145600  0.68467875  0.24690605  1
  H  H66  1  0.97552069  0.42166265  0.10674716  1
  H  H67  1  0.47558021  0.07825547  0.39319542  1
  H  H68  1  0.02433623  0.57823224  0.89313854  1
  H  H69  1  0.52431928  0.92178897  0.60687646  1
  H  H70  1  0.96182565  0.37410887  0.93191923  1
  H  H71  1  0.46184573  0.12598950  0.56819733  1
  H  H72  1  0.03816542  0.62607379  0.06831773  1
  H  H73  1  0.53815193  0.87392125  0.43168042  1
  C  C74  1  0.82438070  0.12416629  0.85257978  1
  C  C75  1  0.32439493  0.37583422  0.64741152  1
  C  C76  1  0.17562012  0.87586238  0.14741560  1
  C  C77  1  0.67562587  0.62413362  0.35258589  1
  C  C78  1  0.13934962  0.23796380  0.95054972  1
  C  C79  1  0.63934940  0.26203724  0.54946287  1
  C  C80  1  0.86066818  0.76205526  0.04950321  1
  C  C81  1  0.36066500  0.73793848  0.45050229  1
  C  C82  1  0.67462748  0.34028255  0.99252263  1
  C  C83  1  0.17461083  0.15970422  0.50746008  1
  C  C84  1  0.32539217  0.65969186  0.00745383  1
  C  C85  1  0.82538547  0.84031854  0.49255006  1
  C  C86  1  0.75920384  0.22631248  0.02543402  1
  C  C87  1  0.25916689  0.27366975  0.47453839  1
  C  C88  1  0.24085183  0.77365821  0.97453024  1
  C  C89  1  0.74084960  0.72634678  0.52547195  1
  C  C90  1  0.73710608  0.23620336  0.81907295  1
  C  C91  1  0.23711652  0.26379657  0.68091507  1
  C  C92  1  0.26288800  0.76380787  0.18091348  1
  C  C93  1  0.76289233  0.73619172  0.31908793  1
  C  C94  1  0.98944030  0.28083246  0.96129011  1
  C  C95  1  0.48945145  0.21917265  0.53872149  1
  C  C96  1  0.01055375  0.71920651  0.03878091  1
  C  C97  1  0.51055107  0.78078552  0.46121911  1
  N  N98  1  0.88162578  0.17637013  0.95682481  1
  N  N99  1  0.38161169  0.32361521  0.54314767  1
  N  N100  1  0.11841158  0.82362086  0.04314690  1
  N  N101  1  0.61841297  0.67637853  0.45685484  1
  N  N102  1  0.17752660  0.13698882  0.01193552  1
  N  N103  1  0.67749900  0.36298891  0.48806030  1
  N  N104  1  0.82252434  0.86296806  0.98807148  1
  N  N105  1  0.32252399  0.63704193  0.51194769  1
  N  N106  1  0.62390378  0.29142808  0.89006869  1
  N  N107  1  0.12391182  0.20856845  0.60992069  1
  N  N108  1  0.37608259  0.70856423  0.10991381  1
  N  N109  1  0.87608276  0.79144570  0.39009218  1
  O  O110  1  0.05360326  0.90457523  0.85757444  1
  O  O111  1  0.55362870  0.59540091  0.64242067  1
  O  O112  1  0.94639747  0.09542292  0.14236001  1
  O  O113  1  0.44634443  0.40462594  0.35763152  1
  O  O114  1  0.02408246  0.97305656  0.67397920  1
  O  O115  1  0.52407223  0.52691200  0.82600825  1
  O  O116  1  0.97596733  0.02685713  0.32593078  1
  O  O117  1  0.47596907  0.47315400  0.17403700  1
  O  O118  1  0.89383872  0.40992095  0.62113204  1
  O  O119  1  0.39385357  0.09007670  0.87888745  1
  O  O120  1  0.10604619  0.58996444  0.37888766  1
  O  O121  1  0.60609045  0.90999860  0.12111573  1
  O  O122  1  0.02727094  0.69409319  0.67521077  1
  O  O123  1  0.52729552  0.80588440  0.82478662  1
  O  O124  1  0.97273966  0.30583409  0.32473855  1
  O  O125  1  0.47262611  0.19415521  0.17526580  1
  O  O126  1  0.27262962  0.84267643  0.70956520  1
  O  O127  1  0.77263047  0.65728161  0.79043660  1
  O  O128  1  0.72741851  0.15728034  0.29039275  1
  O  O129  1  0.22742485  0.34281197  0.20958185  1
  O  O130  1  0.03159404  0.50074810  0.83287952  1
  O  O131  1  0.53158257  0.99927592  0.66713549  1
  O  O132  1  0.96839324  0.49912478  0.16701649  1
  O  O133  1  0.46847397  0.00080273  0.33290851  1
