# generated using pymatgen
data_Co4NiH32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35105721
_cell_length_b   9.70507941
_cell_length_c   13.65137319
_cell_angle_alpha   103.49283650
_cell_angle_beta   89.99997852
_cell_angle_gamma   90.00013302
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co4NiH32C12(NO2)6
_chemical_formula_sum   'Co8 Ni2 H64 C24 N12 O24'
_cell_volume   1204.70494984
_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  0.09347344  0.85084856  0.73438934  1
  Co  Co1  1  0.59347753  0.64917171  0.76559685  1
  Co  Co2  1  0.90652224  0.14915753  0.26561375  1
  Co  Co3  1  0.40652831  0.35085001  0.23439116  1
  Co  Co4  1  0.94227246  0.55481454  0.73444848  1
  Co  Co5  1  0.44227121  0.94518330  0.76554755  1
  Co  Co6  1  0.05773857  0.44518255  0.26555246  1
  Co  Co7  1  0.55772348  0.05482604  0.23445423  1
  Ni  Ni8  1  -0.00000662  1.00000265  1.00000318  1
  Ni  Ni9  1  0.49999997  0.49999850  0.49999337  1
  H  H10  1  0.18929323  0.19851119  0.09007237  1
  H  H11  1  0.68928914  0.30148581  0.40993161  1
  H  H12  1  0.81070659  0.80149179  0.90993106  1
  H  H13  1  0.31070964  0.69851249  0.59006659  1
  H  H14  1  0.27438138  0.09840473  0.99067715  1
  H  H15  1  0.77438270  0.40160514  0.50932545  1
  H  H16  1  0.72560954  0.90159482  0.00932508  1
  H  H17  1  0.22561823  0.59839357  0.49067136  1
  H  H18  1  0.53886539  0.47143677  0.87702064  1
  H  H19  1  0.03891564  0.02856416  0.62298873  1
  H  H20  1  0.46120776  0.52847949  0.12297015  1
  H  H21  1  0.96108439  0.97143792  0.37701300  1
  H  H22  1  0.53350933  0.21932605  0.89262145  1
  H  H23  1  0.03352751  0.28067684  0.60735436  1
  H  H24  1  0.46647076  0.78070153  0.10736462  1
  H  H25  1  0.96647269  0.71932293  0.39264537  1
  H  H26  1  0.76996903  0.03164169  0.85738723  1
  H  H27  1  0.26998605  0.46838633  0.64263545  1
  H  H28  1  0.23000773  0.96838512  0.14262425  1
  H  H29  1  0.73001950  0.53161307  0.35736808  1
  H  H30  1  0.91883136  0.10390173  0.80892774  1
  H  H31  1  0.41885506  0.39612654  0.69109832  1
  H  H32  1  0.08114322  0.89613126  0.19109317  1
  H  H33  1  0.58114912  0.60386712  0.30890022  1
  H  H34  1  0.21240107  0.32696684  0.96322744  1
  H  H35  1  0.71240574  0.17302743  0.53676972  1
  H  H36  1  0.78759412  0.67302583  0.03677249  1
  H  H37  1  0.28759476  0.82697300  0.46322936  1
  H  H38  1  0.14824586  0.17662715  0.87444945  1
  H  H39  1  0.64826564  0.32337202  0.62555603  1
  H  H40  1  0.85174475  0.82336803  0.12555473  1
  H  H41  1  0.35173368  0.67662943  0.37444239  1
  H  H42  1  0.57350800  0.38467631  0.06756846  1
  H  H43  1  0.07347127  0.11520165  0.43234723  1
  H  H44  1  0.42652020  0.61519957  0.93233625  1
  H  H45  1  0.92652985  0.88480074  0.56765301  1
  H  H46  1  0.73551088  0.43481905  0.00489786  1
  H  H47  1  0.23555359  0.06522935  0.49511337  1
  H  H48  1  0.26445491  0.56522257  0.99512398  1
  H  H49  1  0.76444743  0.93477222  0.50488606  1
  H  H50  1  0.79763500  0.26876781  0.10891382  1
  H  H51  1  0.29765659  0.23129109  0.39109864  1
  H  H52  1  0.20235840  0.73124795  0.89110289  1
  H  H53  1  0.70234448  0.76871647  0.60889951  1
  H  H54  1  0.69230272  0.13324917  0.03335438  1
  H  H55  1  0.19229392  0.36676163  0.46664999  1
  H  H56  1  0.30770225  0.86676135  0.96664828  1
  H  H57  1  0.80770702  0.63324063  0.53335122  1
  H  H58  1  0.79221568  0.32590242  0.81319144  1
  H  H59  1  0.29219879  0.17410562  0.68680454  1
  H  H60  1  0.20780679  0.67410932  0.18680515  1
  H  H61  1  0.70779811  0.82588891  0.31319118  1
  H  H62  1  0.68293279  0.18021995  0.75524926  1
  H  H63  1  0.18298344  0.31978533  0.74473670  1
  H  H64  1  0.31701050  0.81980151  0.24475491  1
  H  H65  1  0.81702078  0.68021059  0.25526557  1
  H  H66  1  0.98310531  0.36123171  0.05384880  1
  H  H67  1  0.48309189  0.13879310  0.44616212  1
  H  H68  1  0.01690535  0.63878524  0.94615770  1
  H  H69  1  0.51690836  0.86120702  0.55383632  1
  H  H70  1  0.96726681  0.36245806  0.92171344  1
  H  H71  1  0.46726499  0.13754952  0.57829112  1
  H  H72  1  0.03273570  0.63754760  0.07828863  1
  H  H73  1  0.53273460  0.86244939  0.42170698  1
  C  C74  1  0.82898293  0.13016492  0.86085677  1
  C  C75  1  0.32900910  0.36985819  0.63914838  1
  C  C76  1  0.17099224  0.86985871  0.13915031  1
  C  C77  1  0.67099319  0.63013867  0.36085187  1
  C  C78  1  0.13828014  0.23667169  0.95279399  1
  C  C79  1  0.63828635  0.26333139  0.54721104  1
  C  C80  1  0.86171373  0.76332759  0.04720832  1
  C  C81  1  0.36171358  0.73666857  0.45278772  1
  C  C82  1  0.67096562  0.33879015  0.99945672  1
  C  C83  1  0.17097373  0.16122644  0.50056131  1
  C  C84  1  0.32902518  0.66122437  0.00056745  1
  C  C85  1  0.82902706  0.83877457  0.49943802  1
  C  C86  1  0.75859009  0.22619842  0.03260664  1
  C  C87  1  0.25856743  0.27380424  0.46739553  1
  C  C88  1  0.24143157  0.77380287  0.96740231  1
  C  C89  1  0.74143346  0.72619688  0.53260314  1
  C  C90  1  0.72992745  0.23631885  0.82710538  1
  C  C91  1  0.22993514  0.26368986  0.67288084  1
  C  C92  1  0.27006560  0.76370700  0.17289514  1
  C  C93  1  0.77006582  0.73630892  0.32711914  1
  C  C94  1  0.98860592  0.29562371  0.97552224  1
  C  C95  1  0.48859366  0.20439114  0.52448678  1
  C  C96  1  0.01140266  0.70438685  0.02448334  1
  C  C97  1  0.51140642  0.79560802  0.47551169  1
  N  N98  1  0.88142048  0.18041789  0.96484833  1
  N  N99  1  0.38138193  0.31957697  0.53514799  1
  N  N100  1  0.11860811  0.81957806  0.03515198  1
  N  N101  1  0.61861886  0.68042274  0.46485123  1
  N  N102  1  0.17749339  0.14137325  0.01661589  1
  N  N103  1  0.67749671  0.35862860  0.48338950  1
  N  N104  1  0.82249940  0.85862816  0.98338900  1
  N  N105  1  0.32250344  0.64137056  0.51660741  1
  N  N106  1  0.61623512  0.29280621  0.89933650  1
  N  N107  1  0.11623439  0.20717999  0.60068331  1
  N  N108  1  0.38377823  0.70717748  0.10068534  1
  N  N109  1  0.88376535  0.79282005  0.39931593  1
  O  O110  1  0.04510198  0.93701763  0.85600498  1
  O  O111  1  0.54518042  0.56298392  0.64396361  1
  O  O112  1  0.95490493  0.06297507  0.14400288  1
  O  O113  1  0.45479516  0.43701012  0.35603052  1
  O  O114  1  -0.00079669  0.93842770  0.63342816  1
  O  O115  1  0.49920643  0.56158170  0.86658139  1
  O  O116  1  1.00079383  0.06157485  0.36657377  1
  O  O117  1  0.50081079  0.43833173  0.13338670  1
  O  O118  1  0.90191339  0.41235821  0.64509126  1
  O  O119  1  0.40191613  0.08762154  0.85491476  1
  O  O120  1  0.09808583  0.58764150  0.35490994  1
  O  O121  1  0.59807240  0.91239017  0.14508300  1
  O  O122  1  0.04398207  0.66485104  0.67792280  1
  O  O123  1  0.54400186  0.83515160  0.82207809  1
  O  O124  1  0.95601781  0.33515377  0.32207636  1
  O  O125  1  0.45600042  0.16485414  0.17793010  1
  O  O126  1  0.28975156  0.85276727  0.71093702  1
  O  O127  1  0.78973219  0.64720444  0.78906265  1
  O  O128  1  0.71024528  0.14723248  0.28905954  1
  O  O129  1  0.21027806  0.35280521  0.21093971  1
  O  O130  1  0.03331994  0.51535631  0.82899685  1
  O  O131  1  0.53332999  0.98464447  0.67100163  1
  O  O132  1  0.96669044  0.48464094  0.17100619  1
  O  O133  1  0.46666903  0.01535454  0.32899677  1
