# generated using pymatgen
data_Co3Ni2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.34722587
_cell_length_b   9.70053577
_cell_length_c   13.64610605
_cell_angle_alpha   103.56393809
_cell_angle_beta   90.00017041
_cell_angle_gamma   90.00032566
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co3Ni2H32C12(NO2)6
_chemical_formula_sum   'Co6 Ni4 H64 C24 N12 O24'
_cell_volume   1202.82398151
_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
  Ni  Ni0  1  0.10601334  0.83939446  0.74465850  1
  Ni  Ni1  1  0.60567690  0.66038164  0.75526768  1
  Ni  Ni2  1  0.89440143  0.16038069  0.25532434  1
  Ni  Ni3  1  0.39396340  0.33943048  0.24465808  1
  Co  Co4  1  0.94839646  0.55775981  0.73269278  1
  Co  Co5  1  0.44859193  0.94226964  0.76711593  1
  Co  Co6  1  0.05140696  0.44229907  0.26712749  1
  Co  Co7  1  0.55160915  0.05776599  0.23264754  1
  Co  Co8  1  -0.00109849  1.00127379  0.99967949  1
  Co  Co9  1  0.50096742  0.50122259  0.49969336  1
  H  H10  1  0.17814719  0.20088932  0.09541657  1
  H  H11  1  0.67818675  0.29974395  0.40446629  1
  H  H12  1  0.82182302  0.79972703  0.90448872  1
  H  H13  1  0.32184894  0.70094973  0.59540796  1
  H  H14  1  0.26794981  0.09591892  0.99968249  1
  H  H15  1  0.76853743  0.40389548  0.50014458  1
  H  H16  1  0.73144472  0.90388962  0.00018488  1
  H  H17  1  0.23203653  0.59598949  0.49965724  1
  H  H18  1  0.55469080  0.44697299  0.85877809  1
  H  H19  1  0.05478396  0.05325413  0.64138819  1
  H  H20  1  0.44519239  0.55326740  0.14147234  1
  H  H21  1  0.94544896  0.94715428  0.35889773  1
  H  H22  1  0.53443960  0.21366113  0.88527115  1
  H  H23  1  0.03366847  0.28629442  0.61454345  1
  H  H24  1  0.46616640  0.78631249  0.11460551  1
  H  H25  1  0.96558221  0.71367138  0.38529291  1
  H  H26  1  0.76727201  0.02729188  0.85522834  1
  H  H27  1  0.26705569  0.47221683  0.64453154  1
  H  H28  1  0.23288402  0.97233349  0.14457815  1
  H  H29  1  0.73274897  0.52731320  0.35526048  1
  H  H30  1  0.91991503  0.09452526  0.80603319  1
  H  H31  1  0.41942990  0.40497316  0.69407900  1
  H  H32  1  0.08048581  0.90513113  0.19410440  1
  H  H33  1  0.58010313  0.59452748  0.30606062  1
  H  H34  1  0.21387714  0.32163161  0.96258438  1
  H  H35  1  0.71394171  0.17890585  0.53712817  1
  H  H36  1  0.78608764  0.67887628  0.03713254  1
  H  H37  1  0.28619714  0.82171624  0.46259719  1
  H  H38  1  0.15045108  0.16815015  0.87593813  1
  H  H39  1  0.65023230  0.33232399  0.62391524  1
  H  H40  1  0.84976152  0.83228562  0.12393889  1
  H  H41  1  0.34956651  0.66823731  0.37593612  1
  H  H42  1  0.54629028  0.41762026  0.10466772  1
  H  H43  1  0.04630296  0.08283614  0.39585233  1
  H  H44  1  0.45382837  0.58269881  0.89570250  1
  H  H45  1  0.95369436  0.91749675  0.60466568  1
  H  H46  1  0.71988283  0.44124735  0.00489474  1
  H  H47  1  0.21996021  0.05850875  0.49522663  1
  H  H48  1  0.28021029  0.55852389  0.99522764  1
  H  H49  1  0.78002936  0.94124833  0.50486390  1
  H  H50  1  0.79463049  0.27340156  0.10450531  1
  H  H51  1  0.29457346  0.22617009  0.39568174  1
  H  H52  1  0.20537349  0.72627331  0.89568160  1
  H  H53  1  0.70538865  0.77342584  0.60451910  1
  H  H54  1  0.69109116  0.13355402  0.03240493  1
  H  H55  1  0.19140246  0.36627460  0.46771441  1
  H  H56  1  0.30856488  0.86631254  0.96777677  1
  H  H57  1  0.80893779  0.63356806  0.53245641  1
  H  H58  1  0.79536889  0.31705471  0.80380963  1
  H  H59  1  0.29471313  0.18245348  0.69599388  1
  H  H60  1  0.20517403  0.68261337  0.19610076  1
  H  H61  1  0.70462801  0.81707504  0.30384350  1
  H  H62  1  0.68475341  0.17113929  0.74819994  1
  H  H63  1  0.18420996  0.32865983  0.75196571  1
  H  H64  1  0.31569512  0.82874861  0.25195445  1
  H  H65  1  0.81520431  0.67114549  0.24819885  1
  H  H66  1  0.98082033  0.36016940  0.05060276  1
  H  H67  1  0.48119432  0.13977513  0.44931183  1
  H  H68  1  0.01886505  0.63982329  0.94935292  1
  H  H69  1  0.51922526  0.86021221  0.55063298  1
  H  H70  1  0.96742355  0.35864077  0.91800055  1
  H  H71  1  0.46847517  0.14077887  0.58187078  1
  H  H72  1  0.03158656  0.64081492  0.08189866  1
  H  H73  1  0.53266782  0.85863680  0.41800752  1
  C  C74  1  0.82933330  0.12387949  0.85687966  1
  C  C75  1  0.32904675  0.37563166  0.64308314  1
  C  C76  1  0.17087919  0.87573697  0.14311381  1
  C  C77  1  0.67067940  0.62389610  0.35690811  1
  C  C78  1  0.13782274  0.23283068  0.95286923  1
  C  C79  1  0.63784415  0.26767612  0.54695649  1
  C  C80  1  0.86216347  0.76766280  0.04697683  1
  C  C81  1  0.36221184  0.73288764  0.45287427  1
  C  C82  1  0.67435476  0.33367867  0.98930793  1
  C  C83  1  0.17452326  0.16620972  0.51084579  1
  C  C84  1  0.32555314  0.66621968  0.01086351  1
  C  C85  1  0.82561499  0.83370240  0.48931864  1
  C  C86  1  0.75519166  0.22696421  0.02850163  1
  C  C87  1  0.25574131  0.27292797  0.47174770  1
  C  C88  1  0.24433572  0.77294474  0.97174040  1
  C  C89  1  0.74478302  0.72694800  0.52851727  1
  C  C90  1  0.73355402  0.22808208  0.81929810  1
  C  C91  1  0.23281252  0.27163656  0.68076527  1
  C  C92  1  0.26705384  0.77171977  0.18078119  1
  C  C93  1  0.76646494  0.72810634  0.31932414  1
  C  C94  1  0.98797285  0.29286323  0.97250716  1
  C  C95  1  0.48824508  0.20699700  0.52745027  1
  C  C96  1  0.01178325  0.70703181  0.02748490  1
  C  C97  1  0.51207464  0.79288244  0.47252773  1
  N  N98  1  0.88121804  0.17623834  0.96200975  1
  N  N99  1  0.38133389  0.32333355  0.53822781  1
  N  N100  1  0.11867744  0.82334812  0.03825348  1
  N  N101  1  0.61877209  0.67621270  0.46203246  1
  N  N102  1  0.17030741  0.14103735  0.02145480  1
  N  N103  1  0.67052608  0.35962720  0.47843243  1
  N  N104  1  0.82945883  0.85962126  0.97845743  1
  N  N105  1  0.32968631  0.64109136  0.52144927  1
  N  N106  1  0.61946203  0.28694149  0.89250735  1
  N  N107  1  0.11900741  0.21306714  0.60741873  1
  N  N108  1  0.38092017  0.71304527  0.10744486  1
  N  N109  1  0.88054062  0.78695049  0.39254663  1
  O  O110  1  0.04672491  0.94644138  0.87518520  1
  O  O111  1  0.54584321  0.55270399  0.62503970  1
  O  O112  1  0.95408958  0.05275120  0.12504017  1
  O  O113  1  0.45324245  0.44645307  0.37518147  1
  O  O114  1  0.01010740  0.97090893  0.66260427  1
  O  O115  1  0.50990985  0.52916450  0.83777043  1
  O  O116  1  0.99022750  0.02931655  0.33790528  1
  O  O117  1  0.48985078  0.47094051  0.16256977  1
  O  O118  1  0.90259189  0.40890446  0.65106400  1
  O  O119  1  0.40294988  0.09107033  0.84887672  1
  O  O120  1  0.09709370  0.59108161  0.34888683  1
  O  O121  1  0.59728892  0.90889624  0.15099062  1
  O  O122  1  0.05428256  0.65453089  0.67087685  1
  O  O123  1  0.55435893  0.84542352  0.82893002  1
  O  O124  1  0.94557813  0.34548160  0.32892758  1
  O  O125  1  0.44579819  0.15461376  0.17084877  1
  O  O126  1  0.30527797  0.83695994  0.71813179  1
  O  O127  1  0.80511836  0.66311320  0.78170971  1
  O  O128  1  0.69495692  0.16299639  0.28166316  1
  O  O129  1  0.19467748  0.33691473  0.21816412  1
  O  O130  1  0.03575863  0.52336302  0.83060015  1
  O  O131  1  0.53575873  0.97689723  0.66919761  1
  O  O132  1  0.96428021  0.47694939  0.16920497  1
  O  O133  1  0.46422641  0.02339052  0.33055643  1
