# generated using pymatgen
data_Mn2CoNi2H32C12(NO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.34987444
_cell_length_b   9.70360008
_cell_length_c   13.64580304
_cell_angle_alpha   103.39546909
_cell_angle_beta   90.00000519
_cell_angle_gamma   90.00013872
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2CoNi2H32C12(NO2)6
_chemical_formula_sum   'Mn4 Co2 Ni4 H64 C24 N12 O24'
_cell_volume   1204.36670250
_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
  Mn  Mn0  1  0.09694402  0.85503460  0.73059740  1
  Mn  Mn1  1  0.59695990  0.64502878  0.76942237  1
  Mn  Mn2  1  0.90300549  0.14500441  0.26938974  1
  Mn  Mn3  1  0.40301341  0.35506887  0.23063885  1
  Ni  Ni4  1  0.94348712  0.54913336  0.73081819  1
  Ni  Ni5  1  0.44347135  0.95087870  0.76918593  1
  Ni  Ni6  1  0.05651760  0.45088769  0.26917697  1
  Ni  Ni7  1  0.55650214  0.04913875  0.23082600  1
  Co  Co8  1  0.00022941  0.99974795  1.00036423  1
  Co  Co9  1  0.50013102  0.50003872  0.50023934  1
  H  H10  1  0.18975641  0.18982768  0.08868262  1
  H  H11  1  0.68965288  0.31019724  0.41132670  1
  H  H12  1  0.81040884  0.81022176  0.91133891  1
  H  H13  1  0.31031084  0.68980317  0.58867144  1
  H  H14  1  0.27692793  0.09552061  0.98630628  1
  H  H15  1  0.77693448  0.40444420  0.51369235  1
  H  H16  1  0.72317520  0.90453878  0.01371272  1
  H  H17  1  0.22319453  0.59542486  0.48628835  1
  H  H18  1  0.58653164  0.38240083  0.86825608  1
  H  H19  1  0.08654606  0.11759503  0.63172254  1
  H  H20  1  0.41343958  0.61760604  0.13171689  1
  H  H21  1  0.91344630  0.88239882  0.36826296  1
  H  H22  1  0.46949322  0.16582623  0.89319803  1
  H  H23  1  -0.03050205  0.33417366  0.60680849  1
  H  H24  1  0.53051228  0.83419726  0.10679378  1
  H  H25  1  1.03052230  0.66582519  0.39320634  1
  H  H26  1  0.76315151  0.02933470  0.85446584  1
  H  H27  1  0.26316618  0.47065843  0.64553367  1
  H  H28  1  0.23682975  0.97067565  0.14554050  1
  H  H29  1  0.73684219  0.52932101  0.35444854  1
  H  H30  1  0.91563102  0.08945192  0.79964502  1
  H  H31  1  0.41565267  0.41054854  0.70035136  1
  H  H32  1  0.08433203  0.91055979  0.20035340  1
  H  H33  1  0.58435529  0.58944325  0.29963465  1
  H  H34  1  0.20911288  0.32922283  0.97071834  1
  H  H35  1  0.70914609  0.17072031  0.52927890  1
  H  H36  1  0.79082450  0.67072476  0.02928463  1
  H  H37  1  0.29084907  0.82922869  0.47072001  1
  H  H38  1  0.16887329  0.18008531  0.87356221  1
  H  H39  1  0.66890780  0.31986601  0.62644334  1
  H  H40  1  0.83107814  0.81985512  0.12644737  1
  H  H41  1  0.33109607  0.68010409  0.37356143  1
  H  H42  1  0.58310472  0.36513296  0.04398185  1
  H  H43  1  0.08312629  0.13487359  0.45600542  1
  H  H44  1  0.41686617  0.63488116  0.95599808  1
  H  H45  1  0.91687899  0.86512268  0.54398761  1
  H  H46  1  0.73990560  0.44126641  0.00888009  1
  H  H47  1  0.23991476  0.05872781  0.49110659  1
  H  H48  1  0.26007090  0.55873575  0.99110282  1
  H  H49  1  0.76007302  0.94125734  0.50888209  1
  H  H50  1  0.79877550  0.26355110  0.10333621  1
  H  H51  1  0.29877934  0.23644700  0.39663574  1
  H  H52  1  0.20120624  0.73644944  0.89662595  1
  H  H53  1  0.70121183  0.76354216  0.60334626  1
  H  H54  1  0.69475869  0.13227058  0.02395595  1
  H  H55  1  0.19476233  0.36772303  0.47602203  1
  H  H56  1  0.30523549  0.86772868  0.97600074  1
  H  H57  1  0.80523833  0.63226376  0.52397203  1
  H  H58  1  0.81138938  0.31593111  0.79901073  1
  H  H59  1  0.31140229  0.18405293  0.70097333  1
  H  H60  1  0.18859484  0.68406162  0.20097662  1
  H  H61  1  0.68860220  0.81593048  0.29900569  1
  H  H62  1  0.68615226  0.18013985  0.74928453  1
  H  H63  1  0.18617258  0.31985850  0.75069773  1
  H  H64  1  0.31382718  0.81987181  0.25069639  1
  H  H65  1  0.81383751  0.68012917  0.24928445  1
  H  H66  1  0.97074643  0.42291685  0.10374687  1
  H  H67  1  0.47073802  0.07706559  0.39625591  1
  H  H68  1  0.02925546  0.57707579  0.89625406  1
  H  H69  1  0.52925006  0.92290105  0.60375205  1
  H  H70  1  0.96765094  0.37338442  0.92954654  1
  H  H71  1  0.46760997  0.12660394  0.57044485  1
  H  H72  1  0.03241975  0.62659931  0.07044931  1
  H  H73  1  0.53238341  0.87338299  0.42954067  1
  C  C74  1  0.82803100  0.12267135  0.85325717  1
  C  C75  1  0.32805326  0.37732272  0.64673103  1
  C  C76  1  0.17194141  0.87733859  0.14673517  1
  C  C77  1  0.67196105  0.62266099  0.35324822  1
  C  C78  1  0.14195095  0.23353412  0.95182424  1
  C  C79  1  0.64197264  0.26640300  0.54818415  1
  C  C80  1  0.85802895  0.76638836  0.04819247  1
  C  C81  1  0.35804375  0.73355983  0.45181695  1
  C  C82  1  0.67709901  0.34187663  0.99450572  1
  C  C83  1  0.17712086  0.15812433  0.50547939  1
  C  C84  1  0.32286948  0.65813068  0.00547423  1
  C  C85  1  0.82288193  0.84186894  0.49450917  1
  C  C86  1  0.76109406  0.22559531  0.02621252  1
  C  C87  1  0.26110641  0.27440387  0.47376051  1
  C  C88  1  0.23889549  0.77440925  0.97374670  1
  C  C89  1  0.73890084  0.72558556  0.52622358  1
  C  C90  1  0.74070760  0.23483063  0.81860013  1
  C  C91  1  0.24072716  0.26515663  0.68138299  1
  C  C92  1  0.25926600  0.76516617  0.18138366  1
  C  C93  1  0.75927938  0.73482896  0.31859712  1
  C  C94  1  0.99174685  0.27746985  0.95835421  1
  C  C95  1  0.49176408  0.22247946  0.54161877  1
  C  C96  1  0.00823621  0.72245365  0.04161026  1
  C  C97  1  0.50824725  0.77749484  0.45835895  1
  N  N98  1  0.88443458  0.17660012  0.95755626  1
  N  N99  1  0.38447644  0.32341099  0.54241771  1
  N  N100  1  0.11551787  0.82341785  0.04241389  1
  N  N101  1  0.61554613  0.67658899  0.45755749  1
  N  N102  1  0.17739782  0.13450335  0.01487553  1
  N  N103  1  0.67738708  0.36547383  0.48515365  1
  N  N104  1  0.82268576  0.86548240  0.98516948  1
  N  N105  1  0.32268475  0.63450196  0.51486037  1
  N  N106  1  0.63144950  0.29748280  0.89072064  1
  N  N107  1  0.13146481  0.20252022  0.60926318  1
  N  N108  1  0.36852427  0.70253228  0.10925937  1
  N  N109  1  0.86853389  0.79747552  0.39072247  1
  O  O110  1  0.05666267  0.89762086  0.85522452  1
  O  O111  1  0.55664158  0.60263360  0.64473536  1
  O  O112  1  0.94319915  0.10257315  0.14467076  1
  O  O113  1  0.44314939  0.39766646  0.35529508  1
  O  O114  1  0.01947482  0.97000045  0.67294662  1
  O  O115  1  0.51943657  0.52995008  0.82694644  1
  O  O116  1  0.98055716  0.02991235  0.32688766  1
  O  O117  1  0.48052275  0.47005750  0.17302775  1
  O  O118  1  0.89016179  0.40315588  0.61852562  1
  O  O119  1  0.39014245  0.09685992  0.88147446  1
  O  O120  1  0.10986223  0.59684899  0.38146812  1
  O  O121  1  0.60984238  0.90318415  0.11852914  1
  O  O122  1  0.04136219  0.68879591  0.67445889  1
  O  O123  1  0.54134734  0.81124573  0.82559161  1
  O  O124  1  0.95864865  0.31121552  0.32554492  1
  O  O125  1  0.45862954  0.18884028  0.17450897  1
  O  O126  1  0.27626735  0.84656002  0.70835854  1
  O  O127  1  0.77628736  0.65346974  0.79164818  1
  O  O128  1  0.72368919  0.15346626  0.29168434  1
  O  O129  1  0.22370564  0.34657744  0.20831817  1
  O  O130  1  0.03265570  0.49236510  0.84103168  1
  O  O131  1  0.53264190  1.00762636  0.65896151  1
  O  O132  1  0.96734154  0.50764124  0.15895951  1
  O  O133  1  0.46733550  -0.00764528  0.34103230  1
