# generated using pymatgen
data_Mn2CrCoH28(C7N8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11780995
_cell_length_b   10.13586833
_cell_length_c   12.55692284
_cell_angle_alpha   90.03353143
_cell_angle_beta   89.98214232
_cell_angle_gamma   106.44410942
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2CrCoH28(C7N8)4
_chemical_formula_sum   'Mn2 Cr1 Co1 H28 C28 N32'
_cell_volume   990.93510643
_cell_formula_units_Z   1
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  0.14715415  0.12325521  0.54919896  1
  Mn  Mn1  1  0.33936220  0.86637631  0.05440617  1
  Mn  Mn2  1  0.84096970  0.86660354  0.44831678  1
  Cr  Cr3  1  0.65290434  0.12856600  0.94387971  1
  H  H4  1  0.11240911  0.44877058  0.58050014  1
  H  H5  1  0.38391125  0.54989090  0.08045177  1
  H  H6  1  0.88477794  0.55081460  0.41902275  1
  H  H7  1  0.61261004  0.45027980  0.91906536  1
  H  H8  1  0.18574110  0.64773908  0.46133852  1
  H  H9  1  0.31157871  0.34963770  0.95991482  1
  H  H10  1  0.81159567  0.35025419  0.53912605  1
  H  H11  1  0.68573963  0.64823066  0.03986173  1
  H  H12  1  0.38725955  0.65272823  0.30508749  1
  H  H13  1  0.11114596  0.34507633  0.80393958  1
  H  H14  1  0.61114292  0.34563591  0.69504732  1
  H  H15  1  0.88844128  0.65256909  0.19521498  1
  H  H16  1  0.50115614  0.44842426  0.27932448  1
  H  H17  1  0.99846178  0.54997062  0.77751988  1
  H  H18  1  0.49814636  0.55041772  0.72165846  1
  H  H19  1  0.00076992  0.44812484  0.22071584  1
  H  H20  1  0.52726176  0.23118283  0.34764848  1
  H  H21  1  0.97350252  0.76799846  0.84439311  1
  H  H22  1  0.47115967  0.76799729  0.65355778  1
  H  H23  1  0.02487917  0.22865611  0.15354063  1
  H  H24  1  0.49763195  0.00343676  0.37739065  1
  H  H25  1  1.00108895  0.99737298  0.87718426  1
  H  H26  1  0.50156574  0.99791563  0.62242950  1
  H  H27  1  -0.00243830  0.00259837  0.12236528  1
  H  H28  1  0.33060306  0.90143273  0.45958372  1
  H  H29  1  0.16811781  0.09719044  0.95964694  1
  H  H30  1  0.66916232  0.09800372  0.54022003  1
  H  H31  1  0.83070472  0.89998972  0.04080759  1
  C  C32  1  0.19264724  0.44683983  0.51109595  1
  C  C33  1  0.30499321  0.55037684  0.01023168  1
  C  C34  1  0.80584367  0.55123226  0.48926142  1
  C  C35  1  0.69385696  0.44851482  0.98808287  1
  C  C36  1  0.23753516  0.56181874  0.44453695  1
  C  C37  1  0.26041092  0.43589110  0.94320801  1
  C  C38  1  0.76063682  0.43664548  0.55598742  1
  C  C39  1  0.73825308  0.56242929  0.05557622  1
  C  C40  1  0.34899683  0.56471757  0.35863301  1
  C  C41  1  0.14953942  0.43348117  0.85709242  1
  C  C42  1  0.64954027  0.43411174  0.64206042  1
  C  C43  1  0.84994794  0.56481543  0.14138352  1
  C  C44  1  0.41363146  0.45356685  0.34394708  1
  C  C45  1  0.08591156  0.54511849  0.84220025  1
  C  C46  1  0.58563824  0.54557561  0.65695943  1
  C  C47  1  0.91405756  0.45331047  0.15568089  1
  C  C48  1  0.36013364  0.34007557  0.41345635  1
  C  C49  1  0.13925397  0.65854880  0.91163514  1
  C  C50  1  0.63910968  0.65913600  0.58779576  1
  C  C51  1  0.86122498  0.34015346  0.08578241  1
  C  C52  1  0.42235964  0.22121661  0.40454053  1
  C  C53  1  0.07685165  0.77697251  0.90253262  1
  C  C54  1  0.57614717  0.77726585  0.59655295  1
  C  C55  1  0.92153354  0.22084597  0.09556055  1
  C  C56  1  0.43355391  -0.00202354  0.45524642  1
  C  C57  1  0.06446728  1.00089679  0.95503894  1
  C  C58  1  0.56518410  1.00187516  0.54462492  1
  C  C59  1  0.93319158  -0.00293063  0.04462514  1
  N  N60  1  0.24621372  0.33457871  0.49449709  1
  N  N61  1  0.25364680  0.66395563  0.99280896  1
  N  N62  1  0.75446105  0.66493141  0.50701870  1
  N  N63  1  0.74876570  0.33600137  0.00319673  1
  N  N64  1  0.35439707  0.11161302  0.46045786  1
  N  N65  1  0.14197809  0.88626761  0.96004563  1
  N  N66  1  0.64240280  0.88687013  0.53966986  1
  N  N67  1  0.85361033  0.11076373  0.03884333  1
  N  N68  1  0.02920653  0.92186358  0.57693112  1
  N  N69  1  0.48316279  0.09176469  0.06937720  1
  N  N70  1  0.97269292  0.08255025  0.42690893  1
  N  N71  1  0.53508449  0.92162687  0.92213339  1
  N  N72  1  0.09697190  0.84048595  0.61505863  1
  N  N73  1  0.41852403  0.17342977  0.11081096  1
  N  N74  1  0.91502587  0.17051595  0.38949877  1
  N  N75  1  0.59721292  0.83692891  0.88305281  1
  N  N76  1  0.15791449  0.75712923  0.64751607  1
  N  N77  1  0.34893761  0.24840016  0.14770240  1
  N  N78  1  0.85082414  0.25031370  0.35423863  1
  N  N79  1  0.65508104  0.75209526  0.85087117  1
  N  N80  1  0.95972271  0.19290056  0.65203807  1
  N  N81  1  0.53042559  0.80168257  0.14914680  1
  N  N82  1  0.03183550  0.80337060  0.35165869  1
  N  N83  1  0.46919306  0.19311231  0.85212085  1
  N  N84  1  0.87700510  0.15897969  0.72978193  1
  N  N85  1  0.62065566  0.84101460  0.22409693  1
  N  N86  1  0.12086829  0.84239767  0.27624910  1
  N  N87  1  0.37949227  0.15510268  0.77599928  1
  N  N88  1  0.79376713  0.13574315  0.80876524  1
  N  N89  1  0.71676054  0.88232065  0.29498144  1
  N  N90  1  0.21582981  0.88346914  0.20469658  1
  N  N91  1  0.28536846  0.12021787  0.70415160  1
