# generated using pymatgen
data_MnCoH28C32(NO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.91284022
_cell_length_b   11.65715293
_cell_length_c   12.32844692
_cell_angle_alpha   118.30097146
_cell_angle_beta   100.12656756
_cell_angle_gamma   89.87721338
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCoH28C32(NO3)4
_chemical_formula_sum   'Mn1 Co1 H28 C32 N4 O12'
_cell_volume   981.32702659
_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
  Mn  Mn0  1  1.00000101  0.99999908  0.49999877  1
  Co  Co1  1  0.50001082  0.50000060  0.50001112  1
  H  H2  1  0.84466549  0.90898807  0.62987521  1
  H  H3  1  0.65549152  0.28473082  0.37566130  1
  H  H4  1  0.15533497  0.09101284  0.37012372  1
  H  H5  1  0.34450470  0.71527079  0.62433416  1
  H  H6  1  0.02546561  0.84515106  0.62483415  1
  H  H7  1  0.47502429  0.22706251  0.38212884  1
  H  H8  1  0.97453359  0.15484956  0.37516450  1
  H  H9  1  0.52497541  0.77294085  0.61786956  1
  H  H10  1  0.76296478  0.93769738  0.25014632  1
  H  H11  1  0.73336785  0.68992996  0.74809254  1
  H  H12  1  0.23703282  0.06230243  0.74985123  1
  H  H13  1  0.26663237  0.31007259  0.25191590  1
  H  H14  1  0.57468952  0.74881096  0.07482420  1
  H  H15  1  0.92071766  0.67725169  0.92391881  1
  H  H16  1  0.42530925  0.25118847  0.92517188  1
  H  H17  1  0.07928247  0.32274774  0.07608889  1
  H  H18  1  0.79626055  0.51189107  0.24050114  1
  H  H19  1  0.70421272  0.27452693  0.75824706  1
  H  H20  1  0.20373355  0.48810878  0.75949698  1
  H  H21  1  0.29579076  0.72547120  0.24175542  1
  H  H22  1  0.98626117  0.70886891  0.40133101  1
  H  H23  1  0.51241335  0.30979036  0.59736294  1
  H  H24  1  0.01373316  0.29113042  0.59866716  1
  H  H25  1  0.48759073  0.69020749  0.40263821  1
  H  H26  1  0.56958920  0.40938468  0.05392892  1
  H  H27  1  0.92962085  0.35605540  0.94225273  1
  H  H28  1  0.43040668  0.59061515  0.94606786  1
  H  H29  1  0.07038055  0.64394257  0.05775094  1
  C  C30  1  0.76476972  0.84144674  0.24420979  1
  C  C31  1  0.73161677  0.59956001  0.75371176  1
  C  C32  1  0.23522676  0.15855272  0.75578788  1
  C  C33  1  0.26838569  0.40044201  0.24629565  1
  C  C34  1  0.66013650  0.73531769  0.14672198  1
  C  C35  1  0.83643063  0.59140890  0.85160475  1
  C  C36  1  0.33986102  0.26468166  0.85327491  1
  C  C37  1  0.16357103  0.40859070  0.14840157  1
  C  C38  1  0.66670481  0.61261524  0.14355190  1
  C  C39  1  0.83216794  0.47200555  0.85507724  1
  C  C40  1  0.33329149  0.38738433  0.85644510  1
  C  C41  1  0.16783419  0.52799313  0.14492705  1
  C  C42  1  0.78568967  0.60412569  0.23848791  1
  C  C43  1  0.71385497  0.36859959  0.75991429  1
  C  C44  1  0.21430523  0.39587372  0.76150949  1
  C  C45  1  0.28614816  0.63139903  0.24008886  1
  C  C46  1  0.88846698  0.71458431  0.33035180  1
  C  C47  1  0.61004473  0.38672597  0.66791607  1
  C  C48  1  0.11152776  0.28541468  0.66964622  1
  C  C49  1  0.38995915  0.61327183  0.33208685  1
  C  C50  1  0.61996640  0.04401514  0.50988916  1
  C  C51  1  0.87881151  0.53453586  0.49397998  1
  C  C52  1  0.38003473  0.95598580  0.49011011  1
  C  C53  1  0.12118763  0.46546477  0.50601870  1
  C  C54  1  0.55698248  0.95481557  0.55084897  1
  C  C55  1  0.94319949  0.40439114  0.45070292  1
  C  C56  1  0.44301773  0.04518571  0.44915037  1
  C  C57  1  0.05679995  0.59560948  0.54929727  1
  C  C58  1  0.55800293  0.49940971  0.04749047  1
  C  C59  1  0.94157044  0.45355897  0.95113434  1
  C  C60  1  0.44199369  0.50059023  0.95250644  1
  C  C61  1  0.05843128  0.54643919  0.04886988  1
  N  N62  1  0.87291390  0.83240837  0.33691394  1
  N  N63  1  0.62330150  0.49775407  0.66038036  1
  N  N64  1  0.12708034  0.16759144  0.66308466  1
  N  N65  1  0.37670337  0.50224602  0.33962587  1
  O  O66  1  0.96763514  0.92149099  0.62622859  1
  O  O67  1  0.53278420  0.30178474  0.38056283  1
  O  O68  1  0.03236432  0.07850876  0.37376871  1
  O  O69  1  0.46721014  0.69821547  0.61942704  1
  O  O70  1  0.76341566  0.09872347  0.52133378  1
  O  O71  1  0.73476828  0.57739614  0.48296189  1
  O  O72  1  0.23658596  0.90127510  0.47866372  1
  O  O73  1  0.26523168  0.42260179  0.51702906  1
  O  O74  1  0.62719186  0.89798474  0.60961842  1
  O  O75  1  0.87124059  0.28922182  0.39058997  1
  O  O76  1  0.37280888  0.10201859  0.39038297  1
  O  O77  1  0.12875840  0.71077875  0.60941047  1
