# generated using pymatgen
data_Mn2CrCoH28(C7N8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11690035
_cell_length_b   10.13725944
_cell_length_c   12.55318873
_cell_angle_alpha   90.02086914
_cell_angle_beta   90.02077073
_cell_angle_gamma   106.45288956
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2CrCoH28(C7N8)4
_chemical_formula_sum   'Mn2 Cr1 Co1 H28 C28 N32'
_cell_volume   990.62055128
_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
  Cr  Cr0  1  0.14953323  0.12576551  0.55196033  1
  Mn  Mn1  1  0.34289171  0.86579898  0.05573495  1
  Co  Co2  1  0.84314834  0.87196541  0.43993996  1
  Mn  Mn3  1  0.65624351  0.13214836  0.94880689  1
  H  H4  1  0.11206305  0.44768221  0.58258031  1
  H  H5  1  0.38531698  0.55014242  0.08187634  1
  H  H6  1  0.88637843  0.55065858  0.41742524  1
  H  H7  1  0.61355872  0.44813057  0.91931617  1
  H  H8  1  0.18471439  0.64629305  0.46289002  1
  H  H9  1  0.31190053  0.35031517  0.96097293  1
  H  H10  1  0.81417524  0.35197118  0.53731927  1
  H  H11  1  0.68666151  0.64870402  0.03940608  1
  H  H12  1  0.38525592  0.65081781  0.30609258  1
  H  H13  1  0.11111347  0.34609274  0.80551447  1
  H  H14  1  0.61273991  0.34758059  0.69337202  1
  H  H15  1  0.88939298  0.65465293  0.19451673  1
  H  H16  1  0.49843689  0.44686836  0.27978161  1
  H  H17  1  1.00095018  0.55225788  0.77822478  1
  H  H18  1  0.50302104  0.55396159  0.72112439  1
  H  H19  1  0.00106563  0.44967568  0.22188101  1
  H  H20  1  0.52775326  0.22915757  0.34826903  1
  H  H21  1  0.97305079  0.76894243  0.84744836  1
  H  H22  1  0.47465296  0.76970386  0.65133734  1
  H  H23  1  0.02925451  0.23221684  0.15351962  1
  H  H24  1  0.49349554  -0.00111357  0.37598839  1
  H  H25  1  1.00712398  1.00035229  0.87836581  1
  H  H26  1  0.50755758  1.00041053  0.62134853  1
  H  H27  1  -0.00566919  -0.00011042  0.12354335  1
  H  H28  1  0.33074275  0.89777288  0.46101611  1
  H  H29  1  0.17221917  0.09795287  0.96349631  1
  H  H30  1  0.67075912  0.09932499  0.53524676  1
  H  H31  1  0.82898584  0.90182296  0.03855260  1
  C  C32  1  0.19196099  0.44580977  0.51286591  1
  C  C33  1  0.30668938  0.55120902  0.01155201  1
  C  C34  1  0.80691802  0.55244415  0.48724007  1
  C  C35  1  0.69260670  0.44778537  0.98957528  1
  C  C36  1  0.23623812  0.56021277  0.44600666  1
  C  C37  1  0.26125986  0.43686459  0.94440253  1
  C  C38  1  0.76282616  0.43803487  0.55448041  1
  C  C39  1  0.73795419  0.56258112  0.05620819  1
  C  C40  1  0.34735885  0.56296542  0.35982947  1
  C  C41  1  0.15041127  0.43481829  0.85829624  1
  C  C42  1  0.65211292  0.43617305  0.64056671  1
  C  C43  1  0.84971786  0.56560683  0.14205002  1
  C  C44  1  0.41177680  0.45177244  0.34496156  1
  C  C45  1  0.08748891  0.54678160  0.84332743  1
  C  C46  1  0.58901494  0.54803367  0.65584537  1
  C  C47  1  0.91352531  0.45408076  0.15708897  1
  C  C48  1  0.35926431  0.33810061  0.41424674  1
  C  C49  1  0.14091858  0.65989188  0.91301123  1
  C  C50  1  0.64187343  0.66093585  0.58578900  1
  C  C51  1  0.86007983  0.34032955  0.08801185  1
  C  C52  1  0.42130977  0.21955950  0.40436909  1
  C  C53  1  0.07811653  0.77814752  0.90444629  1
  C  C54  1  0.57966254  0.78000398  0.59447777  1
  C  C55  1  0.92355854  0.22232453  0.09684027  1
  C  C56  1  0.43237767  -0.00496097  0.45456678  1
  C  C57  1  0.06788389  1.00233177  0.95694643  1
  C  C58  1  0.56783983  1.00299252  0.54252493  1
  C  C59  1  0.93348748  -0.00264105  0.04494106  1
  N  N60  1  0.24523621  0.33279864  0.49615378  1
  N  N61  1  0.25554824  0.66509238  0.99432805  1
  N  N62  1  0.75330512  0.66458475  0.50382906  1
  N  N63  1  0.74427931  0.33419791  0.00721449  1
  N  N64  1  0.35219623  0.10817304  0.45912496  1
  N  N65  1  0.14481149  0.88722599  0.96184481  1
  N  N66  1  0.64647763  0.88926206  0.53814965  1
  N  N67  1  0.85674608  0.11247300  0.04036024  1
  N  N68  1  0.02744750  0.92298612  0.57633801  1
  N  N69  1  0.46398294  0.08353568  0.07672437  1
  N  N70  1  0.98699994  0.09017628  0.42665084  1
  N  N71  1  0.53632859  0.91551910  0.92742420  1
  N  N72  1  0.08615488  0.83483558  0.61265861  1
  N  N73  1  0.40222737  0.16717903  0.11718162  1
  N  N74  1  0.91393242  0.16697085  0.38645127  1
  N  N75  1  0.59703202  0.83242093  0.88519961  1
  N  N76  1  0.15049814  0.75373947  0.64486772  1
  N  N77  1  0.34123671  0.24962676  0.15101712  1
  N  N78  1  0.83944484  0.23994669  0.35182543  1
  N  N79  1  0.65832349  0.75114088  0.84955816  1
  N  N80  1  0.96105611  0.18846996  0.64333673  1
  N  N81  1  0.53651666  0.80544487  0.15867792  1
  N  N82  1  0.03031095  0.80795807  0.35414324  1
  N  N83  1  0.45419879  0.18928353  0.84481357  1
  N  N84  1  0.87997885  0.15559070  0.72303217  1
  N  N85  1  0.62778839  0.84289900  0.23347756  1
  N  N86  1  0.11544903  0.84290429  0.27681779  1
  N  N87  1  0.37360720  0.16095931  0.76546457  1
  N  N88  1  0.79380554  0.12706082  0.79933673  1
  N  N89  1  0.72362940  0.88140864  0.30466511  1
  N  N90  1  0.20621120  0.87424781  0.20215219  1
  N  N91  1  0.29252511  0.14179850  0.68585670  1
