# generated using pymatgen
data_Mn2VCrH28(C7N8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11981358
_cell_length_b   10.13971745
_cell_length_c   12.55955644
_cell_angle_alpha   90.04337452
_cell_angle_beta   89.97461567
_cell_angle_gamma   106.45825431
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2VCrH28(C7N8)4
_chemical_formula_sum   'Mn2 V1 Cr1 H28 C28 N32'
_cell_volume   991.69162545
_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
  V  V0  1  0.15595187  0.12646113  0.55275985  1
  Cr  Cr1  1  0.34798237  0.87169054  0.05285468  1
  Mn  Mn2  1  0.83718842  0.86713442  0.44487810  1
  Mn  Mn3  1  0.66429454  0.13090432  0.94741706  1
  H  H4  1  0.11097654  0.44918578  0.58170619  1
  H  H5  1  0.38553974  0.54988801  0.08244211  1
  H  H6  1  0.88440036  0.55043431  0.41882430  1
  H  H7  1  0.61400676  0.44840048  0.92001901  1
  H  H8  1  0.18478821  0.64815409  0.46152943  1
  H  H9  1  0.31315563  0.35209856  0.96151640  1
  H  H10  1  0.81246585  0.35049447  0.53837452  1
  H  H11  1  0.68619390  0.64887622  0.04008891  1
  H  H12  1  0.38593267  0.65265306  0.30599058  1
  H  H13  1  0.11284032  0.34794828  0.80562273  1
  H  H14  1  0.61251138  0.34564378  0.69517639  1
  H  H15  1  0.88902202  0.65492478  0.19498069  1
  H  H16  1  0.49976448  0.44839627  0.27989344  1
  H  H17  1  1.00070709  0.55274486  0.77925495  1
  H  H18  1  0.49990929  0.55060113  0.72226549  1
  H  H19  1  0.00184008  0.45044447  0.22183621  1
  H  H20  1  0.52652418  0.22956916  0.34806034  1
  H  H21  1  0.97239401  0.77092126  0.84820922  1
  H  H22  1  0.47146175  0.76734095  0.65426097  1
  H  H23  1  0.03019278  0.23350486  0.15424354  1
  H  H24  1  0.49503836  0.00041265  0.37764448  1
  H  H25  1  1.00556197  1.00040067  0.87777688  1
  H  H26  1  0.50148077  0.99753591  0.62303952  1
  H  H27  1  0.00009130  0.00230127  0.12312508  1
  H  H28  1  0.32863228  0.89937980  0.46042908  1
  H  H29  1  0.17198114  0.10115133  0.96068460  1
  H  H30  1  0.66744373  0.09757857  0.53978904  1
  H  H31  1  0.83408623  0.90218031  0.03975829  1
  C  C32  1  0.19040150  0.44746617  0.51174593  1
  C  C33  1  0.30569321  0.55209652  0.01284650  1
  C  C34  1  0.80590454  0.55110241  0.48927151  1
  C  C35  1  0.69321631  0.44812930  0.99014592  1
  C  C36  1  0.23605917  0.56186560  0.44502376  1
  C  C37  1  0.26142258  0.43816518  0.94541681  1
  C  C38  1  0.76147464  0.43655904  0.55608700  1
  C  C39  1  0.73776338  0.56286919  0.05683937  1
  C  C40  1  0.34759731  0.56431597  0.35910785  1
  C  C41  1  0.15055666  0.43589531  0.85923483  1
  C  C42  1  0.65074500  0.43409368  0.64224300  1
  C  C43  1  0.84968246  0.56605228  0.14245757  1
  C  C44  1  0.41177159  0.45308118  0.34431988  1
  C  C45  1  0.08637170  0.54720653  0.84476606  1
  C  C46  1  0.58699507  0.54559981  0.65736911  1
  C  C47  1  0.91392156  0.45480043  0.15733530  1
  C  C48  1  0.35775566  0.33912713  0.41325548  1
  C  C49  1  0.13883773  0.66043899  0.91458068  1
  C  C50  1  0.64009307  0.65913663  0.58819295  1
  C  C51  1  0.86056765  0.34095014  0.08837970  1
  C  C52  1  0.42079636  0.22149486  0.40424957  1
  C  C53  1  0.07783589  0.77932456  0.90470034  1
  C  C54  1  0.57680776  0.77707554  0.59734897  1
  C  C55  1  0.92449693  0.22332486  0.09760499  1
  C  C56  1  0.43213782  -0.00411365  0.45574037  1
  C  C57  1  0.06903311  1.00451507  0.95563602  1
  C  C58  1  0.56414690  1.00118850  0.54498355  1
  C  C59  1  0.93720135  -0.00134024  0.04519451  1
  N  N60  1  0.24165112  0.33352673  0.49420704  1
  N  N61  1  0.25208435  0.66513285  0.99687733  1
  N  N62  1  0.75494608  0.66473232  0.50709582  1
  N  N63  1  0.74536585  0.33497045  0.00748436  1
  N  N64  1  0.35396756  0.11020404  0.46056495  1
  N  N65  1  0.14772856  0.89051389  0.95972163  1
  N  N66  1  0.64252574  0.88713317  0.54086081  1
  N  N67  1  0.85879772  0.11245723  0.04191572  1
  N  N68  1  0.04281886  0.92173717  0.57611572  1
  N  N69  1  0.46229850  0.07698409  0.07856633  1
  N  N70  1  0.98125609  0.08977497  0.42709190  1
  N  N71  1  0.51708442  0.90894920  0.92834468  1
  N  N72  1  0.10135374  0.83661302  0.61780818  1
  N  N73  1  0.40099685  0.16170471  0.11807704  1
  N  N74  1  0.91695711  0.17311961  0.38784465  1
  N  N75  1  0.58239184  0.82683884  0.88816561  1
  N  N76  1  0.15716529  0.75234619  0.65276929  1
  N  N77  1  0.34257198  0.24586200  0.15091856  1
  N  N78  1  0.84733864  0.24858382  0.35250743  1
  N  N79  1  0.65294034  0.75207637  0.85224175  1
  N  N80  1  0.97692559  0.19566788  0.64741028  1
  N  N81  1  0.53301953  0.80701017  0.14578996  1
  N  N82  1  0.04662901  0.80888105  0.34614943  1
  N  N83  1  0.44959101  0.19214535  0.84528087  1
  N  N84  1  0.88277240  0.15596732  0.72116319  1
  N  N85  1  0.62179317  0.84680243  0.22141240  1
  N  N86  1  0.12763064  0.83788396  0.26717332  1
  N  N87  1  0.36838424  0.16127908  0.76698471  1
  N  N88  1  0.78707539  0.12207597  0.79273674  1
  N  N89  1  0.71530709  0.88259333  0.29388192  1
  N  N90  1  0.20761631  0.85837162  0.18719389  1
  N  N91  1  0.28737504  0.13830077  0.68712771  1
