# generated using pymatgen
data_V2CrH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.86700951
_cell_length_b   10.86482251
_cell_length_c   10.85881938
_cell_angle_alpha   89.22220222
_cell_angle_beta   88.98053243
_cell_angle_gamma   63.75343954
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2CrH8C14(NO)6
_chemical_formula_sum   'V4 Cr2 H16 C28 N12 O12'
_cell_volume   1149.69178774
_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
  V  V0  1  0.91110910  0.09105043  0.25097670  1
  V  V1  1  0.08888912  0.90895278  0.74902151  1
  Cr  Cr2  1  0.85424402  0.98582884  -0.00440870  1
  V  V3  1  0.01408162  0.14611746  0.50137792  1
  Cr  Cr4  1  0.14575880  0.01416881  1.00440772  1
  V  V5  1  0.98591409  0.85388892  0.49862303  1
  H  H6  1  0.53909949  0.16921687  0.41318834  1
  H  H7  1  0.83001713  0.46457031  0.08655969  1
  H  H8  1  0.46090281  0.83077227  0.58681524  1
  H  H9  1  0.16998796  0.53543079  0.91343694  1
  H  H10  1  0.33689729  0.15652203  0.51269149  1
  H  H11  1  0.84256875  0.66826128  0.98940120  1
  H  H12  1  0.66309887  0.84347634  0.48730933  1
  H  H13  1  0.15743857  0.33173980  0.01059738  1
  H  H14  1  0.42489297  0.07429408  0.05772456  1
  H  H15  1  0.92887765  0.57340105  0.44253584  1
  H  H16  1  0.57511004  0.92570207  0.94227663  1
  H  H17  1  0.07111456  0.42660400  0.55746500  1
  H  H18  1  0.88679701  0.21033556  0.03900388  1
  H  H19  1  0.78443542  0.12571081  0.46479773  1
  H  H20  1  0.11320439  0.78966321  0.96099295  1
  H  H21  1  0.21556213  0.87429408  0.53520102  1
  C  C22  1  0.62826838  0.11505158  0.17445720  1
  C  C23  1  0.88291295  0.37620125  0.32487719  1
  C  C24  1  0.37173368  0.88494060  0.82554590  1
  C  C25  1  0.11708424  0.62380221  0.67512113  1
  C  C26  1  0.50015065  0.11704132  0.22907944  1
  C  C27  1  0.88312440  0.50237753  0.26989198  1
  C  C28  1  0.49985174  0.88295049  0.77092339  1
  C  C29  1  0.11687431  0.49762539  0.73010677  1
  C  C30  1  0.47150308  0.14348347  0.35714979  1
  C  C31  1  0.85624273  0.53214093  0.14249897  1
  C  C32  1  0.52849782  0.85650924  0.64285257  1
  C  C33  1  0.14375969  0.46786065  0.85749884  1
  C  C34  1  0.35827532  0.13802132  0.41454059  1
  C  C35  1  0.86205258  0.64599710  0.08724310  1
  C  C36  1  0.64172317  0.86197507  0.58546036  1
  C  C37  1  0.13795295  0.35400346  0.91275545  1
  C  C38  1  0.27104849  0.10701565  0.34166179  1
  C  C39  1  0.89464111  0.73144967  0.16201700  1
  C  C40  1  0.72894944  0.89298269  0.65833771  1
  C  C41  1  0.10536307  0.26855069  0.83798269  1
  C  C42  1  0.29528852  0.08483778  0.21466613  1
  C  C43  1  0.91731917  0.70503972  0.28858712  1
  C  C44  1  0.70471082  0.91516101  0.78533371  1
  C  C45  1  0.08267988  0.29496309  0.71141365  1
  C  C46  1  0.40894465  0.09036146  0.15630678  1
  C  C47  1  0.91171864  0.59112493  0.34434835  1
  C  C48  1  0.59105721  0.90963319  0.84369459  1
  C  C49  1  0.08827667  0.40887942  0.65565222  1
  N  N50  1  0.15369070  0.09309258  0.37051108  1
  N  N51  1  0.91259671  0.84662833  0.13523377  1
  N  N52  1  0.84630373  0.90691172  0.62948673  1
  N  N53  1  0.08741312  0.15336896  0.86476577  1
  N  N54  1  0.10927402  0.05675460  0.26591334  1
  N  N55  1  0.94701861  0.89124926  0.23894057  1
  N  N56  1  0.89072139  0.94325026  0.73408436  1
  N  N57  1  0.05298357  0.10875212  0.76105905  1
  N  N58  1  0.19138912  0.05897684  0.17024307  1
  N  N59  1  0.94523224  0.80790386  0.33503167  1
  N  N60  1  0.80860919  0.94102417  0.82975536  1
  N  N61  1  0.05476576  0.19209938  0.66496912  1
  O  O62  1  0.93717730  0.11328026  0.06181806  1
  O  O63  1  0.88222391  0.07348673  0.44410287  1
  O  O64  1  0.06282519  0.88671892  0.93817930  1
  O  O65  1  0.11777403  0.92651797  0.55589648  1
  O  O66  1  0.70232559  0.14619792  0.24601077  1
  O  O67  1  0.85317314  0.30007157  0.25394770  1
  O  O68  1  0.29767372  0.85380108  0.75399119  1
  O  O69  1  0.14682414  0.69993216  0.74605010  1
  O  O70  1  0.65977656  0.07993037  0.06100362  1
  O  O71  1  0.91460889  0.34867776  0.43874992  1
  O  O72  1  0.34022742  0.92005633  0.93900179  1
  O  O73  1  0.08538528  0.65132697  0.56124890  1
