# generated using pymatgen
data_VCr2H8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.85959550
_cell_length_b   10.84571078
_cell_length_c   10.89749318
_cell_angle_alpha   88.91930295
_cell_angle_beta   88.83240199
_cell_angle_gamma   63.77158629
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCr2H8C14(NO)6
_chemical_formula_sum   'V2 Cr4 H16 C28 N12 O12'
_cell_volume   1151.04776315
_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
  Cr  Cr0  1  0.90986861  0.08570572  0.24567208  1
  Cr  Cr1  1  0.09012962  0.91429761  0.75432668  1
  V  V2  1  0.85439595  0.98416824  -0.00274072  1
  Cr  Cr3  1  0.00813340  0.14636066  0.51259553  1
  V  V4  1  0.14560586  0.01583164  1.00274127  1
  Cr  Cr5  1  0.99186300  0.85364272  0.48740552  1
  H  H6  1  0.53531635  0.16997622  0.41059009  1
  H  H7  1  0.82699612  0.45210707  0.08999460  1
  H  H8  1  0.46468819  0.83001512  0.58941220  1
  H  H9  1  0.17300752  0.54789294  0.91000331  1
  H  H10  1  0.33217197  0.15402049  0.50830712  1
  H  H11  1  0.83768008  0.65328634  0.98449836  1
  H  H12  1  0.66782907  0.84597725  0.49169489  1
  H  H13  1  0.16232837  0.34671163  0.01549947  1
  H  H14  1  0.42339669  0.07994650  0.05440259  1
  H  H15  1  0.92716676  0.57347612  0.43751117  1
  H  H16  1  0.57660663  0.92004793  0.94559970  1
  H  H17  1  0.07282421  0.42652802  0.56248900  1
  H  H18  1  0.87441672  0.21124629  0.03519946  1
  H  H19  1  0.79340726  0.09701866  0.44483075  1
  H  H20  1  0.12558354  0.78875587  0.96479568  1
  H  H21  1  0.20659038  0.90298729  0.55516567  1
  C  C22  1  0.62485832  0.11755634  0.17361976  1
  C  C23  1  0.88820077  0.36620972  0.32704194  1
  C  C24  1  0.37514305  0.88243894  0.82638157  1
  C  C25  1  0.11179739  0.63379173  0.67295784  1
  C  C26  1  0.49704231  0.11933175  0.22759194  1
  C  C27  1  0.88306883  0.49450157  0.26958679  1
  C  C28  1  0.50295840  0.88066330  0.77240979  1
  C  C29  1  0.11693059  0.50549868  0.73041231  1
  C  C30  1  0.46741457  0.14446301  0.35507560  1
  C  C31  1  0.85341954  0.52154701  0.14230121  1
  C  C32  1  0.53258776  0.85553180  0.64492598  1
  C  C33  1  0.14658346  0.47845327  0.85769698  1
  C  C34  1  0.35494896  0.13565066  0.41072603  1
  C  C35  1  0.85738849  0.63434225  0.08228613  1
  C  C36  1  0.64505089  0.86434677  0.58927542  1
  C  C37  1  0.14261731  0.36565615  0.91771259  1
  C  C38  1  0.27091655  0.10072735  0.33671554  1
  C  C39  1  0.88965933  0.72315764  0.15174663  1
  C  C40  1  0.72908230  0.89927284  0.66328519  1
  C  C41  1  0.11034418  0.27684139  0.84825233  1
  C  C42  1  0.29509001  0.08316837  0.20962866  1
  C  C43  1  0.91424526  0.70044637  0.27822876  1
  C  C44  1  0.70491057  0.91683001  0.79037239  1
  C  C45  1  0.08575468  0.29955455  0.72177096  1
  C  C46  1  0.40691323  0.09334694  0.15296297  1
  C  C47  1  0.90969877  0.58738500  0.33936241  1
  C  C48  1  0.59308840  0.90664888  0.84703922  1
  C  C49  1  0.09029758  0.41261723  0.66063687  1
  N  N50  1  0.15960873  0.07633059  0.36516074  1
  N  N51  1  0.90496773  0.83998579  0.12163409  1
  N  N52  1  0.84038870  0.92367192  0.63484047  1
  N  N53  1  0.09503594  0.16001357  0.87836600  1
  N  N54  1  0.11279524  0.04595462  0.26343824  1
  N  N55  1  0.94317472  0.88492184  0.22458587  1
  N  N56  1  0.88720196  0.95404877  0.73656338  1
  N  N57  1  0.05682617  0.11507886  0.77541441  1
  N  N58  1  0.19229588  0.05370589  0.16540048  1
  N  N59  1  0.94184998  0.80351484  0.31981127  1
  N  N60  1  0.80770250  0.94629383  0.83460087  1
  N  N61  1  0.05814650  0.19648762  0.68018890  1
  O  O62  1  0.92708861  0.11481959  0.05985350  1
  O  O63  1  0.89117117  0.05704320  0.42430249  1
  O  O64  1  0.07291105  0.88518273  0.94014268  1
  O  O65  1  0.10882665  0.94296036  0.57569646  1
  O  O66  1  0.70278283  0.14334891  0.24527373  1
  O  O67  1  0.85833421  0.28921826  0.25805930  1
  O  O68  1  0.29721685  0.85665003  0.75472633  1
  O  O69  1  0.14166244  0.71078456  0.74193820  1
  O  O70  1  0.65235123  0.08805246  0.05965805  1
  O  O71  1  0.92264186  0.33910662  0.43984433  1
  O  O72  1  0.34764889  0.91194226  0.94034289  1
  O  O73  1  0.07735288  0.66089576  0.56015360  1
