# generated using pymatgen
data_VCr2H8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.88563753
_cell_length_b   10.87824473
_cell_length_c   11.05156959
_cell_angle_alpha   88.33315971
_cell_angle_beta   88.14145129
_cell_angle_gamma   63.57451806
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCr2H8C14(NO)6
_chemical_formula_sum   'V2 Cr4 H16 C28 N12 O12'
_cell_volume   1171.17624826
_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  0.91889839  0.08120060  0.25005550  1
  V  V1  1  0.08110075  0.91880067  0.74994361  1
  Cr  Cr2  1  0.85272148  0.99317176  -0.01192507  1
  Cr  Cr3  1  0.00637704  0.14772598  0.51212581  1
  Cr  Cr4  1  0.14727949  0.00682863  1.01192396  1
  Cr  Cr5  1  0.99361987  0.85227622  0.48787336  1
  H  H6  1  0.54582639  0.17288447  0.40326625  1
  H  H7  1  0.82579084  0.45461071  0.09741682  1
  H  H8  1  0.45417836  0.82710803  0.59673508  1
  H  H9  1  0.17421378  0.54538634  0.90258172  1
  H  H10  1  0.34547140  0.15774023  0.50672059  1
  H  H11  1  0.84020370  0.65495044  0.99391470  1
  H  H12  1  0.65453082  0.84225677  0.49328048  1
  H  H13  1  0.15980637  0.34504448  0.00608331  1
  H  H14  1  0.42793969  0.08007236  0.05852444  1
  H  H15  1  0.92256633  0.57164317  0.44089689  1
  H  H16  1  0.57206040  0.91992699  0.94147614  1
  H  H17  1  0.07742587  0.42836131  0.55910442  1
  H  H18  1  0.90183097  0.20862663  0.04639300  1
  H  H19  1  0.79180915  0.09784209  0.45449293  1
  H  H20  1  0.09817060  0.79137243  0.95360466  1
  H  H21  1  0.20818892  0.90216235  0.54550616  1
  C  C22  1  0.63280603  0.11598999  0.16836046  1
  C  C23  1  0.88425643  0.36743613  0.33183271  1
  C  C24  1  0.36719477  0.88400811  0.83163960  1
  C  C25  1  0.11573966  0.63256565  0.66816765  1
  C  C26  1  0.50516835  0.11974774  0.22534184  1
  C  C27  1  0.88073733  0.49483158  0.27471654  1
  C  C28  1  0.49483249  0.88025022  0.77465855  1
  C  C29  1  0.11926092  0.50516924  0.72528307  1
  C  C30  1  0.47762437  0.14632074  0.35143060  1
  C  C31  1  0.85304587  0.52261835  0.14898535  1
  C  C32  1  0.52237814  0.85367513  0.64857041  1
  C  C33  1  0.14695741  0.47737952  0.85101333  1
  C  C34  1  0.36574032  0.13914831  0.41018972  1
  C  C35  1  0.85976950  0.63463430  0.09019766  1
  C  C36  1  0.63426109  0.86084954  0.58981136  1
  C  C37  1  0.14023637  0.36536186  0.90980113  1
  C  C38  1  0.27909365  0.10613634  0.34096220  1
  C  C39  1  0.89366583  0.72116962  0.15895563  1
  C  C40  1  0.72090537  0.89386547  0.65903834  1
  C  C41  1  0.10633699  0.27882850  0.84104343  1
  C  C42  1  0.30198271  0.08640330  0.21564177  1
  C  C43  1  0.91521851  0.69755352  0.28391758  1
  C  C44  1  0.69801593  0.91359857  0.78435863  1
  C  C45  1  0.08477974  0.30244704  0.71608260  1
  C  C46  1  0.41347779  0.09444185  0.15568596  1
  C  C47  1  0.90733244  0.58612132  0.34391953  1
  C  C48  1  0.58652189  0.90555825  0.84431429  1
  C  C49  1  0.09266325  0.41388058  0.65608039  1
  N  N50  1  0.16779695  0.08245389  0.37189322  1
  N  N51  1  0.91665903  0.83290252  0.12815102  1
  N  N52  1  0.83220241  0.91754813  0.62810744  1
  N  N53  1  0.08334501  0.16709479  0.87184811  1
  N  N54  1  0.12265063  0.05023331  0.27142123  1
  N  N55  1  0.95117890  0.87695754  0.22813788  1
  N  N56  1  0.87734740  0.94976956  0.72857935  1
  N  N57  1  0.04882059  0.12304274  0.77186178  1
  N  N58  1  0.20118351  0.05603611  0.17505968  1
  N  N59  1  0.94685787  0.79768617  0.32412148  1
  N  N60  1  0.79881515  0.94396608  0.82494091  1
  N  N61  1  0.05313869  0.20231570  0.67587855  1
  O  O62  1  0.94204152  0.11142814  0.06986925  1
  O  O63  1  0.88886267  0.05770917  0.43026248  1
  O  O64  1  0.05795909  0.88857155  0.93012966  1
  O  O65  1  0.11113587  0.94229296  0.56973740  1
  O  O66  1  0.71190283  0.13953086  0.23718661  1
  O  O67  1  0.85977697  0.28850433  0.26335036  1
  O  O68  1  0.28809692  0.86046873  0.76281308  1
  O  O69  1  0.14021998  0.71149676  0.73664920  1
  O  O70  1  0.65839954  0.08666001  0.05573909  1
  O  O71  1  0.91422960  0.34184243  0.44414735  1
  O  O72  1  0.34160124  0.91333763  0.94426129  1
  O  O73  1  0.08576441  0.65816024  0.55585293  1
