# generated using pymatgen
data_VH14C20N2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.04942538
_cell_length_b   10.21575510
_cell_length_c   11.33772497
_cell_angle_alpha   112.02387826
_cell_angle_beta   95.10464870
_cell_angle_gamma   114.92817924
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VH14C20N2O5
_chemical_formula_sum   'V2 H28 C40 N4 O10'
_cell_volume   842.22830953
_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  0.48437619  0.87258450  0.70820929  1
  V  V1  1  0.51564645  0.12744346  0.29179518  1
  H  H2  1  0.38040255  0.80101412  0.40740513  1
  H  H3  1  0.61959716  0.19899407  0.59259604  1
  H  H4  1  0.46340781  0.67948675  0.21043461  1
  H  H5  1  0.53656807  0.32051004  0.78955721  1
  H  H6  1  0.65366188  0.56072932  0.22584439  1
  H  H7  1  0.34630330  0.43925671  0.77412747  1
  H  H8  1  0.82745668  0.50681106  0.37423989  1
  H  H9  1  0.17252445  0.49317292  0.62572267  1
  H  H10  1  0.93946503  0.54332103  0.59903404  1
  H  H11  1  0.06047816  0.45660218  0.40091157  1
  H  H12  1  0.95374102  0.64895895  0.84365680  1
  H  H13  1  0.04619382  0.35092842  0.15627597  1
  H  H14  1  0.85831033  0.79601660  0.02779971  1
  H  H15  1  0.14161704  0.20386028  0.97215660  1
  H  H16  1  0.65674676  0.88336161  0.97514787  1
  H  H17  1  0.34324929  0.11658575  0.02483225  1
  H  H18  1  0.96083847  0.28808228  0.77974379  1
  H  H19  1  0.03920649  0.71195877  0.22027307  1
  H  H20  1  0.77769017  0.43990358  0.11646117  1
  H  H21  1  0.22235540  0.56013967  0.88355831  1
  H  H22  1  0.20134107  0.90921061  0.41551259  1
  H  H23  1  0.79865119  0.09083086  0.58453297  1
  H  H24  1  0.97501910  0.04258285  0.72686763  1
  H  H25  1  0.02496805  0.95745044  0.27317598  1
  H  H26  1  0.24826410  0.85138124  0.80551801  1
  H  H27  1  0.75173603  0.14862422  0.19448959  1
  H  H28  1  0.35460081  0.81520486  0.90274121  1
  H  H29  1  0.64545088  0.18485363  0.09727736  1
  C  C30  1  0.46368807  0.75058757  0.41376684  1
  C  C31  1  0.53631233  0.24942044  0.58623152  1
  C  C32  1  0.51088128  0.68122321  0.30291060  1
  C  C33  1  0.48910268  0.31877505  0.69707976  1
  C  C34  1  0.61719682  0.61757326  0.31165752  1
  C  C35  1  0.38278333  0.38241916  0.68832217  1
  C  C36  1  0.68134739  0.62871927  0.43503188  1
  C  C37  1  0.31863762  0.37126820  0.56494460  1
  C  C38  1  0.79270688  0.56969496  0.45862460  1
  C  C39  1  0.20727163  0.43028080  0.54134045  1
  C  C40  1  0.85297786  0.58793097  0.58315911  1
  C  C41  1  0.14698685  0.41201832  0.41679812  1
  C  C42  1  0.80728341  0.66635682  0.69481787  1
  C  C43  1  0.19268335  0.33358742  0.30514367  1
  C  C44  1  0.86608746  0.69108781  0.82470484  1
  C  C45  1  0.13386105  0.30882095  0.17524764  1
  C  C46  1  0.81317383  0.77048247  0.92534574  1
  C  C47  1  0.18677940  0.22942091  0.07461479  1
  C  C48  1  0.70074203  0.82251419  0.89725052  1
  C  C49  1  0.29924316  0.17742790  0.10272303  1
  C  C50  1  0.69493430  0.72392892  0.67326397  1
  C  C51  1  0.30505519  0.27604376  0.32671264  1
  C  C52  1  0.63187638  0.70416567  0.54494654  1
  C  C53  1  0.36812061  0.29582773  0.45503667  1
  C  C54  1  0.69915573  0.18595997  0.88042871  1
  C  C55  1  0.30089390  0.81407523  0.11960013  1
  C  C56  1  0.85304441  0.34726619  0.94155807  1
  C  C57  1  0.14700950  0.65276942  0.05846654  1
  C  C58  1  0.97818268  0.38175842  0.87591643  1
  C  C59  1  0.02186955  0.61827834  0.12410712  1
  C  C60  1  0.87568389  0.46653823  0.06612665  1
  C  C61  1  0.12436605  0.53350002  0.93389599  1
  C  C62  1  0.19910134  0.93822031  0.66265283  1
  C  C63  1  0.80090749  0.06183235  0.33739157  1
  C  C64  1  0.09815509  0.97137808  0.57970239  1
  C  C65  1  0.90185002  0.02867772  0.42034876  1
  C  C66  1  0.11042591  0.94597289  0.45133309  1
  C  C67  1  0.88957471  0.05407837  0.54871663  1
  C  C68  1  0.98711406  0.02609604  0.62790302  1
  C  C69  1  0.01288412  0.97395107  0.37214479  1
  N  N70  1  0.51999465  0.75935785  0.53270628  1
  N  N71  1  0.48001973  0.24065903  0.46729170  1
  N  N72  1  0.64115344  0.79989606  0.77343045  1
  N  N73  1  0.35884804  0.20007917  0.22655251  1
  O  O74  1  0.67431102  0.09071249  0.75691024  1
  O  O75  1  0.32574426  0.90930839  0.24312363  1
  O  O76  1  0.59364518  0.14046831  0.94237886  1
  O  O77  1  0.40640113  0.85958594  0.05765141  1
  O  O78  1  0.30320541  0.89327915  0.61162803  1
  O  O79  1  0.69684659  0.10683300  0.38843191  1
  O  O80  1  0.18068952  0.95239331  0.77504964  1
  O  O81  1  0.81927850  0.04759877  0.22497530  1
  O  O82  1  0.31514633  0.79052786  0.80679420  1
  O  O83  1  0.68489237  0.20951301  0.19322266  1
