# generated using pymatgen
data_VH28(C13N5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.84054624
_cell_length_b   10.38717597
_cell_length_c   10.42113157
_cell_angle_alpha   75.74117886
_cell_angle_beta   72.14798320
_cell_angle_gamma   72.84452599
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VH28(C13N5)2
_chemical_formula_sum   'V1 H28 C26 N10'
_cell_volume   663.48723906
_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  0.00000005  -0.00000066  0.99999860  1
  H  H1  1  0.94198507  0.06534335  0.71560604  1
  H  H2  1  0.06901104  0.28204380  0.92162206  1
  H  H3  1  0.05801664  0.93465616  0.28438929  1
  H  H4  1  0.93098683  0.71795461  0.07837994  1
  H  H5  1  0.12758226  0.16521170  0.48409599  1
  H  H6  1  0.88329680  0.51350204  0.82542661  1
  H  H7  1  0.87242263  0.83478790  0.51590113  1
  H  H8  1  0.11670299  0.48649623  0.17457476  1
  H  H9  1  0.65218420  0.13222489  0.64957797  1
  H  H10  1  0.34207585  0.34932322  0.88801069  1
  H  H11  1  0.34781251  0.86777878  0.35042509  1
  H  H12  1  0.65792245  0.65067702  0.11198983  1
  H  H13  1  0.45650738  0.02858378  0.87251570  1
  H  H14  1  0.53747377  0.12735409  0.98876756  1
  H  H15  1  0.54348750  0.97141773  0.12748574  1
  H  H16  1  0.46252372  0.87264572  0.01123242  1
  H  H17  1  0.52416470  0.15706377  0.33580385  1
  H  H18  1  0.48264553  0.66135540  0.84542933  1
  H  H19  1  0.47583747  0.84293742  0.66419570  1
  H  H20  1  0.51734867  0.33864388  0.15457229  1
  H  H21  1  0.68323375  0.21201725  0.40619697  1
  H  H22  1  0.31983234  0.58882870  0.79615894  1
  H  H23  1  0.31676999  0.78798275  0.59380311  1
  H  H24  1  0.68016910  0.41116931  0.20383813  1
  H  H25  1  0.23897374  0.37356573  0.37440906  1
  H  H26  1  0.76102950  0.62643570  0.62559447  1
  H  H27  1  0.40968375  0.43405965  0.42992802  1
  H  H28  1  0.59032388  0.56594106  0.57007148  1
  C  C29  1  0.10076826  0.07915323  0.69663008  1
  C  C30  1  0.90734137  0.30132706  0.91402657  1
  C  C31  1  0.89923301  0.92084621  0.30336634  1
  C  C32  1  0.09265773  0.69867118  0.08597372  1
  C  C33  1  0.20389199  0.13742012  0.56849384  1
  C  C34  1  0.80440467  0.42904352  0.85742291  1
  C  C35  1  0.79611118  0.86257962  0.43150353  1
  C  C36  1  0.19559468  0.57095515  0.14257727  1
  C  C37  1  0.40594564  0.15602745  0.54856141  1
  C  C38  1  0.59853877  0.44874342  0.84665710  1
  C  C39  1  0.59405671  0.84397268  0.45143828  1
  C  C40  1  0.40146077  0.55125580  0.15334270  1
  C  C41  1  0.49667916  0.11702071  0.65958047  1
  C  C42  1  0.50261853  0.33863026  0.89403751  1
  C  C43  1  0.50331995  0.88298075  0.34042052  1
  C  C44  1  0.49738041  0.66136927  0.10596238  1
  C  C45  1  0.38732776  0.05817148  0.78499468  1
  C  C46  1  0.61218500  0.21360813  0.95077256  1
  C  C47  1  0.61267005  0.94182903  0.21500533  1
  C  C48  1  0.38781363  0.78639083  0.04922674  1
  C  C49  1  0.51839399  0.21855584  0.40971047  1
  C  C50  1  0.48557382  0.58680127  0.78551293  1
  C  C51  1  0.48160959  0.78144434  0.59028940  1
  C  C52  1  0.51442608  0.41319796  0.21448660  1
  C  C53  1  0.40680330  0.36653371  0.36394452  1
  C  C54  1  0.59320040  0.63346676  0.63605613  1
  N  N55  1  0.84529579  0.91629358  0.91952647  1
  N  N56  1  0.15470336  0.08371293  0.08047883  1
  N  N57  1  0.88521029  0.83788785  0.84200182  1
  N  N58  1  0.11478463  0.16211978  0.15800606  1
  N  N59  1  0.92548010  0.76291287  0.76517414  1
  N  N60  1  0.07451700  0.23707883  0.23481832  1
  N  N61  1  0.19131660  0.03934232  0.80430534  1
  N  N62  1  0.81312000  0.19396946  0.95978306  1
  N  N63  1  0.80868287  0.96065657  0.19569217  1
  N  N64  1  0.18687908  0.80602875  0.04021476  1
