# generated using pymatgen
data_VNiH12(C2O3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.79896845
_cell_length_b   7.86938086
_cell_length_c   7.84235579
_cell_angle_alpha   121.25369332
_cell_angle_beta   100.28493301
_cell_angle_gamma   100.45539001
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VNiH12(C2O3)4
_chemical_formula_sum   'V1 Ni1 H12 C8 O12'
_cell_volume   333.67358469
_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  0.47681284  0.13685637  0.84838478  1
  Ni  Ni1  1  0.98027559  0.85336749  0.14171917  1
  H  H2  1  0.49504612  0.51491012  0.03291519  1
  H  H3  1  -0.00035106  0.03755242  0.51451272  1
  H  H4  1  0.24979715  0.43682206  0.97591909  1
  H  H5  1  0.75665302  0.98188261  0.43808068  1
  H  H6  1  0.85596880  0.43768327  0.14859543  1
  H  H7  1  0.35454295  0.14567804  0.43316553  1
  H  H8  1  0.81942573  0.20209791  0.09416734  1
  H  H9  1  0.31590029  0.09508091  0.20347125  1
  H  H10  1  0.28475149  0.47466133  0.65350274  1
  H  H11  1  0.78806663  0.65689535  0.47747475  1
  H  H12  1  0.22661254  0.46940585  0.34098426  1
  H  H13  1  0.73300526  0.34209452  0.46986256  1
  C  C14  1  0.26122329  0.77315663  0.87189929  1
  C  C15  1  0.76310149  0.87059094  0.77854279  1
  C  C16  1  0.26906293  0.61400440  0.66255890  1
  C  C17  1  0.77278094  0.66361889  0.61673400  1
  C  C18  1  0.22817799  0.60725739  0.48600710  1
  C  C19  1  0.73280605  0.48629541  0.60767759  1
  C  C20  1  0.16019443  0.75763868  0.45072962  1
  C  C21  1  0.66737985  0.45341504  0.76088622  1
  O  O22  1  0.35823891  0.97243544  0.96594647  1
  O  O23  1  0.85917052  0.96985966  0.97632865  1
  O  O24  1  0.16126583  0.70603432  0.95894852  1
  O  O25  1  0.65441771  0.95041895  0.70470797  1
  O  O26  1  0.20361779  0.95432594  0.60002660  1
  O  O27  1  0.70430808  0.59903895  0.95434231  1
  O  O28  1  0.04892201  0.68325555  0.26264036  1
  O  O29  1  0.55968558  0.26019498  0.68320009  1
  O  O30  1  0.74934511  0.31089701  0.11671075  1
  O  O31  1  0.24615223  0.11868783  0.31183189  1
  O  O32  1  0.37719848  0.41018113  0.02223120  1
  O  O33  1  0.88341373  0.03080080  0.41238478  1
