# generated using pymatgen
data_FeCoH12(C2O3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.80645536
_cell_length_b   7.88029434
_cell_length_c   7.85526888
_cell_angle_alpha   121.27366583
_cell_angle_beta   100.27700400
_cell_angle_gamma   100.43924280
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCoH12(C2O3)4
_chemical_formula_sum   'Fe1 Co1 H12 C8 O12'
_cell_volume   335.02791871
_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
  Co  Co0  1  0.47607412  0.14037429  0.85257824  1
  Fe  Fe1  1  0.97623335  0.85406755  0.14141765  1
  H  H2  1  0.49381132  0.51375098  0.03280634  1
  H  H3  1  -0.00101871  0.04019275  0.52197315  1
  H  H4  1  0.24971609  0.43624747  0.97579698  1
  H  H5  1  0.75468986  0.98609916  0.44550547  1
  H  H6  1  0.85465585  0.43408778  0.14733327  1
  H  H7  1  0.36019661  0.14969571  0.43508109  1
  H  H8  1  0.81702381  0.20145138  0.09066232  1
  H  H9  1  0.32087920  0.09557905  0.20239648  1
  H  H10  1  0.28502743  0.47578409  0.65717444  1
  H  H11  1  0.78864162  0.65853009  0.47770612  1
  H  H12  1  0.23019780  0.47262997  0.33880518  1
  H  H13  1  0.73683272  0.34242053  0.47338868  1
  C  C14  1  0.26584587  0.77453302  0.87292827  1
  C  C15  1  0.76028006  0.87102331  0.77288984  1
  C  C16  1  0.27018281  0.61294762  0.66137126  1
  C  C17  1  0.76981717  0.66171488  0.61397718  1
  C  C18  1  0.22937889  0.60622237  0.48583735  1
  C  C19  1  0.73191486  0.48664919  0.60736491  1
  C  C20  1  0.16063320  0.75856938  0.45277907  1
  C  C21  1  0.66039075  0.44781604  0.75588225  1
  O  O22  1  0.35801976  0.97172947  0.96647603  1
  O  O23  1  0.85648272  0.96683083  0.97052000  1
  O  O24  1  0.16844647  0.70200571  0.95805933  1
  O  O25  1  0.65824766  0.95211226  0.69953694  1
  O  O26  1  0.20258435  0.95188760  0.60034928  1
  O  O27  1  0.69581008  0.59544114  0.94822931  1
  O  O28  1  0.04948441  0.68057507  0.26286088  1
  O  O29  1  0.55691509  0.25633997  0.67756650  1
  O  O30  1  0.74764313  0.31076348  0.11914710  1
  O  O31  1  0.25300286  0.12429969  0.31343440  1
  O  O32  1  0.37665099  0.41142553  0.02516586  1
  O  O33  1  0.88227812  0.03329882  0.42008937  1
