# generated using pymatgen
data_CoH14C16(NO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.88276859
_cell_length_b   11.63762388
_cell_length_c   12.30594633
_cell_angle_alpha   118.35835742
_cell_angle_beta   100.15499393
_cell_angle_gamma   89.90490118
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoH14C16(NO3)2
_chemical_formula_sum   'Co2 H28 C32 N4 O12'
_cell_volume   973.46794217
_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
  Co  Co0  1  0.99999558  0.99999696  0.49999636  1
  Co  Co1  1  0.50000264  0.50000052  0.50000306  1
  H  H2  1  0.84438857  0.90957121  0.62418990  1
  H  H3  1  0.65579500  0.28481595  0.37618711  1
  H  H4  1  0.15561221  0.09042870  0.37580904  1
  H  H5  1  0.34420730  0.71518476  0.62381370  1
  H  H6  1  0.02652662  0.84644480  0.61760029  1
  H  H7  1  0.47345175  0.22819303  0.38229036  1
  H  H8  1  0.97347429  0.15355558  0.38239844  1
  H  H9  1  0.52655016  0.77180801  0.61770987  1
  H  H10  1  0.76692165  0.94193769  0.25528173  1
  H  H11  1  0.73098802  0.68877913  0.74717598  1
  H  H12  1  0.23307723  0.05806177  0.74471589  1
  H  H13  1  0.26901477  0.31122268  0.25283013  1
  H  H14  1  0.57772997  0.75361506  0.07871336  1
  H  H15  1  0.91944684  0.67680266  0.92372234  1
  H  H16  1  0.42226925  0.24638443  0.92128260  1
  H  H17  1  0.08055219  0.32319690  0.07628471  1
  H  H18  1  0.79662687  0.51404393  0.24224237  1
  H  H19  1  0.70600312  0.27162034  0.75593134  1
  H  H20  1  0.20336688  0.48595444  0.75775418  1
  H  H21  1  0.29399764  0.72837793  0.24406856  1
  H  H22  1  0.98929160  0.71015890  0.40407835  1
  H  H23  1  0.51224272  0.30656768  0.59499189  1
  H  H24  1  0.01070266  0.28983927  0.59591946  1
  H  H25  1  0.48776048  0.69343288  0.40500783  1
  H  H26  1  0.57187401  0.41175332  0.05553293  1
  H  H27  1  0.92994061  0.35545156  0.94232768  1
  H  H28  1  0.42812191  0.58824609  0.94446336  1
  H  H29  1  0.07005811  0.64454610  0.05767414  1
  C  C30  1  0.76867887  0.84542273  0.24884353  1
  C  C31  1  0.73002320  0.59825589  0.75278380  1
  C  C32  1  0.23131801  0.15457644  0.75115348  1
  C  C33  1  0.26997921  0.40174528  0.24722131  1
  C  C34  1  0.66335598  0.73943399  0.15036670  1
  C  C35  1  0.83514487  0.59053527  0.85113455  1
  C  C36  1  0.33664139  0.26056520  0.84962951  1
  C  C37  1  0.16485535  0.40946456  0.14887050  1
  C  C38  1  0.66841682  0.61578404  0.14565331  1
  C  C39  1  0.83167447  0.47081049  0.85441257  1
  C  C40  1  0.33157952  0.38421523  0.85434316  1
  C  C41  1  0.16832528  0.52918812  0.14559008  1
  C  C42  1  0.78714933  0.60676913  0.24071520  1
  C  C43  1  0.71416095  0.36637764  0.75840724  1
  C  C44  1  0.21284554  0.39322946  0.75928143  1
  C  C45  1  0.28583999  0.63362109  0.24159390  1
  C  C46  1  0.89126976  0.71697799  0.33349982  1
  C  C47  1  0.60968224  0.38417247  0.66610206  1
  C  C48  1  0.10872498  0.28301998  0.66649750  1
  C  C49  1  0.39032002  0.61582754  0.33389933  1
  C  C50  1  0.62177897  0.03939946  0.50540887  1
  C  C51  1  0.87815240  0.53418143  0.49474832  1
  C  C52  1  0.37822062  0.96060239  0.49459190  1
  C  C53  1  0.12184983  0.46581979  0.50525354  1
  C  C54  1  0.55707248  0.94814298  0.54377737  1
  C  C55  1  0.94304438  0.40424937  0.45587737  1
  C  C56  1  0.44292710  0.05185891  0.45622357  1
  C  C57  1  0.05695796  0.59575196  0.54412494  1
  C  C58  1  0.55893485  0.50146645  0.04843075  1
  C  C59  1  0.94156263  0.45306412  0.95102385  1
  C  C60  1  0.44106167  0.49853320  0.95156552  1
  C  C61  1  0.05843626  0.54693393  0.04897859  1
  N  N62  1  0.87787421  0.83607267  0.34162402  1
  N  N63  1  0.62211468  0.49573180  0.65903662  1
  N  N64  1  0.12212076  0.16392546  0.65837313  1
  N  N65  1  0.37788919  0.50426937  0.34096698  1
  O  O66  1  0.96809943  0.92379264  0.62166868  1
  O  O67  1  0.53199612  0.30159238  0.37868849  1
  O  O68  1  0.03190160  0.07620835  0.37833110  1
  O  O69  1  0.46800633  0.69840896  0.62131239  1
  O  O70  1  0.76663406  0.09276189  0.51664467  1
  O  O71  1  0.73319530  0.57659063  0.48398141  1
  O  O72  1  0.23336578  0.90723976  0.48335594  1
  O  O73  1  0.26680695  0.42341048  0.51602020  1
  O  O74  1  0.62832871  0.89440072  0.60578574  1
  O  O75  1  0.87173574  0.28839727  0.39435583  1
  O  O76  1  0.37167137  0.10560037  0.39421417  1
  O  O77  1  0.12826718  0.71160411  0.60564352  1
