%chk=000080900.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080900

0 1
 O    6.192900     -0.6604000     -0.4458000    
 O   -6.192800     -0.6606000      0.4457000    
 O  -5.0000002E-04  0.8836000       0.000000    
 N    3.596300      0.1727000      0.3698000    
 N   -3.596300      0.1728000     -0.3698000    
 C    4.775700       1.025700      0.5719000    
 C    3.793700     -0.6895000     -0.8036000    
 C   -4.775800       1.025700     -0.5719000    
 C   -3.793500     -0.6895000      0.8036000    
 C    2.389100      0.9829000      0.2212000    
 C   -2.389300      0.9833000     -0.2211000    
 C    6.024100      0.1592000      0.7116000    
 C    5.064700      -1.516100     -0.6306000    
 C   -6.024000      0.1590000     -0.7115000    
 C   -5.064400      -1.516200      0.6305000    
 C    1.170100      8.3499998E-02  0.1083000    
 C   -1.170000      8.3899997E-02 -0.1083000    
 H    4.658600       1.628700       1.479500    
 H    4.900100       1.709800     -0.2777000    
 H    3.869000     -8.5400000E-02  -1.716900    
 H    2.985600      -1.413900     -0.9316000    
 H   -4.900300       1.709900      0.2777000    
 H   -4.658600       1.628700      -1.479600    
 H   -2.985300      -1.413800      0.9315000    
 H   -3.869000     -8.5500002E-02   1.716900    
 H    2.445000       1.649200     -0.6500000    
 H    2.259000       1.634200       1.095000    
 H   -2.445200       1.649500      0.6501000    
 H   -2.259200       1.634700      -1.094900    
 H    5.978700     -0.4748000       1.605500    
 H    6.910800      0.7948000      0.8012000    
 H    5.246100      -2.114500      -1.529300    
 H    4.986800      -2.207300      0.2176000    
 H   -5.978700     -0.4748000      -1.605600    
 H   -6.910800      0.7946000     -0.8011000    
 H   -5.245800      -2.114600       1.529200    
 H   -4.986500      -2.207400     -0.2177000    
 H    1.090900     -0.5627000      0.9913000    
 H    1.203100     -0.5411000     -0.7882000    
 H   -1.091200     -0.5623000     -0.9913000    
 H   -1.203200     -0.5408000      0.7881000    


%chk=000080900-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080900

0 1
O 6.517629 -0.408281 -0.354146
O -6.517624 -0.408379 0.354153
O -0.000006 0.622493 0.000029
N 3.703058 0.109395 0.184935
N -3.703066 0.109366 -0.184927
C 4.768700 1.030804 0.663262
C 4.142365 -0.565711 -1.065736
C -4.768729 1.030759 -0.663240
C -4.142357 -0.565759 1.065740
C 2.396167 0.796076 0.045444
C -2.396182 0.796061 -0.045436
C 6.076706 0.255200 0.884652
C 5.460867 -1.318574 -0.824583
C -6.076719 0.255128 -0.884637
C -5.460841 -1.318652 0.824580
C 1.219972 -0.190410 0.045941
C -1.219977 -0.190413 -0.046064
H 4.445582 1.486227 1.618486
H 4.955797 1.857445 -0.068106
H 4.287779 0.174071 -1.894112
H 3.370060 -1.287970 -1.388300
H -4.955842 1.857387 0.068138
H -4.445625 1.486200 -1.618460
H -3.370034 -1.287998 1.388303
H -4.287792 0.174016 1.894119
H 2.341447 1.427802 -0.875060
H 2.263121 1.471788 0.910196
H -2.341429 1.427705 0.875120
H -2.263186 1.471852 -0.910133
H 5.928725 -0.504073 1.682930
H 6.899365 0.933640 1.165168
H 5.844690 -1.757502 -1.760440
H 5.297057 -2.121785 -0.073741
H -5.928722 -0.504130 -1.682925
H -6.899393 0.933554 -1.165142
H -5.844653 -1.757598 1.760433
H -5.297011 -2.121852 0.073730
H 1.247821 -0.809275 0.968359
H 1.250751 -0.872065 -0.832863
H -1.247785 -0.809122 -0.968588
H -1.250786 -0.872219 0.832621


