%chk=000062495.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062495

0 1
 O   -1.207600     -5.3800002E-02   1.006100    
 O    1.257500      6.1900001E-02   2.101900    
 O  -0.3082000      -1.745400     -0.2684000    
 N   -4.225100      -1.169600     -0.8502000    
 C   -2.502800     -0.6210000      0.8414000    
 C   -3.506900      0.2315000       1.610900    
 C   -2.855500     -0.6808000     -0.6476000    
 C   -4.929300     -0.2356000       1.331000    
 C   -5.203000     -0.3067000     -0.1724000    
 C   -4.529200      -1.265200      -2.277700    
 C    1.156400     -3.0099999E-02  0.6766000    
 C  -0.1777000     -0.7213000      0.3921000    
 C    1.112900       1.393900      0.1112000    
 C    2.360500     -0.8446000      0.1951000    
 C   0.4506000       1.609200      -1.074100    
 C    2.508800      -1.063600      -1.154700    
 C    1.737700       2.397900      0.8124000    
 C    3.246600      -1.324700       1.131100    
 C   0.4108000       2.905100      -1.588700    
 C    3.605600      -1.805400      -1.593400    
 C    1.697700       3.693700      0.2978000    
 C    4.343400      -2.066300      0.6923000    
 C    1.034100       3.947300     -0.9028000    
 C    4.522900      -2.306500     -0.6700000    
 H   -2.500500      -1.632500       1.270200    
 H   -3.395300       1.285800       1.326000    
 H   -3.293100      0.1881000       2.685300    
 H   -2.723100      0.3142000      -1.096000    
 H   -2.198000      -1.346300      -1.207500    
 H   -5.085400      -1.224300       1.780800    
 H   -5.642900      0.4476000       1.805200    
 H   -6.213800     -0.7073000     -0.3164000    
 H   -5.190100      0.7061000     -0.5967000    
 H   -4.469100     -0.2928000      -2.780000    
 H   -5.536000      -1.670000      -2.430100    
 H   -3.837900      -1.954300      -2.775300    
 H   0.5376000      0.6296000       2.428100    
 H  -3.6100000E-02  0.8197000      -1.636700    
 H    1.804500     -0.6967000      -1.892300    
 H    2.276000       2.225300       1.738500    
 H    3.150200      -1.165900       2.199300    
 H  -0.1038000       3.102300      -2.524600    
 H    3.743900      -1.995300      -2.653800    
 H    2.186700       4.504800      0.8293000    
 H    5.058100      -2.457300       1.410700    
 H    1.004400       4.956000      -1.304200    
 H    5.376500      -2.884700      -1.011600    


%chk=000062495-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062495

0 1
O -1.233769 -0.313674 0.809661
O 0.909773 0.626672 1.863790
O -0.211041 -1.261885 -1.059810
N -4.626089 -0.629614 -0.817562
C -2.549038 -0.956854 0.462873
C -3.330353 -1.089737 1.772933
C -3.285429 -0.061986 -0.552479
C -4.761654 -1.595046 1.467131
C -5.446398 -0.698856 0.415112
C -5.313163 0.052448 -1.931172
C 1.095902 0.240280 0.463294
C -0.149361 -0.550699 -0.036135
C 1.260855 1.514401 -0.415332
C 2.350578 -0.660226 0.398877
C 0.896839 1.565224 -1.783893
C 2.903919 -1.045370 -0.846809
C 1.842332 2.657222 0.188895
C 2.949400 -1.117301 1.596924
C 1.108393 2.745447 -2.533429
C 4.040874 -1.880659 -0.891559
C 2.056398 3.831816 -0.563269
C 4.092045 -1.947980 1.548939
C 1.689338 3.882075 -1.928593
C 4.641117 -2.334923 0.305890
H -2.336295 -1.938538 0.003205
H -3.381441 -0.095277 2.259439
H -2.806150 -1.773695 2.464030
H -3.337853 0.979774 -0.139580
H -2.716769 -0.028747 -1.498260
H -4.720561 -2.630256 1.078837
H -5.360808 -1.607564 2.396543
H -6.436101 -1.114497 0.150602
H -5.616534 0.322642 0.850316
H -5.536095 1.129127 -1.721976
H -6.268202 -0.459134 -2.146525
H -4.687819 0.002866 -2.840126
H -0.062924 0.770576 2.004858
H 0.447761 0.692359 -2.270354
H 2.451767 -0.698904 -1.780484
H 2.113775 2.609976 1.247593
H 2.516882 -0.808110 2.551400
H 0.819140 2.773269 -3.590182
H 4.458792 -2.174709 -1.860914
H 2.509866 4.707404 -0.084805
H 4.551040 -2.292024 2.482939
H 1.853900 4.795061 -2.511870
H 5.526161 -2.980375 0.269144


