%chk=000023166.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023166

0 1
 O   -1.580400     -0.1294000     -3.8999999E-03
 O   -2.775500      -2.098000     -1.7000000E-03
 N   -3.696700       2.594200     -5.5999998E-03
 C    3.307800      0.4094000      4.8999999E-02
 C    2.149500     -0.5897000      8.2999999E-03
 C    4.686700     -0.2566000      4.1800000E-02
 C   0.8004000      0.1278000     -6.5000001E-03
 C    5.844200      0.7423000      8.0000004E-03
 C  -0.3599000     -0.8573000     -4.8000002E-03
 C    7.187100      3.1800002E-02 -7.0600003E-02
 C   -2.724700     -0.8761000     -2.3000001E-03
 C   -3.915500      1.8400000E-02 -3.1000001E-03
 C   -5.127000     -0.5548000     -4.6000001E-03
 C   -3.795900       1.438000     -3.8999999E-03
 H    3.231900       1.081100     -0.8153000    
 H    3.217900       1.035800      0.9451000    
 H    2.208500      -1.250600      0.8815000    
 H    2.240100      -1.221900     -0.8832000    
 H    4.756700     -0.9164000     -0.8322000    
 H    4.782600     -0.8957000      0.9283000    
 H   0.7132000      0.7901000      0.8640000    
 H   0.7251000      0.7783000     -0.8868000    
 H    5.737800       1.405200     -0.8584000    
 H    5.816600       1.371900      0.9046000    
 H  -0.3131000      -1.490700      0.8889000    
 H  -0.3139000      -1.492400     -0.8973000    
 H    7.336900     -0.6202000      0.7959000    
 H    8.001400      0.7627000     -9.0800002E-02
 H    7.256000     -0.5786000     -0.9767000    
 H   -5.261900      -1.631700     -4.6999999E-03
 H   -6.033800      4.3499999E-02 -5.9000002E-03


%chk=000023166-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000023166

0 1
O -1.638429 -0.127299 0.004070
O -2.849807 -2.124023 -0.000894
N -3.698883 2.640260 0.011867
C 3.339626 0.424856 -0.002052
C 2.165787 -0.579834 -0.006797
C 4.724623 -0.259846 -0.012183
C 0.784474 0.116720 0.002260
C 5.901208 0.742287 -0.003444
C -0.353344 -0.901205 -0.001346
C 7.281664 0.051290 -0.010994
C -2.803542 -0.871574 0.003071
C -4.017265 0.023894 0.009677
C -5.258045 -0.545613 0.011123
C -3.834621 1.452958 0.014397
H 3.254191 1.092791 -0.884062
H 3.259879 1.078144 0.891392
H 2.253177 -1.246467 0.876280
H 2.248216 -1.232550 -0.900668
H 4.806826 -0.910759 -0.907692
H 4.810218 -0.930832 0.868081
H 0.693283 0.762727 0.895866
H 0.687793 0.774955 -0.881791
H 5.816676 1.410973 -0.884238
H 5.817733 1.394320 0.889853
H -0.343474 -1.552729 0.891833
H -0.345650 -1.543765 -0.901035
H 7.404885 -0.599006 0.875458
H 8.104064 0.789810 -0.004413
H 7.403860 -0.581808 -0.909943
H -5.344065 -1.637672 0.007613
H -6.168958 0.059397 0.015809


