%chk=000043422.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043422

0 1
 O  -6.3900001E-02  0.1227000     -0.1909000    
 O    2.739000       3.406300      0.4388000    
 O    1.771900       1.753900       1.651400    
 N  -0.7088000      -2.019300      0.1739000    
 C    2.379600     -0.2358000     -0.2606000    
 C    2.776400       1.178300     -0.4994000    
 C    1.060000     -0.6505000     -0.1288000    
 C   0.6616000      -1.960200      9.4700001E-02
 C    3.344300      -1.243400     -0.1535000    
 C    2.228900       1.772000      -1.814900    
 C   -1.076500     -0.7690000     -1.3000000E-03
 C    1.641100      -2.958000      0.1994000    
 C    2.985100      -2.578000      7.1900003E-02
 C    2.372300       2.114000      0.6471000    
 C   -2.397900     -0.2050000     -2.0300001E-02
 C   -2.574200       1.166800     -0.2228000    
 C   -3.515100      -1.024500      0.1646000    
 C   -3.857000       1.714300     -0.2404000    
 C   -4.797900     -0.4769000      0.1468000    
 C   -4.968900      0.8924000     -5.5799998E-02
 H    3.872800       1.231100     -0.5447000    
 H    4.401000      -1.001100     -0.2450000    
 H    2.450400       1.110300      -2.659500    
 H    1.143700       1.916300      -1.773600    
 H    2.681000       2.746400      -2.028900    
 H    1.374200      -3.995100      0.3739000    
 H    3.762000      -3.334700      0.1497000    
 H   -1.733800       1.840700     -0.3705000    
 H   -3.407100      -2.094800      0.3244000    
 H   -3.990800       2.780600     -0.3980000    
 H   -5.663700      -1.116600      0.2907000    
 H   -5.967600       1.318800     -6.9600001E-02
 H    2.466100       3.987300       1.180600    


%chk=000043422-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000043422

0 1
O -0.057817 0.206199 -0.221990
O 3.084299 3.425767 0.428611
O 1.971437 1.850208 1.716216
N -0.742089 -1.974522 0.181317
C 2.440456 -0.208652 -0.261982
C 2.875961 1.222338 -0.531307
C 1.097360 -0.601056 -0.136888
C 0.672408 -1.938044 0.105423
C 3.375995 -1.265235 -0.131440
C 2.272506 1.802815 -1.846486
C -1.142453 -0.721585 -0.008776
C 1.623598 -2.971957 0.232581
C 2.982022 -2.611776 0.108239
C 2.566733 2.137876 0.658954
C -2.497878 -0.181064 -0.030033
C -2.732886 1.209960 -0.204238
C -3.598140 -1.068543 0.128864
C -4.053610 1.702874 -0.221858
C -4.913952 -0.567207 0.110222
C -5.147300 0.818666 -0.065886
H 3.978313 1.239577 -0.638693
H 4.443894 -1.030119 -0.214485
H 2.565933 1.165795 -2.698536
H 1.171200 1.826074 -1.795878
H 2.644547 2.825674 -2.018939
H 1.309957 -4.002239 0.420609
H 3.755547 -3.381281 0.200791
H -1.882174 1.888756 -0.316948
H -3.398259 -2.136151 0.264794
H -4.231580 2.775535 -0.354493
H -5.758750 -1.253512 0.232979
H -6.172278 1.205445 -0.079363
H 2.885200 3.998682 1.218019


