%chk=000115652.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115652

0 1
 O    2.487000       1.704900     -4.9199998E-02
 O    3.222100     -0.9558000      0.2284000    
 N   -2.905400      0.5723000      0.6835000    
 C   -2.226000      0.1964000     -0.5511000    
 C   -2.584100      -1.244200     -0.9764000    
 C  -0.7393000      6.4599998E-02 -0.3702000    
 C   -1.561300      -2.176900     -0.3078000    
 C  -0.3657000      -1.279700     -0.2359000    
 C   0.2051000       1.076700     -0.3035000    
 C   0.9551000      -1.636700     -2.2600001E-02
 C    1.541100      0.7240000     -0.1011000    
 C    1.913200     -0.6225000      3.8899999E-02
 C   -4.349400      0.6903000      0.4658000    
 C   -2.369300       1.830800       1.208000    
 C    3.094300       2.083100      -1.282200    
 C    3.682600      -1.027300       1.575700    
 H   -2.447700      0.8930000      -1.370500    
 H   -2.454400      -1.318000      -2.067200    
 H   -3.608200      -1.571000     -0.7842000    
 H   -1.378800      -3.068300     -0.9144000    
 H   -1.881300      -2.463300      0.6991000    
 H  -7.4800000E-02   2.117900     -0.4256000    
 H    1.237600      -2.678400      9.0300001E-02
 H   -4.846400       1.025500       1.384100    
 H   -4.818300     -0.2662000      0.2220000    
 H   -4.589100       1.409900     -0.3257000    
 H   -2.342100       2.625800      0.4538000    
 H   -1.380200       1.700700       1.656200    
 H   -2.992900       2.192000       2.035700    
 H    3.607700       1.230200      -1.737400    
 H    3.830900       2.864500      -1.075900    
 H    2.344600       2.482500      -1.972500    
 H    4.742400      -1.295600       1.561800    
 H    3.134000      -1.796600       2.128200    
 H    3.573700     -5.8100000E-02   2.072600    


%chk=000115652-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115652

0 1
O 2.484045 1.761818 -0.111799
O 3.225780 -1.037839 0.221535
N -3.076261 0.498119 0.690372
C -2.330690 0.203313 -0.581241
C -2.690576 -1.225327 -1.108577
C -0.820541 0.071176 -0.373420
C -1.677917 -2.181099 -0.409241
C -0.452072 -1.293960 -0.253460
C 0.161535 1.079660 -0.335779
C 0.891605 -1.653237 -0.037105
C 1.516891 0.725285 -0.149277
C 1.878215 -0.642722 0.034806
C -4.504577 0.780613 0.422308
C -2.486309 1.579347 1.509367
C 3.463205 1.721599 -1.222557
C 3.849810 -0.528625 1.464989
H -2.559860 0.991072 -1.344112
H -2.527420 -1.253685 -2.203213
H -3.738628 -1.505246 -0.911957
H -1.479483 -3.097135 -0.993913
H -2.062615 -2.488104 0.582384
H -0.085027 2.139259 -0.461185
H 1.206505 -2.695975 0.075607
H -5.040555 0.903405 1.380417
H -4.974159 -0.056307 -0.120759
H -4.658579 1.711909 -0.182347
H -2.465489 2.572196 0.989514
H -1.455874 1.322511 1.799905
H -3.083852 1.694873 2.431846
H 4.014231 0.763638 -1.228882
H 4.150532 2.561920 -1.039456
H 2.945606 1.862471 -2.190766
H 4.886709 -0.897937 1.444692
H 3.322227 -0.936237 2.348372
H 3.830287 0.575751 1.493631


