%chk=000135306.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135306

0 1
 O  -0.1695000      -1.359200      -2.378800    
 O   6.5200001E-02  -4.040400       1.318500    
 O   -4.734500       2.439900      7.9899997E-02
 N   4.5899998E-02  -1.718600       1.068500    
 N  -4.0700000E-02  -2.988600     -0.7488000    
 C  -4.8000002E-03 -0.7219000     -1.5000000E-03
 C    1.278400      0.1121000      6.4900003E-02
 C   -1.279300      0.1306000      2.0199999E-02
 C  -7.8900002E-02  -1.693300      -1.203300    
 C   2.8500000E-02  -3.036600      0.6204000    
 C    1.514300      0.9431000       1.160200    
 C    2.211100      4.0500000E-02 -0.9698000    
 C   -1.509800       1.077100     -0.9819000    
 C   -2.217800     -3.5300002E-02   1.042400    
 C    2.682700       1.702600       1.220700    
 C    3.379600      0.7999000     -0.9092000    
 C    3.615300       1.631100      0.1860000    
 C   -2.669600       1.851900     -0.9619000    
 C   -3.377500      0.7393000       1.062400    
 C   -3.603400       1.683100      6.0400002E-02
 C    4.864700       2.442800      0.2508000    
 H   0.1046000      -1.479900       2.054200    
 H  -7.4100003E-02  -3.805200      -1.348200    
 H   0.8004000       1.009500       1.976800    
 H    2.083700     -0.5965000      -1.837100    
 H  -0.7932000       1.228300      -1.784700    
 H   -2.082800     -0.7565000       1.842400    
 H    2.856200       2.344500       2.080300    
 H    4.101200      0.7329000      -1.719200    
 H   -2.833000       2.584500      -1.747700    
 H   -4.101600      0.6039000       1.861300    
 H    5.208500       2.719700     -0.7517000    
 H    4.702200       3.375100      0.8021000    
 H    5.656500       1.874400      0.7487000    
 H   -4.726400       3.038600     -0.6867000    


%chk=000135306-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000135306

0 1
O -0.208866 -1.240107 -2.485679
O 0.097252 -4.133106 1.220765
O -4.884859 2.361743 0.265905
N 0.085584 -1.756441 1.042832
N -0.156380 -2.941501 -0.839848
C -0.003318 -0.719794 -0.015877
C 1.277170 0.140403 -0.028488
C -1.293448 0.120450 0.087650
C -0.130277 -1.624314 -1.297193
C 0.019116 -3.060770 0.577455
C 1.379492 1.246876 0.851768
C 2.398311 -0.196110 -0.824741
C -1.488268 1.198597 -0.811578
C -2.317684 -0.191510 1.014265
C 2.575932 1.988322 0.939280
C 3.590076 0.554724 -0.739129
C 3.705788 1.654386 0.148747
C -2.672808 1.959482 -0.776736
C -3.505017 0.566663 1.064143
C -3.681357 1.643948 0.167674
C 5.001028 2.438918 0.261565
H 0.354064 -1.547698 2.003102
H -0.270993 -3.758821 -1.439729
H 0.513627 1.541264 1.456261
H 2.343422 -1.031360 -1.531158
H -0.714009 1.435110 -1.548242
H -2.191526 -1.036827 1.698309
H 2.632609 2.842071 1.625403
H 4.442777 0.284846 -1.373726
H -2.811521 2.789539 -1.481600
H -4.299684 0.335564 1.779302
H 5.562680 2.433062 -0.688845
H 4.815019 3.490161 0.543241
H 5.661666 2.003080 1.036201
H -4.923496 3.082549 -0.410700


