%chk=000023209.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023209

0 1
 O   0.2148000      8.5900001E-02  0.6192000    
 O    2.320500       1.529200      0.1581000    
 O  -0.9336000       2.332500      0.2362000    
 N    3.786000     -0.2371000     -0.1940000    
 N   -3.143300       2.464600     -0.3624000    
 C  -0.9905000     -0.4934000      0.2994000    
 C    1.383000     -0.6416000      0.3052000    
 C   -2.087600      0.2956000     -2.1299999E-02
 C    2.534800      0.3155000      8.1200004E-02
 C   -1.086200      -1.879200      0.3025000    
 C   -3.301200     -0.3116000     -0.3443000    
 C    4.927000      0.6443000     -0.4081000    
 C    4.081100      -1.665300     -0.2780000    
 C   -2.299700      -2.486200     -2.0700000E-02
 C   -3.407100      -1.702400     -0.3441000    
 C   -1.998200       1.749100     -2.8899999E-02
 H    1.265600      -1.211700     -0.6252000    
 H    1.632900      -1.299000       1.144900    
 H  -0.2578000      -2.525900      0.5742000    
 H   -4.203700      0.2267000     -0.6059000    
 H    4.648600       1.698600     -0.3364000    
 H    5.337300      0.4539000      -1.404300    
 H    5.686600      0.4266000      0.3486000    
 H    3.198800      -2.289400     -0.1355000    
 H    4.816000      -1.914500      0.4931000    
 H    4.503500      -1.877100      -1.264800    
 H   -2.384500      -3.569000     -1.4600000E-02
 H   -4.351900      -2.176500     -0.5941000    
 H   -4.047500       2.075800     -0.5952000    
 H   -3.103600       3.479000     -0.3813000    


%chk=000023209-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000023209

0 1
O 0.019012 0.020114 -0.026824
O 2.037154 1.619245 -0.276300
O -3.522146 2.294771 0.064325
N 3.665795 -0.048533 -0.325325
N -1.209301 2.362386 -0.062871
C -1.209039 -0.660751 0.018652
C 1.265518 -0.704670 -0.133881
C -2.374050 0.161795 0.047236
C 2.353152 0.391552 -0.250256
C -1.303820 -2.072330 0.041140
C -3.631990 -0.486440 0.102514
C 4.749503 0.947410 -0.414838
C 4.089130 -1.456544 -0.275505
C -2.575372 -2.684645 0.093966
C -3.744218 -1.891922 0.125826
C -2.403209 1.682324 0.018441
H 1.263731 -1.356508 -1.032962
H 1.431824 -1.334487 0.764717
H -0.404170 -2.695557 0.022056
H -4.512121 0.165163 0.124295
H 4.299390 1.951172 -0.408052
H 5.325101 0.810072 -1.349620
H 5.438307 0.849058 0.445709
H 3.233746 -2.143103 -0.357604
H 4.622755 -1.677275 0.670044
H 4.775301 -1.672685 -1.115999
H -2.646461 -3.777958 0.111284
H -4.730842 -2.364210 0.167605
H -0.297313 1.889703 -0.099588
H -1.265269 3.380250 -0.084687


