%chk=000043260.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043260

0 1
 O    1.984800      0.9801000      -1.531300    
 O    1.646600      -1.571900     -6.5899998E-02
 O   -3.469700      0.4736000      0.1187000    
 N    3.462300       2.063100      0.6928000    
 C    1.328600       1.258300     -0.2877000    
 C   0.1776000      0.3215000     -0.1251000    
 C    2.344400       1.138200      0.8651000    
 C   0.3873000      -1.053700     -2.1199999E-02
 C   -1.118600      0.8348000     -7.8299999E-02
 C   -2.205000     -2.7100001E-02  7.2499998E-02
 C  -0.6993000      -1.915400      0.1297000    
 C   -1.995400      -1.402100      0.1764000    
 C    1.768900      -2.988300      4.7699999E-02
 C   -3.612400       1.888900      6.6000000E-03
 H   0.9740000       2.294900     -0.3461000    
 H    2.792600      0.1454000      0.9307000    
 H    1.851100       1.341100       1.822800    
 H   -1.229300       1.910500     -0.1634000    
 H  -0.6139000      -2.993000      0.2167000    
 H   -2.838700      -2.077300      0.2941000    
 H    2.743900       1.584200      -1.599200    
 H    4.075600       2.006900       1.504900    
 H    3.112300       3.019900      0.6648000    
 H    1.286600      -3.503900     -0.7897000    
 H    1.414600      -3.347500       1.019900    
 H    2.836800      -3.224100     -7.3000002E-03
 H   -3.134600       2.409500      0.8435000    
 H   -4.683300       2.110600      6.3000001E-02
 H   -3.262300       2.253400     -0.9652000    


%chk=000043260-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043260

0 1
O 2.036930 1.115553 -1.449623
O 1.685428 -1.532658 0.076135
O -3.614087 0.425439 0.075443
N 3.604571 1.934381 0.535960
C 1.321749 1.332611 -0.192972
C 0.170610 0.348607 -0.047546
C 2.354686 1.270708 0.982748
C 0.356345 -1.060874 0.058736
C -1.151000 0.855073 -0.039721
C -2.271851 -0.003025 0.064539
C -0.766486 -1.920687 0.153391
C -2.073651 -1.397384 0.157191
C 1.892227 -2.977415 -0.010237
C -3.859346 1.861564 -0.046187
H 0.882146 2.358518 -0.205561
H 2.590140 0.214466 1.185228
H 1.906784 1.716221 1.895043
H -1.283197 1.937656 -0.140047
H -0.634663 -3.003962 0.227980
H -2.946003 -2.053926 0.228258
H 2.984185 1.377566 -1.205694
H 4.465263 1.528057 0.910357
H 3.600661 2.957177 0.604845
H 1.416613 -3.397252 -0.917690
H 1.505754 -3.502280 0.886533
H 2.983127 -3.107934 -0.071341
H -3.412334 2.422429 0.798925
H -4.953829 1.971053 -0.023483
H -3.465271 2.260919 -1.001708


