%chk=000128888.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128888

0 1
 O   -2.510600     -0.4005000       1.754600    
 O    1.867900       1.887000     -0.5631000    
 O    3.211100       1.383400       1.193300    
 O   -3.001300      0.6972000      -1.622700    
 N   -2.539200     -0.3901000      0.3501000    
 N    4.233400     -0.7441000     -0.2588000    
 C   0.4123000     -0.9102000     -0.3137000    
 C    1.864200      -1.313600     -3.7000000E-02
 C  -0.6263000      -1.940000      0.1491000    
 C    2.874900     -0.2817000     -0.5549000    
 C   -2.067800      -1.614400     -0.2310000    
 C    2.696700       1.062700      0.1292000    
 C   -2.974200      0.6828000     -0.3914000    
 C   -3.441100       1.881600      0.3963000    
 H   0.1931000      3.9700001E-02  0.1858000    
 H   0.2886000     -0.7409000      -1.390600    
 H    1.987700      -1.451900       1.045400    
 H    2.058900      -2.286100     -0.5072000    
 H  -0.5441000      -2.060600       1.236500    
 H  -0.3728000      -2.914200     -0.2879000    
 H    2.780200     -0.1510000      -1.638700    
 H   -2.725100      -2.417900      0.1214000    
 H   -2.160400      -1.577100      -1.321800    
 H    4.909600     -0.1040000     -0.6743000    
 H    4.390500      -1.648300     -0.7025000    
 H   -3.752600       2.675700     -0.2880000    
 H   -2.625600       2.254700       1.021800    
 H   -4.290700       1.603300       1.025900    
 H   -3.363500     -0.8274000       1.944100    
 H    1.746300       2.748200     -0.1093000    


%chk=000128888-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128888

0 1
O -2.642907 -0.273113 1.704319
O 1.689569 1.688639 0.599307
O 4.003048 1.627085 0.601928
O -2.726882 0.397442 -1.836129
N -2.739554 -0.554464 0.272678
N 4.093020 -0.743527 -0.735957
C 0.265507 -0.907629 -0.308046
C 1.750339 -1.182331 0.009823
C -0.657100 -1.996577 0.281497
C 2.760760 -0.152277 -0.590754
C -2.139556 -1.842599 -0.129675
C 2.915988 1.111421 0.255060
C -2.861791 0.548968 -0.584436
C -3.207174 1.875452 0.075913
H -0.022533 0.081420 0.089253
H 0.123683 -0.859846 -1.407610
H 1.914885 -1.256009 1.101907
H 2.038869 -2.166193 -0.410505
H -0.581459 -1.993006 1.385957
H -0.326474 -2.998920 -0.061097
H 2.322266 0.203699 -1.558923
H -2.744950 -2.662367 0.302935
H -2.245683 -1.873364 -1.228441
H 4.875396 -0.103644 -0.581399
H 4.205035 -1.399617 -1.508236
H -3.261426 2.642991 -0.710033
H -2.445583 2.152427 0.824469
H -4.178719 1.824751 0.599840
H -3.519232 -0.562774 2.081375
H 1.862757 2.516264 1.125580


