%chk=000226572.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226572

0 1
 O   -4.707700     -0.3525000     -9.0800002E-02
 O    1.152700       2.226800     -0.3921000    
 N   0.8785000     -7.1500003E-02 -2.8899999E-02
 N    1.477200      -1.296400      0.1052000    
 N    3.811600       2.169000     -8.5699998E-02
 C  -0.5628000     -0.1443000     -4.4300001E-02
 C    1.617500       1.110100     -0.1586000    
 C    2.763700      -1.358600      0.1764000    
 C    3.107000       1.001100     -2.4300000E-02
 C   -1.319900      0.9299000      0.4221000    
 C   -1.198000      -1.288800     -0.5259000    
 C    3.661400     -0.2007000      0.1379000    
 C   -3.348500     -0.2847000     -7.4600004E-02
 C   -2.712900      0.8597000      0.4071000    
 C   -2.591000      -1.359000     -0.5411000    
 C    3.391600      -2.722100      0.3184000    
 C   -5.420400      0.7822000      0.3993000    
 H  -0.8620000       1.821100      0.8396000    
 H  -0.6385000      -2.137200     -0.9107000    
 H    4.730500     -0.3420000      0.2368000    
 H   -3.240100       1.726200      0.7917000    
 H   -3.080800      -2.251500     -0.9208000    
 H    3.082800      -3.351100     -0.5218000    
 H    3.049400      -3.180700       1.250800    
 H    4.483100      -2.665400      0.3324000    
 H    4.820700       2.156100     -4.3000001E-03
 H    3.323600       3.046600     -0.2142000    
 H   -5.217800      0.9565000       1.461400    
 H   -6.488100      0.5562000      0.3105000    
 H   -5.230200       1.671500     -0.2111000    


%chk=000226572-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226572

0 1
O -4.743010 -0.439545 0.060683
O 1.195930 2.338226 0.275397
N 0.941189 -0.034699 0.088729
N 1.514223 -1.317721 -0.011326
N 3.840071 2.180419 0.260757
C -0.516113 -0.067825 0.087455
C 1.691004 1.157054 0.181923
C 2.852686 -1.408314 -0.020352
C 3.164890 0.989613 0.167344
C -1.306842 1.107686 0.152215
C -1.166335 -1.332580 0.015613
C 3.728705 -0.281260 0.066280
C -3.354093 -0.239106 0.073726
C -2.716710 1.020947 0.144863
C -2.565453 -1.415379 0.009347
C 3.405603 -2.813887 -0.131890
C -5.593971 0.750927 0.121914
H -0.821541 2.081563 0.209803
H -0.557351 -2.235119 -0.035675
H 4.812881 -0.431155 0.052774
H -3.295343 1.948077 0.195665
H -3.069789 -2.384806 -0.045635
H 2.578622 -3.539215 -0.180289
H 4.042081 -3.059221 0.738386
H 4.026225 -2.924288 -1.040508
H 4.854107 2.231689 0.265218
H 3.263252 3.022908 0.328906
H -5.425867 1.317986 1.058252
H -6.625383 0.369505 0.098942
H -5.421069 1.414021 -0.748120


