%chk=000097207.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097207

0 1
 O   -2.396000       2.697900     -5.4499999E-02
 O   -4.275400      -1.604000      3.5700001E-02
 N   0.2447000       1.307800     -2.9400000E-02
 N   0.4526000     -0.9114000      1.6799999E-02
 N   -1.956100      -1.416600      2.9500000E-02
 N   -3.364600      0.5535000     -9.8999999E-03
 C    2.604400      0.4279000     -1.1000000E-02
 C    3.273900     -0.1221000       1.260800    
 C    3.252700     -0.1814000      -1.271500    
 C    1.099200      0.2358000     -7.4999998E-03
 C    4.775200      0.1850000       1.270300    
 C   -1.024800      0.8053000     -1.8300001E-02
 C  -0.8689000     -0.5537000      1.0200000E-02
 C    4.751100     -0.2282000      -1.194600    
 C    5.434500     -4.8900001E-02 -5.5799998E-02
 C   -2.284600       1.475700     -3.0600000E-02
 C   -3.269900     -0.8849000      1.9300001E-02
 C   -1.739100      -2.857800      5.9799999E-02
 C   -4.708900       1.120300     -1.9400001E-02
 H    2.797400       1.511400     -3.4000002E-02
 H    3.121100      -1.208300       1.319300    
 H    2.808500      0.3051000       2.157600    
 H    2.956900      0.4091000      -2.147600    
 H    2.886000      -1.201500      -1.442600    
 H    5.260000     -0.4359000       2.032200    
 H    4.937000       1.230800       1.557600    
 H   0.5047000       2.285300     -4.9500000E-02
 H    5.295400     -0.4145000      -2.115900    
 H    6.520100     -7.5400002E-02 -7.9300001E-02
 H   -2.684500      -3.406000      7.2099999E-02
 H   -1.171200      -3.113000      0.9599000    
 H   -1.172600      -3.150900     -0.8294000    
 H   -4.707900       2.212200     -4.3400001E-02
 H   -5.238000      0.7790000      0.8760000    
 H   -5.242100      0.7402000     -0.8967000    


%chk=000097207-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097207

0 1
O -2.510919 2.759078 0.147099
O -4.283371 -1.617001 -0.013307
N 0.267638 1.371520 -0.012254
N 0.482078 -0.886529 -0.134560
N -1.946788 -1.399894 -0.078153
N -3.380823 0.545450 0.066288
C 2.645403 0.458772 -0.105343
C 3.264069 0.043338 1.265367
C 3.290968 -0.376426 -1.246202
C 1.151433 0.303404 -0.097189
C 4.781845 0.336241 1.294156
C -1.031020 0.852068 0.008061
C -0.861124 -0.537775 -0.069248
C 4.801233 -0.436929 -1.116967
C 5.474230 -0.101256 0.015250
C -2.307362 1.507202 0.079655
C -3.261287 -0.873374 -0.009059
C -1.747135 -2.859389 -0.158497
C -4.767349 1.061111 0.135500
H 2.886137 1.529472 -0.275099
H 3.082963 -1.038315 1.409031
H 2.755379 0.573299 2.092705
H 3.014355 0.055770 -2.228365
H 2.855214 -1.395602 -1.229327
H 5.240492 -0.180476 2.160695
H 4.962224 1.419570 1.462997
H 0.497827 2.364502 0.024376
H 5.360432 -0.769528 -2.002241
H 6.571809 -0.147204 0.028352
H -2.740033 -3.331800 -0.145561
H -1.148085 -3.207376 0.699687
H -1.214278 -3.118354 -1.088817
H -4.704998 2.158196 0.184076
H -5.276037 0.661832 1.028102
H -5.334318 0.744203 -0.755007


