%chk=000138363.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138363

0 1
 O   -2.161000     -0.8406000      0.4579000    
 N    2.405700     -0.2034000     -0.1582000    
 C   0.2056000     -0.4340000      0.1312000    
 C    1.223900      0.4984000     -7.8100003E-02
 C   -1.121000      2.5900001E-02  0.2509000    
 C   0.8174000      -1.718100      0.1736000    
 C   0.9812000       1.873000     -0.1742000    
 C    2.170200      -1.543600     -7.3000002E-03
 C   -1.378700       1.398300      0.1573000    
 C  -0.3422000       2.306100     -5.1899999E-02
 C   -2.801100      -1.361900     -0.7012000    
 H   0.3231000      -2.668800      0.3204000    
 H    3.315100      0.2116000     -0.3071000    
 H    1.787300       2.580400     -0.3371000    
 H    2.984900      -2.253100     -4.2100001E-02
 H   -2.397800       1.766400      0.2491000    
 H  -0.5650000       3.367800     -0.1213000    
 H   -2.091300      -1.926400      -1.314200    
 H   -3.246300     -0.5540000      -1.290800    
 H   -3.597800      -2.038100     -0.3790000    


%chk=000138363-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138363

0 1
O -2.339489 -0.644930 0.418939
N 2.368472 -0.222113 -0.219006
C 0.106288 -0.369197 0.055351
C 1.202929 0.549148 -0.116433
C -1.204038 0.173663 0.201918
C 0.664467 -1.706814 0.066231
C 1.037852 1.953710 -0.128656
C 2.041886 -1.580319 -0.102375
C -1.380960 1.569097 0.202819
C -0.270080 2.447520 0.043738
C -2.677092 -1.569007 -0.678508
H 0.129057 -2.641733 0.216510
H 3.307470 0.150867 -0.337397
H 1.886497 2.634112 -0.256785
H 2.811513 -2.349004 -0.141101
H -2.392879 1.965731 0.330850
H -0.442713 3.529373 0.049033
H -1.828188 -2.225761 -0.944075
H -2.991771 -1.002970 -1.577081
H -3.517021 -2.175474 -0.306071


