%chk=000129646.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129646

0 1
 O   -4.645600      0.1531000      0.6547000    
 N    3.104600     -0.2546000     -0.3814000    
 C    1.745200     -4.7899999E-02  0.1264000    
 C   0.7278000     -0.3807000     -0.9803000    
 C  -0.7102000     -0.2377000     -0.5426000    
 C    1.628500       1.395900      0.6151000    
 C    4.084300     -6.6999998E-03  0.6632000    
 C   -1.363600      -1.328300      7.8999996E-03
 C   -1.349200      0.9816000     -0.6998000    
 C    5.497400     -0.2171000      0.1599000    
 C   -2.692100      -1.196300      0.4120000    
 C   -2.677800       1.113900     -0.2955000    
 C   -3.349300      2.4800001E-02  0.2604000    
 H    1.562000     -0.7215000      0.9744000    
 H   0.8877000      -1.408000      -1.336600    
 H   0.9006000      0.2582000      -1.857900    
 H    3.201300      -1.210000     -0.7245000    
 H   0.6082000       1.634600      0.9269000    
 H    1.914000       2.114300     -0.1618000    
 H    2.222400       1.593500       1.512500    
 H    4.065500       1.027400       1.016300    
 H    3.911700     -0.6657000       1.522400    
 H  -0.8594000      -2.282300      0.1321000    
 H  -0.8394000       1.834500      -1.138700    
 H    5.647600      -1.247500     -0.1799000    
 H    5.725600      0.4543000     -0.6751000    
 H    6.220000     -1.8999999E-02  0.9584000    
 H   -3.203800      -2.052100      0.8441000    
 H   -3.184700       2.067100     -0.4178000    
 H   -4.950800     -0.6971000       1.015400    


%chk=000129646-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129646

0 1
O -4.784727 -0.025301 0.568953
N 3.139268 -0.097178 -0.300911
C 1.756809 0.117730 0.199595
C 0.777868 -0.146083 -0.984269
C -0.688567 -0.134812 -0.584124
C 1.593881 1.543463 0.764514
C 4.216349 -0.083906 0.714893
C -1.257953 -1.227619 0.118186
C -1.528535 0.970834 -0.881005
C 5.555483 -0.510245 0.088163
C -2.612767 -1.222824 0.515830
C -2.883966 0.995754 -0.493033
C -3.425096 -0.104540 0.208800
H 1.502464 -0.606975 1.017910
H 1.034553 -1.133532 -1.423477
H 0.979227 0.612881 -1.763262
H 3.189630 -0.960235 -0.863759
H 0.546520 1.721628 1.064482
H 1.879684 2.285298 -0.003745
H 2.230482 1.703080 1.652804
H 4.314910 0.942205 1.115959
H 3.984815 -0.747888 1.587562
H -0.636897 -2.101321 0.351986
H -1.114362 1.826412 -1.427675
H 5.503899 -1.545666 -0.301739
H 5.816582 0.158441 -0.751086
H 6.368964 -0.472795 0.834739
H -3.032550 -2.082758 1.054900
H -3.530989 1.847113 -0.724437
H -5.066481 -0.840461 1.053448


