%chk=000138854.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138854

0 1
 O   -1.813700      -1.485500      0.1705000    
 N  -0.8712000      0.6330000     -0.1852000    
 C   -3.276700      0.3977000     -0.1984000    
 C   -1.911800     -0.2815000     -4.8999999E-02
 C   -4.304500     -0.5555000     -0.8047000    
 C   -3.759800      0.9081000       1.157900    
 C   0.5188000      0.3775000     -0.1092000    
 C    3.239000     -0.1217000      3.9400000E-02
 C    1.409700       1.425300     -0.2721000    
 C   0.9583000     -0.9145000      0.1265000    
 C    2.779700       1.173800     -0.1973000    
 C    2.328400      -1.165900      0.2014000    
 C    4.703800     -0.3907000      0.1200000    
 H   -3.174900       1.251500     -0.8801000    
 H   -3.952300     -0.9429000      -1.766900    
 H   -5.258100     -4.4300001E-02 -0.9733000    
 H   -4.491300      -1.414500     -0.1508000    
 H   -4.725700       1.415000       1.064600    
 H   -3.043900       1.619200       1.584300    
 H   -3.870800      8.6099997E-02   1.873900    
 H   -1.119400       1.605100     -0.3554000    
 H    1.062500       2.438000     -0.4573000    
 H   0.3195000      -1.774400      0.2613000    
 H    3.479300       1.995300     -0.3268000    
 H    2.675500      -2.179600      0.3844000    
 H    4.915900      -1.220700      0.8026000    
 H    5.094400     -0.6425000     -0.8708000    
 H    5.245800      0.4822000      0.4994000    


%chk=000138854-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000138854

0 1
O -1.876174 -1.324718 0.625880
N -0.875395 0.644077 -0.176109
C -3.343627 0.525294 -0.045411
C -1.972746 -0.145967 0.168437
C -4.175130 -0.317213 -1.046021
C -4.070442 0.643765 1.318845
C 0.515108 0.334472 -0.096758
C 3.336165 -0.143867 0.008412
C 1.435194 1.332208 -0.515570
C 1.009412 -0.908180 0.380327
C 2.822128 1.092708 -0.460482
C 2.402603 -1.125845 0.426788
C 4.830816 -0.413268 0.036690
H -3.203856 1.543664 -0.465235
H -3.687695 -0.374278 -2.036315
H -5.179600 0.124295 -1.177950
H -4.288958 -1.345347 -0.660367
H -5.076085 1.081069 1.182033
H -3.508608 1.279261 2.027480
H -4.179289 -0.358208 1.769349
H -1.094431 1.576976 -0.533598
H 1.065188 2.299588 -0.881156
H 0.303080 -1.673122 0.707472
H 3.515144 1.878159 -0.785584
H 2.771331 -2.088958 0.800979
H 5.101312 -1.106354 0.852870
H 5.172393 -0.874447 -0.910815
H 5.408665 0.517833 0.174709


