%chk=000097609.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097609

0 1
 O   -3.781500      0.6294000      0.8565000    
 N    1.515400       1.534700     -8.2800001E-02
 C   0.8746000     -0.7861000      1.9700000E-02
 C   0.5622000      0.5839000     -0.1026000    
 C   -1.790800     -1.9700000E-02 -0.2715000    
 C  -0.7759000      0.9401000     -0.2469000    
 C  -0.1460000      -1.751800     -5.2000000E-03
 C   -1.475900      -1.367400     -0.1507000    
 C   -3.212600      0.4038000     -0.4274000    
 C    2.221400      -1.145200      0.1654000    
 C    3.205800     -0.1678000      0.1862000    
 C    2.803300       1.146200      5.9400000E-02
 H   -1.035900       1.993700     -0.3407000    
 H   8.9900002E-02  -2.809500      8.9100003E-02
 H   -2.253200      -2.126300     -0.1662000    
 H   -3.287200       1.325600      -1.014700    
 H   -3.797900     -0.3653000     -0.9436000    
 H    2.510600      -2.189100      0.2633000    
 H    4.251900     -0.4276000      0.2980000    
 H    3.528500       1.953300      6.8800002E-02
 H   -4.704100      0.9022000      0.7153000    


%chk=000097609-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097609

0 1
O -4.139813 -0.506463 -0.080646
N 1.634167 1.525044 -0.412784
C 0.890944 -0.786637 0.150284
C 0.619314 0.594388 -0.200023
C -1.797480 0.136717 -0.133447
C -0.735525 1.026504 -0.335264
C -0.211573 -1.677077 0.349756
C -1.526084 -1.227288 0.211667
C -3.230568 0.627533 -0.276472
C 2.262125 -1.184198 0.276374
C 3.271390 -0.243958 0.061396
C 2.905168 1.099396 -0.281457
H -0.901584 2.076692 -0.602093
H -0.011635 -2.723074 0.613336
H -2.376024 -1.898155 0.358978
H -3.423651 1.421906 0.477428
H -3.366946 1.075001 -1.284876
H 2.501922 -2.221285 0.539774
H 4.329358 -0.510606 0.148633
H 3.685193 1.851423 -0.454101
H -5.076099 -0.198763 -0.157064


