%chk=000094962.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094962

0 1
 O    2.767800     -0.1727000     -0.3603000    
 O    2.975300      -1.695200       1.352200    
 O    1.105300       2.378000       1.525100    
 N   0.3546000      0.5375000      0.2805000    
 C  -0.3903000      0.1000000     -0.8988000    
 C   -1.844000     -8.8100001E-02 -0.5643000    
 C   0.9250000     -0.4680000       1.130000    
 C   -2.290800      -1.326400     -0.1213000    
 C   -2.722900      0.9784000     -0.7027000    
 C    2.330300     -0.8552000      0.7332000    
 C   0.5063000       1.893400      0.5714000    
 C   -3.639600      -1.501200      0.1887000    
 C   -4.071500      0.8037000     -0.3927000    
 C   -4.529800     -0.4361000      5.2999999E-02
 C    4.094700     -0.4845000     -0.7982000    
 C    4.429500      0.3364000      -1.995800    
 H   5.3300001E-02 -0.8219000      -1.293700    
 H  -0.2877000      0.8581000      -1.685400    
 H   0.9789000     -7.8199998E-02   2.152500    
 H   0.3007000      -1.364600       1.127000    
 H   -1.611000      -2.167400     -2.0300001E-02
 H   -2.378800       1.948400      -1.050200    
 H   1.3500000E-02   2.533500     -0.1784000    
 H   -3.997000      -2.467000      0.5335000    
 H   -4.765000       1.632900     -0.4987000    
 H   -5.580100     -0.5721000      0.2938000    
 H    4.801500     -0.2697000      1.1200000E-02
 H    4.150900      -1.550000      -1.048300    
 H    5.439800      0.1200000      -2.355000    
 H    3.721900      0.1457000      -2.809700    
 H    4.362300       1.405400      -1.767300    


%chk=000094962-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094962

0 1
O 2.565084 -0.189459 -0.252419
O 2.313709 -1.455442 1.688537
O 1.260957 3.208442 1.255705
N 0.331559 1.311957 0.224275
C -0.359524 0.749447 -0.951715
C -1.692999 0.080418 -0.621204
C 0.776668 0.415737 1.291635
C -2.025927 -1.164976 -1.206963
C -2.626715 0.703764 0.245348
C 1.945412 -0.514952 0.949735
C 0.638882 2.662653 0.303164
C -3.274280 -1.774648 -0.943705
C -3.872318 0.095103 0.513831
C -4.201395 -1.145453 -0.082234
C 3.771384 -1.007648 -0.605449
C 4.279266 -0.488233 -1.945727
H 0.309905 0.028029 -1.457971
H -0.523189 1.586626 -1.659366
H 1.104104 1.051177 2.137431
H -0.055315 -0.218829 1.646613
H -1.306020 -1.661460 -1.869879
H -2.372610 1.662267 0.714393
H 0.262871 3.230216 -0.578470
H -3.518763 -2.739010 -1.402788
H -4.585104 0.585512 1.186230
H -5.167393 -1.617969 0.127306
H 4.511614 -0.887588 0.205604
H 3.470597 -2.070278 -0.642516
H 5.182265 -1.051117 -2.244571
H 3.517647 -0.612053 -2.734881
H 4.542727 0.580869 -1.878948


