%chk=000121134.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121134

0 1
 O    5.375000      -2.345200      0.6460000    
 O  -0.5169000       2.469700       1.443700    
 O   -5.748200      -1.972200      0.8439000    
 O   -5.653600      -1.723800      -1.335200    
 N    4.085000     -4.6100002E-02 -0.4272000    
 N   0.2007000       1.884500     -0.6833000    
 N   -5.213500      -1.489500     -0.1837000    
 C    2.923000      0.6502000     -0.9753000    
 C    3.818700     -0.5078000      0.9421000    
 C    4.460800      -1.183800      -1.278100    
 C    2.605000       1.889500     -0.1370000    
 C    5.040700      -1.241100       1.487900    
 C    5.666900      -1.902100     -0.6799000    
 C    1.407500       2.665200     -0.6781000    
 C  -0.6760000       1.850500      0.3950000    
 C   -1.865900      0.9740000      0.2431000    
 C   -2.451900      0.4448000       1.374000    
 C   -2.347200      0.7179000      -1.024200    
 C   -3.569300     -0.3777000       1.231500    
 C   -3.464800     -0.1046000      -1.166700    
 C   -4.075900     -0.6524000     -3.8699999E-02
 H    2.055400     -2.0199999E-02  -1.020100    
 H    3.138100      0.9724000      -2.001900    
 H    3.636600      0.3170000       1.635100    
 H    2.949200      -1.177500      0.9607000    
 H    3.622900      -1.888100      -1.363400    
 H    4.717600     -0.8375000      -2.285700    
 H    2.357400       1.631200      0.8967000    
 H    3.476400       2.555300     -0.1099000    
 H    4.823400      -1.638200       2.484800    
 H    5.907100     -0.5744000       1.578300    
 H    6.554500      -1.257800     -0.6635000    
 H    5.910000      -2.785100      -1.279600    
 H    1.250100       3.566300     -7.4900001E-02
 H    1.594100       2.983300      -1.709300    
 H   4.6700001E-02   1.295900      -1.494500    
 H   -2.066600      0.6448000       2.369400    
 H   -1.922800       1.152200      -1.923200    
 H   -4.018800     -0.7880000       2.132300    
 H   -3.836900     -0.2909000      -2.171100    


%chk=000121134-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121134

0 1
O 5.872490 -2.338235 0.504489
O -0.566555 2.487396 1.381193
O -6.255971 -1.595712 1.012614
O -6.029063 -1.711052 -1.254568
N 4.219466 -0.093306 -0.340380
N 0.134487 1.794297 -0.724551
N -5.635761 -1.325832 -0.086334
C 2.997144 0.566239 -0.860504
C 4.009422 -0.760299 0.973228
C 4.775552 -1.065469 -1.320382
C 2.570014 1.794395 -0.032124
C 5.328181 -1.372300 1.472830
C 6.085912 -1.666197 -0.787385
C 1.390707 2.568937 -0.667699
C -0.771140 1.813718 0.321548
C -2.026576 0.986451 0.150983
C -2.754229 0.672267 1.328046
C -2.515895 0.547810 -1.108527
C -3.936207 -0.086845 1.262847
C -3.699444 -0.210130 -1.193732
C -4.388439 -0.522266 -0.002246
H 2.141736 -0.158721 -0.927680
H 3.220745 0.899005 -1.894886
H 3.658215 -0.018712 1.712747
H 3.235042 -1.566158 0.897095
H 4.053877 -1.896501 -1.528091
H 4.973885 -0.538284 -2.273414
H 2.276964 1.507611 0.993897
H 3.435960 2.478230 0.053436
H 5.172057 -1.942888 2.403082
H 6.068616 -0.562634 1.650328
H 6.843764 -0.861495 -0.670896
H 6.472209 -2.444385 -1.466243
H 1.183278 3.470625 -0.066761
H 1.646751 2.885966 -1.696824
H -0.007782 1.153594 -1.505579
H -2.372145 1.047521 2.282252
H -2.004888 0.821951 -2.038236
H -4.508773 -0.344024 2.157574
H -4.099106 -0.553868 -2.151148


