%chk=000119507.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000119507

0 1
 O    1.216200      0.1282000      -2.263700    
 O    3.219600      -1.144300       1.681900    
 O   -4.750800      -1.053800      1.4700000E-02
 N    1.359100      0.1789000       1.208300    
 N    2.508800     -0.6797000     -0.4975000    
 C   0.6488000      0.6886000      4.6500001E-02
 C   0.8788000       2.202000     -5.5100001E-02
 C    1.468900      2.3100000E-02  -1.069600    
 C  -0.7997000      0.2208000      3.7999999E-02
 C    2.461900     -0.6124000      0.8808000    
 C   0.2577000       2.941800       1.116700    
 C   -1.177600     -0.8966000      0.7834000    
 C   -1.751000      0.9098000     -0.7149000    
 C    3.499100      -1.428500      -1.244900    
 C   -2.505200      -1.324600      0.7755000    
 C   -3.078600      0.4820000     -0.7226000    
 C   -3.455700     -0.6353000      2.2500001E-02
 H    1.955300       2.422500     -6.6399999E-02
 H   0.4898000       2.609200     -0.9955000    
 H    1.090100      0.3746000       2.167900    
 H  -0.8255000       2.804600       1.174800    
 H   0.6950000       2.635900       2.071900    
 H   0.4413000       4.016400       1.009300    
 H  -0.4670000      -1.470300       1.370800    
 H   -1.489800       1.771800      -1.319900    
 H    3.713100     -0.9204000      -2.189100    
 H    3.083300      -2.416600      -1.462500    
 H    4.412300      -1.544300     -0.6558000    
 H   -2.785900      -2.198400       1.357500    
 H   -3.814100       1.020500      -1.314100    
 H   -4.831900      -1.838600      0.5836000    


%chk=000119507-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000119507

0 1
O 1.251621 0.356478 -2.324400
O 3.381327 -1.290994 1.534756
O -4.790832 -1.051777 -0.116292
N 1.496435 0.132257 1.227153
N 2.499754 -0.696428 -0.610966
C 0.715657 0.705761 0.114679
C 0.821620 2.264454 0.084502
C 1.487415 0.121911 -1.113593
C -0.745161 0.213588 0.088367
C 2.543208 -0.682992 0.826110
C 0.165313 2.952419 1.298125
C -1.247293 -0.683432 1.059369
C -1.616182 0.648865 -0.947170
C 3.451320 -1.452392 -1.427629
C -2.589598 -1.121859 1.020545
C -2.953733 0.217886 -0.999705
C -3.444439 -0.665023 -0.009277
H 1.894055 2.533607 0.027883
H 0.355850 2.616674 -0.853375
H 1.360222 0.373312 2.206232
H -0.906771 2.698985 1.372924
H 0.655379 2.668172 2.248908
H 0.250047 4.049729 1.205948
H -0.587551 -1.060403 1.847361
H -1.237612 1.304539 -1.737807
H 3.991833 -0.776919 -2.111985
H 2.925841 -2.214245 -2.028225
H 4.162568 -1.941990 -0.743341
H -2.960292 -1.817315 1.784924
H -3.625938 0.544141 -1.798474
H -5.037767 -1.680110 0.606953


