%chk=000161197.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161197

0 1
 O  -9.6299998E-02   1.384700      -1.448800    
 O   -2.239400       2.349200       1.159300    
 O    3.611400      -1.348800       1.521900    
 O   -4.175700       2.095300      9.8999999E-03
 O    4.637500      -1.488400     -0.4952000    
 O   -3.155700      -3.144600      0.6110000    
 O   -2.249000      -2.319400      -1.299600    
 N   -1.120300      0.1964000      0.2644000    
 N    4.921100       1.253300     -0.4965000    
 C    2.491100      0.9544000     -0.4596000    
 C    1.277200      0.3805000      0.2740000    
 C   -2.482700      0.3698000     -0.1834000    
 C    3.812000      0.6749000      0.2659000    
 C  -3.2299999E-02  0.7251000     -0.4150000    
 C   -3.360600     -0.8056000      0.2555000    
 C   -3.067400       1.677900      0.3235000    
 C    4.082500     -0.8155000      0.3645000    
 C   -2.853300      -2.139200     -0.2519000    
 H    2.361900       2.038600     -0.5769000    
 H    2.519000      0.5328000      -1.474000    
 H    1.339300     -0.7122000      0.3260000    
 H    1.239500      0.7711000       1.297800    
 H   -2.463500      0.4392000      -1.278100    
 H    3.817000       1.109900       1.271200    
 H  -0.9639000     -0.2758000       1.150600    
 H   -4.389100     -0.6807000     -0.1014000    
 H   -3.393100     -0.8412000       1.352200    
 H    4.789800       2.261600     -0.5736000    
 H    4.907200      0.8985000      -1.452600    
 H   -2.636300       3.190100       1.471500    
 H    3.777100      -2.314200       1.573500    
 H   -2.831100      -4.012500      0.2888000    


%chk=000161197-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161197

0 1
O -0.260984 1.526250 -1.154521
O -2.369655 2.266551 1.706214
O 3.904213 -0.233502 2.123436
O -4.469601 1.657232 0.929236
O 4.853935 -1.519549 0.441826
O -3.163034 -3.185228 -0.587967
O -2.493107 -1.530702 -2.076226
N -1.110135 0.184473 0.541237
N 4.868502 0.739652 -1.208859
C 2.404860 0.474376 -0.626982
C 1.326648 0.583855 0.474588
C -2.497903 0.393206 0.139966
C 3.877103 0.680221 -0.127431
C -0.062063 0.811855 -0.128331
C -3.326278 -0.910368 0.168900
C -3.232405 1.475607 0.950326
C 4.281090 -0.465177 0.794507
C -2.934019 -1.851738 -0.953943
H 2.199309 1.261997 -1.376370
H 2.331516 -0.497529 -1.151691
H 1.332242 -0.302176 1.135705
H 1.555471 1.456886 1.119457
H -2.450400 0.770370 -0.904188
H 3.905315 1.614302 0.465325
H -0.918051 -0.299436 1.420052
H -4.394857 -0.650242 0.041980
H -3.239972 -1.434972 1.136493
H 4.625671 1.376405 -1.971130
H 5.195916 -0.179484 -1.521644
H -2.894074 2.985939 2.153038
H 4.176436 -1.014247 2.679688
H -2.947791 -3.779626 -1.357788


