%chk=000135612.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135612

0 1
 O   -4.751100     -0.9787000     -0.3228000    
 O   -6.339600      -2.136600      0.8908000    
 N    6.134400     -0.8515000      0.1594000    
 N   0.7499000      0.5043000     -0.5545000    
 N   0.3025000       1.040600      0.4863000    
 C    4.778300     -0.5104000     -2.2100000E-02
 C   -3.383700      0.8024000      0.4610000    
 C    3.778900      -1.426400      0.3063000    
 C    4.436000      0.7435000     -0.5283000    
 C    2.101800      0.1636000     -0.3767000    
 C   -2.042200      0.4641000      0.6382000    
 C    2.437300      -1.088500      0.1284000    
 C    3.094400       1.081400     -0.7060000    
 C   -1.042700       1.379500      0.3089000    
 C   -4.452700     -0.1762000      0.8130000    
 C   -3.725800       2.056400     -4.5299999E-02
 C    6.565700      -2.230900      4.7800001E-02
 C    7.117500      0.1743000      0.4463000    
 C   -1.384800       2.633500     -0.1973000    
 C   -2.726400       2.971900     -0.3743000    
 C   -5.720400      -1.926100     -0.1433000    
 C   -5.927600      -2.690100      -1.415900    
 H    4.010600      -2.406300      0.7140000    
 H    5.189300       1.475500     -0.8052000    
 H   -1.772600     -0.5136000       1.031500    
 H    1.664700      -1.807100      0.3887000    
 H    2.836100       2.059300      -1.103700    
 H   -4.123100     -0.8145000       1.642600    
 H   -5.356300      0.3529000       1.141600    
 H   -4.767300       2.331200     -0.1898000    
 H    6.087400      -2.733400     -0.8005000    
 H    7.647100      -2.295000     -0.1176000    
 H    6.340400      -2.783500      0.9660000    
 H    7.410100      0.6986000     -0.4695000    
 H    6.737900      0.9026000       1.171900    
 H    8.024900     -0.2592000      0.8817000    
 H  -0.6132000       3.354000     -0.4562000    
 H   -2.992600       3.948200     -0.7689000    
 H   -5.000600      -3.194300      -1.700300    
 H   -6.254900      -2.010500      -2.206700    
 H   -6.702900      -3.446300      -1.263000    


%chk=000135612-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135612

0 1
O -4.801633 -1.569840 -0.075841
O -6.679691 -0.189048 -0.247447
N 6.381701 -0.732110 -0.001558
N 0.762779 0.006609 0.346624
N 0.258010 1.175547 0.015546
C 5.005573 -0.526159 0.077558
C -3.408372 0.378825 0.636243
C 4.121372 -1.570053 0.510010
C 4.424879 0.742798 -0.273722
C 2.172102 -0.092369 0.233494
C -2.012628 0.191513 0.561495
C 2.739876 -1.348796 0.582993
C 3.045403 0.951857 -0.197282
C -1.168026 1.253443 0.132220
C -4.306022 -0.750881 1.092755
C -3.971612 1.639092 0.287462
C 6.953472 -2.037580 0.359411
C 7.271084 0.351609 -0.445674
C -1.739054 2.506101 -0.215597
C -3.135118 2.694507 -0.137590
C -5.999945 -1.155844 -0.665017
C -6.323349 -2.022188 -1.863396
H 4.516634 -2.550735 0.786928
H 5.065854 1.563412 -0.607854
H -1.550925 -0.766007 0.825545
H 2.062434 -2.144279 0.911821
H 2.606795 1.918038 -0.466029
H -3.759111 -1.492990 1.694438
H -5.189447 -0.376634 1.638383
H -5.057744 1.771566 0.341562
H 6.557034 -2.849328 -0.282912
H 8.046568 -2.006926 0.232213
H 6.739551 -2.300670 1.414747
H 7.028624 0.685876 -1.474151
H 7.211336 1.232129 0.224713
H 8.312330 -0.006007 -0.442799
H -1.067336 3.308212 -0.539287
H -3.571239 3.663247 -0.404325
H -6.078038 -3.077157 -1.662424
H -5.712422 -1.694966 -2.724384
H -7.386998 -1.915112 -2.122372


