%chk=000118456.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118456

0 1
 N  -1.1100000E-02  3.7300002E-02  -1.267700    
 N   0.4743000      -3.816400      0.6818000    
 N    3.130900       2.283400      0.7248000    
 N   -3.597700       1.475700      0.7140000    
 C    1.016300     -0.8974000      -1.730900    
 C   0.3086000       1.398600      -1.701600    
 C   -1.325700     -0.3618000      -1.755400    
 C   0.7552000      -2.323700      -1.242100    
 C    1.684300       1.849500      -1.205800    
 C   -2.432300      0.5601000      -1.238400    
 C   0.7095000      -2.432900      0.2831000    
 C    1.805600       1.828600      0.3190000    
 C   -2.516000      0.5942000      0.2886000    
 C  -0.8173000      -4.285000      0.1771000    
 C   0.5290000      -3.948700       2.138500    
 C    4.164900       1.391300      0.1978000    
 C    3.223600       2.362900       2.183400    
 C   -3.351100       2.846800      0.2649000    
 C   -3.751100       1.437500       2.169100    
 H    1.089300     -0.8979000      -2.826400    
 H    2.005600     -0.6418000      -1.340900    
 H   0.2759000       1.485500      -2.795600    
 H  -0.4032000       2.124700      -1.296900    
 H   -1.356300     -0.3814000      -2.852700    
 H   -1.599700      -1.362800      -1.409100    
 H  -0.1340000      -2.718700      -1.738000    
 H    1.581000      -2.951000      -1.607100    
 H    2.461800       1.281700      -1.721300    
 H    1.828100       2.885400      -1.545300    
 H   -2.320500       1.546700      -1.693500    
 H   -3.386700      0.1772000      -1.627400    
 H  -6.1999999E-02  -1.774300      0.7010000    
 H    1.673800      -2.092600      0.6820000    
 H    1.603000      0.8267000      0.7170000    
 H    1.042200       2.499200      0.7341000    
 H   -1.562400      0.9138000      0.7272000    
 H   -2.708500     -0.4256000      0.6460000    
 H   -1.068500      -5.257300      0.6190000    
 H   -1.635800      -3.594900      0.4124000    
 H  -0.7963000      -4.468300     -0.9010000    
 H   0.4098000      -4.996600       2.435700    
 H    1.505000      -3.626400       2.518300    
 H  -0.2479000      -3.357300       2.636600    
 H    3.958200      0.3361000      0.4114000    
 H    5.138400       1.632900      0.6424000    
 H    4.312300       1.521300     -0.8780000    
 H    2.470200       3.052400       2.580300    
 H    3.083300       1.386000       2.660400    
 H    4.199000       2.759100       2.487200    
 H   -2.345500       3.199000      0.5226000    
 H   -4.069900       3.534100      0.7282000    
 H   -3.511200       2.962900     -0.8108000    
 H   -4.600100       2.054300       2.484100    
 H   -2.853600       1.792600       2.688700    
 H   -3.964900      0.4174000       2.507300    


%chk=000118456-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000118456

0 1
N 0.003601 0.018888 -2.011067
N 0.520160 -3.419265 0.820434
N 2.669617 2.156587 0.892845
N -3.185254 1.229290 0.909486
C 0.602374 -1.276006 -2.435451
C 0.826787 1.194913 -2.404983
C -1.426705 0.155362 -2.400829
C 0.232774 -2.456238 -1.507553
C 2.019196 1.452399 -1.454629
C -2.239873 1.049449 -1.436246
C 0.859156 -2.308889 -0.107363
C 1.555177 1.912165 -0.059169
C -2.412321 0.398839 -0.050071
C -0.903092 -3.426805 1.216753
C 1.405325 -3.418661 2.004121
C 3.368396 0.918943 1.296637
C 2.210000 2.920072 2.072089
C -2.462419 2.445686 1.334764
C -3.625080 0.434293 2.075379
H 0.314829 -1.528569 -3.487243
H 1.703193 -1.159779 -2.434772
H 1.204215 1.089879 -3.453107
H 0.172818 2.088078 -2.399926
H -1.524584 0.551479 -3.442957
H -1.878188 -0.855176 -2.410445
H -0.869069 -2.531040 -1.433496
H 0.586497 -3.402708 -1.960924
H 2.628036 0.531471 -1.376370
H 2.674535 2.231931 -1.889875
H -1.738964 2.032354 -1.343610
H -3.241077 1.241078 -1.869116
H 0.567052 -1.313874 0.314632
H 1.962202 -2.300752 -0.218987
H 0.824857 1.164391 0.342742
H 1.006449 2.868814 -0.173651
H -1.401418 0.134942 0.352654
H -2.966525 -0.552650 -0.178606
H -1.090184 -4.275873 1.898382
H -1.218580 -2.484687 1.738237
H -1.549547 -3.559160 0.332804
H 1.169243 -4.286041 2.646700
H 2.458407 -3.508103 1.682279
H 1.312995 -2.491516 2.628278
H 2.693205 0.178463 1.801324
H 4.185940 1.170101 1.995975
H 3.819411 0.424975 0.419396
H 1.771725 3.880324 1.746002
H 1.438911 2.378201 2.680235
H 3.068349 3.142054 2.731601
H -1.487928 2.221018 1.843787
H -3.092226 3.020851 2.036951
H -2.251557 3.092916 0.466860
H -4.249698 1.059142 2.739071
H -2.774563 0.028773 2.683759
H -4.236780 -0.420231 1.734368


