%chk=000118063.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118063

0 1
 O   0.8788000       2.480600      7.1000002E-02
 N    2.475600     -0.1571000      -1.282400    
 N    1.668600     -0.1019000      0.9637000    
 C    3.126100      -2.008500      0.1665000    
 C    3.505600      -1.145000      -1.051300    
 C    2.711400      -1.076900       1.327500    
 C    1.981600      -2.979700     -0.1845000    
 C    4.347400      -2.840200      0.5956000    
 C    1.652000      0.2848000     -0.2708000    
 C   0.6067000       1.302400     -0.6610000    
 C  -0.7738000      0.7919000     -0.3647000    
 C   -1.463900      7.4699998E-02  -1.334500    
 C   -1.347800       1.042500      0.8762000    
 C   -3.330400     -0.1519000      0.1831000    
 C   -4.702000     -0.6581000      0.4775000    
 C   -2.746900     -0.3988000      -1.059700    
 C   -2.630700      0.5689000       1.151100    
 C    2.184900       2.980600     -0.1969000    
 C   -4.784500      -2.195700      0.4320000    
 C   -5.766800     -5.0099999E-02 -0.4550000    
 C    2.408100       4.237700      0.6166000    
 H    4.450700     -0.6195000     -0.8706000    
 H    3.639800      -1.759600      -1.948400    
 H    2.337700      -1.674900       2.167400    
 H    3.578800     -0.5190000       1.702400    
 H    1.718900      -3.603400      0.6776000    
 H    1.072700      -2.456600     -0.4986000    
 H    2.273300      -3.649800      -1.001200    
 H    5.193200      -2.196800      0.8629000    
 H    4.115500      -3.462400       1.467400    
 H    4.676800      -3.503700     -0.2120000    
 H    2.393600      0.2216000      -2.221400    
 H   0.6754000       1.541300      -1.730200    
 H   -1.018100     -0.1257000      -2.304800    
 H  -0.8213000       1.593300       1.650400    
 H   -4.977700     -0.3621000       1.498900    
 H   -3.273200     -0.9584000      -1.828000    
 H   -3.069400      0.7685000       2.125100    
 H    2.965000       2.268000      8.7600000E-02
 H    2.282000       3.211300      -1.263800    
 H   -4.600100      -2.586200     -0.5746000    
 H   -5.777600      -2.536000      0.7448000    
 H   -4.047100      -2.644900       1.106500    
 H   -5.736500       1.044600     -0.4185000    
 H   -6.769900     -0.3689000     -0.1514000    
 H   -5.621300     -0.3552000      -1.496900    
 H    3.401500       4.654800      0.4290000    
 H    1.655600       4.994400      0.3708000    
 H    2.309400       4.026900       1.686700    


%chk=000118063-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000118063

0 1
O 0.659634 1.902445 1.308461
N 1.730440 -0.629692 1.073022
N 2.076914 -0.201927 -1.276633
C 3.627731 -1.821107 0.002892
C 2.516497 -1.869736 1.095026
C 2.949770 -1.407644 -1.342688
C 4.706079 -0.778020 0.392004
C 4.263779 -3.220953 -0.139495
C 1.536119 0.068545 -0.108481
C 0.551156 1.246377 -0.004045
C -0.895583 0.780267 -0.190769
C -1.267191 0.139399 -1.400244
C -1.875804 0.980141 0.807000
C -3.589055 -0.099257 -0.606269
C -5.032763 -0.562200 -0.822398
C -2.593980 -0.290622 -1.602274
C -3.203989 0.541405 0.596614
C 1.875745 2.729996 1.434850
C -5.121233 -2.100836 -1.006623
C -5.695993 0.174373 -2.017102
C 1.863696 3.351726 2.830264
H 1.864342 -2.750802 0.912022
H 2.975682 -1.997588 2.093711
H 3.732120 -1.212334 -2.100956
H 2.347475 -2.259438 -1.725731
H 5.505197 -0.743580 -0.371620
H 4.272724 0.234816 0.471964
H 5.172708 -1.032257 1.362912
H 3.506169 -3.982198 -0.407025
H 5.036342 -3.219702 -0.931092
H 4.749718 -3.538418 0.803209
H 1.273440 -0.267709 1.911811
H 0.824191 1.953082 -0.814857
H -0.504645 -0.026312 -2.170433
H -1.592859 1.486535 1.733838
H -5.605203 -0.301320 0.091141
H -2.856933 -0.779312 -2.548633
H -3.955291 0.703906 1.380311
H 2.777159 2.098026 1.284055
H 1.865814 3.511920 0.646010
H -4.581256 -2.423718 -1.916303
H -6.175129 -2.421469 -1.108159
H -4.677751 -2.631535 -0.144906
H -5.669166 1.269616 -1.874150
H -6.751489 -0.136751 -2.130412
H -5.172453 -0.054957 -2.963992
H 2.749768 3.997437 2.970057
H 0.957182 3.964826 2.972914
H 1.877870 2.568355 3.608299


