%chk=000162660.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162660

0 1
 O  -0.2760000     -5.7700001E-02  -1.389200    
 O    6.027200       1.232200     -0.4233000    
 N   -2.626700     -0.4585000     -0.1432000    
 N   0.8849000     -0.5954000      0.5857000    
 C   -1.427700      -1.134400      0.3859000    
 C   -1.417700      -2.632300      5.1199999E-02
 C   -3.857400      -1.104000      0.3484000    
 C   -2.689400      -3.322400      0.5237000    
 C   -3.909900      -2.587800     -1.1900000E-02
 C   -2.659200      0.9647000      0.2169000    
 C  -0.2168000     -0.5281000     -0.2577000    
 C   -3.891900       1.636500     -0.3854000    
 C   -3.956700       3.116000     -4.4000000E-03
 C    2.196000     -0.1294000      0.3284000    
 C   -5.161900       3.800300     -0.6292000    
 C    3.118100     -0.9804000     -0.2625000    
 C    2.536800       1.170700      0.6713000    
 C    4.410500     -0.5209000     -0.5161000    
 C    3.829200       1.630100      0.4175000    
 C    2.767300      -2.383700     -0.6381000    
 C    1.555300       2.100400       1.308300    
 C    4.766000      0.7843000     -0.1761000    
 H   -1.384100      -1.006500       1.476400    
 H  -0.5495000      -3.118900      0.5128000    
 H   -1.309500      -2.779000      -1.032400    
 H   -4.753900     -0.6952000     -0.1227000    
 H   -3.959500     -0.9845000       1.435100    
 H   -2.716800      -3.335300       1.620100    
 H   -2.699500      -4.365000      0.1876000    
 H   -3.959900      -2.703400      -1.102200    
 H   -4.820600      -3.037900      0.3997000    
 H   -1.777300       1.494800     -0.1580000    
 H   -2.663700       1.089200       1.308000    
 H   -4.828000       1.209700     -1.6799999E-02
 H   -3.882300       1.532400      -1.477500    
 H   -3.045000       3.626000     -0.3368000    
 H   -4.007300       3.219800       1.085800    
 H   0.7979000      -1.136400       1.443200    
 H   -5.185200       4.857700     -0.3475000    
 H   -5.124500       3.740900      -1.721600    
 H   -6.095300       3.338800     -0.2914000    
 H    5.143900      -1.176500     -0.9794000    
 H    4.117100       2.645900      0.6775000    
 H    2.005700      -2.389300      -1.424800    
 H    3.635200      -2.934400      -1.017000    
 H    2.392600      -2.933200      0.2319000    
 H    2.023100       3.044700       1.607900    
 H   0.7480000       2.339800      0.6086000    
 H    1.129300       1.652500       2.212400    
 H    6.541200      0.5171000     -0.8361000    


%chk=000162660-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000162660

0 1
O -0.163158 -0.337871 -1.716575
O 5.959478 1.486208 -0.446886
N -2.748797 -0.628812 -0.102660
N 0.735293 -0.510254 0.440348
C -1.513729 -1.443817 0.036813
C -1.642753 -2.779835 -0.742654
C -3.945395 -1.375945 0.366014
C -2.882787 -3.577217 -0.292159
C -4.140496 -2.692199 -0.409712
C -2.622687 0.704857 0.541882
C -0.272514 -0.695123 -0.510059
C -3.751775 1.687359 0.167984
C -3.449088 3.124408 0.653123
C 2.059791 0.002134 0.192867
C -4.587524 4.115349 0.328914
C 3.167855 -0.838498 0.502901
C 2.257060 1.322670 -0.310039
C 4.479115 -0.351099 0.302163
C 3.578786 1.775966 -0.518420
C 2.951637 -2.245850 1.031766
C 1.091871 2.244752 -0.600306
C 4.679340 0.948545 -0.216164
H -1.333319 -1.690975 1.124711
H -0.719399 -3.373971 -0.596784
H -1.713770 -2.528970 -1.816664
H -4.831333 -0.732787 0.229499
H -3.867620 -1.605316 1.464667
H -2.758285 -3.905443 0.761051
H -2.988229 -4.492523 -0.904564
H -4.329698 -2.454617 -1.473784
H -5.031244 -3.219211 -0.016911
H -1.668815 1.148382 0.203186
H -2.563250 0.614784 1.660820
H -4.718863 1.365515 0.602563
H -3.870453 1.677833 -0.932849
H -2.507616 3.477123 0.184106
H -3.268291 3.113728 1.748018
H 0.553909 -0.906210 1.366936
H -4.346957 5.136367 0.677929
H -4.770250 4.164262 -0.760924
H -5.532999 3.806318 0.813667
H 5.337028 -0.995011 0.537343
H 3.766889 2.781132 -0.907358
H 2.251366 -2.810654 0.389054
H 3.902664 -2.802459 1.073913
H 2.527428 -2.246985 2.056187
H 1.438317 3.275714 -0.782061
H 0.533118 1.891320 -1.485995
H 0.379391 2.261440 0.245916
H 6.662854 0.829484 -0.217811


