%chk=000017785.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017785

0 1
 O   -2.799400       1.888300      0.8232000    
 N    1.917400     -0.2493000      0.7751000    
 N   -2.269100      0.8303000      0.3526000    
 C    1.192100     -0.4765000     -0.4909000    
 C    1.734600      0.5990000      -1.450200    
 C    2.807600       1.333600     -0.6588000    
 C    3.207100      0.3380000      0.4116000    
 C  -0.3112000     -0.4050000     -0.3231000    
 C    2.071400      -1.458500       1.573900    
 C  -0.8998000      0.7444000      0.1902000    
 C   -1.108500      -1.485500     -0.6793000    
 C   -2.487800      -1.409800     -0.5201000    
 C   -3.054400     -0.2490000     -4.1000000E-03
 H    1.469200      -1.454000     -0.9113000    
 H   0.9822000       1.298000      -1.830400    
 H    2.195900      0.1119000      -2.318700    
 H    3.651100       1.635500      -1.286700    
 H    2.382000       2.235800     -0.2024000    
 H    3.894700     -0.4098000     -3.5999999E-03
 H    3.689000      0.8315000       1.261200    
 H    2.605200      -1.234200       2.503900    
 H    2.624100      -2.241400       1.042300    
 H    1.094200      -1.861700       1.860100    
 H  -0.3591000       1.630100      0.4928000    
 H  -0.6699000      -2.394400      -1.082000    
 H   -3.118400      -2.249100     -0.7955000    
 H   -4.115000     -0.1127000      0.1493000    


%chk=000017785-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017785

0 1
O -2.765819 1.451971 1.555627
N 1.948485 -0.134932 0.757037
N -2.245470 0.555765 0.716815
C 1.223132 -0.540794 -0.474301
C 1.753928 0.444067 -1.582773
C 2.888748 1.263222 -0.895721
C 3.259098 0.409614 0.334081
C -0.293318 -0.498206 -0.305346
C 1.993197 -1.151765 1.818417
C -0.863822 0.438647 0.570315
C -1.138888 -1.356155 -1.054646
C -2.539331 -1.228190 -0.904004
C -3.079846 -0.280358 -0.027897
H 1.496237 -1.586278 -0.772094
H 0.948336 1.097877 -1.955817
H 2.137556 -0.133822 -2.441783
H 3.750010 1.435488 -1.563881
H 2.506864 2.244085 -0.564534
H 3.980442 -0.399078 0.048202
H 3.715454 0.996424 1.151358
H 2.504055 -0.740943 2.707019
H 2.528989 -2.084394 1.508254
H 0.967403 -1.429904 2.117879
H -0.263795 1.107254 1.188036
H -0.713340 -2.102014 -1.733290
H -3.228099 -1.868247 -1.463630
H -4.145005 -0.123834 0.145777


