%chk=000025846.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025846

0 1
 O   -1.763200      0.5945000      -1.456700    
 N   -2.381600     -0.3324000      0.5918000    
 N  -0.1792000     -0.3677000     -5.7000000E-02
 C   0.9727000     -0.1346000     -0.8964000    
 C    1.586800       1.241800     -0.6191000    
 C    2.010600      -1.249600     -0.7296000    
 C    2.303100       1.301700      0.7299000    
 C    2.726200      -1.185600      0.6197000    
 C    3.338300      0.1896000      0.8677000    
 C   -3.749400     -0.6485000      0.3021000    
 C   -3.393500      0.5706000       1.055900    
 C   -1.470800      2.0199999E-02 -0.4084000    
 H   0.6235000     -0.1471000      -1.936400    
 H   0.8168000       2.021700     -0.6555000    
 H    2.310000       1.474300      -1.411300    
 H    2.757700      -1.163600      -1.529000    
 H    1.535900      -2.231700     -0.8428000    
 H    1.570200       1.222300       1.542000    
 H    2.793800       2.275300      0.8410000    
 H    3.514600      -1.946600      0.6498000    
 H    2.027000      -1.427700       1.428600    
 H    4.152600      0.3598000      0.1525000    
 H    3.782300      0.2207000       1.869100    
 H   -4.110600      -1.512600      0.8401000    
 H   -4.040100     -0.5617000     -0.7347000    
 H   -3.423000       1.528000      0.5562000    
 H   -3.500800      0.5750000       2.130500    
 H  -4.5100000E-02 -0.7702000      0.8655000    


%chk=000025846-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000025846

0 1
O -1.738032 0.831292 -1.231663
N -2.344037 -0.354203 0.811079
N -0.171017 -0.415524 -0.021463
C 0.979665 -0.151065 -0.914686
C 1.600344 1.248038 -0.644139
C 2.037749 -1.269258 -0.748645
C 2.318205 1.313154 0.723631
C 2.768573 -1.199890 0.616796
C 3.386582 0.200106 0.851311
C -3.746704 -0.685954 0.293316
C -3.511676 0.600838 1.042548
C -1.421056 0.092285 -0.251163
H 0.580513 -0.159483 -1.946536
H 0.805044 2.012153 -0.715401
H 2.328000 1.460105 -1.454164
H 2.784822 -1.148534 -1.557576
H 1.563530 -2.259454 -0.891989
H 1.571490 1.202736 1.536473
H 2.784465 2.308165 0.855861
H 3.552998 -1.979676 0.656243
H 2.065117 -1.430599 1.445255
H 4.183960 0.373061 0.098722
H 3.869820 0.242141 1.846453
H -4.210861 -1.542318 0.790587
H -3.898390 -0.604195 -0.789059
H -3.509743 1.522309 0.449425
H -3.804871 0.690861 2.092321
H -0.059690 -0.981189 0.821962


