%chk=000029971.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029971

0 1
 O   -1.512400       1.350800     -9.7999997E-02
 N   0.8629000      4.2500000E-02  0.5381000    
 N  -0.3312000     -0.6163000      0.2957000    
 C    1.885400     -0.4086000     -0.3960000    
 C    3.222900      0.2434000     -0.1121000    
 C   -1.455800      0.1261000     -1.2700000E-02
 C   -2.671700     -0.7380000     -0.2151000    
 H    2.005400      -1.497500     -0.3356000    
 H    1.585800     -0.1659000      -1.422600    
 H    1.141700     -0.1889000       1.491000    
 H    3.156700       1.333700     -0.1928000    
 H    3.579500     -3.8999999E-03  0.8935000    
 H    3.973700     -0.1024000     -0.8299000    
 H  -0.3512000      -1.627800      0.3842000    
 H   -3.407800     -0.1980000     -0.8172000    
 H   -2.408900      -1.662600     -0.7371000    
 H   -3.107100     -0.9818000      0.7576000    


%chk=000029971-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000029971

0 1
O -1.457587 1.346734 -0.001960
N 0.922910 -0.124323 0.569746
N -0.344292 -0.692922 0.361736
C 1.933179 -0.404497 -0.472451
C 3.259074 0.283238 -0.106083
C -1.467730 0.089672 0.055154
C -2.732392 -0.738390 -0.194679
H 2.104577 -1.501033 -0.617256
H 1.551065 -0.003631 -1.428558
H 1.253153 -0.235552 1.536262
H 3.105635 1.370031 0.006319
H 3.671863 -0.110160 0.843056
H 4.012527 0.112249 -0.894819
H -0.442683 -1.717713 0.319138
H -3.119441 -0.501423 -1.200387
H -2.577478 -1.829437 -0.118457
H -3.504480 -0.438042 0.534240


