%chk=000173282.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173282

0 1
 O   0.7908000       2.074000     -0.4206000    
 O   7.1599998E-02  -2.541300     -0.1993000    
 O   -4.174300      0.3968000       1.259100    
 O   -3.851000      0.3149000     -0.9868000    
 N   0.3601000     -0.2231000     -0.3337000    
 N    2.133100      -1.661300      0.2465000    
 C   -1.039600     -5.3500000E-02 -0.7057000    
 C   -1.937000      0.1315000      0.5110000    
 C    1.169800      0.9199000     -0.2262000    
 C    2.590300      0.6629000      0.1572000    
 C   0.7975000      -1.548800     -0.1040000    
 C    2.978300     -0.5984000      0.3671000    
 C    3.508000       1.836700      0.2866000    
 C   -3.397800      0.2898000      0.1488000    
 H   -1.131600      0.8180000      -1.365400    
 H   -1.373600     -0.9205000      -1.288400    
 H   -1.628200       1.022500       1.069700    
 H   -1.845900     -0.7372000       1.173300    
 H    3.994000     -0.8523000      0.6478000    
 H    2.512300      -2.586600      0.4254000    
 H    3.140900       2.526900       1.053200    
 H    3.576300       2.375700     -0.6639000    
 H    4.521500       1.533400      0.5702000    
 H   -5.123500      0.4966000       1.032700    


%chk=000173282-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000173282

0 1
O 0.668388 2.044433 -0.344895
O 0.071463 -2.621015 -0.197923
O -4.183877 0.520065 1.270181
O -3.860981 0.314251 -1.020881
N 0.373868 -0.281884 -0.328650
N 2.180267 -1.707155 0.214185
C -1.046919 -0.097187 -0.717304
C -1.934161 0.125400 0.523305
C 1.184041 0.898465 -0.179998
C 2.598527 0.672774 0.162150
C 0.814922 -1.604119 -0.111943
C 3.036068 -0.616770 0.344402
C 3.487129 1.883326 0.300349
C -3.384558 0.320391 0.135150
H -1.099114 0.778210 -1.382723
H -1.368761 -0.996352 -1.264293
H -1.601600 1.017070 1.085802
H -1.872343 -0.737099 1.212573
H 4.072426 -0.849306 0.603622
H 2.511036 -2.661376 0.366390
H 3.099728 2.565879 1.078088
H 3.505254 2.463774 -0.639722
H 4.521013 1.598311 0.561171
H -5.129815 0.646514 0.985564


