%chk=000161267.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161267

0 1
 O    3.096100       1.500900      0.3063000    
 O   -5.742100      0.7295000     -0.4120000    
 O   -5.531200      -1.509300     -8.0799997E-02
 N   0.5299000      0.6779000      0.1974000    
 N    3.892100     -0.6505000      0.6802000    
 N    6.405700     -0.4652000      -1.626900    
 C  -0.8292000      0.4147000      0.1049000    
 C    1.528300     -0.3337000      0.4336000    
 C   -1.320400     -0.8962000      0.2413000    
 C   -1.749400       1.452300     -0.1291000    
 C   -3.584300     -0.1188000     -8.5699998E-02
 C   -2.686700      -1.160800      0.1467000    
 C   -3.115700       1.187800     -0.2235000    
 C    2.902600      0.2982000      0.4642000    
 C    5.299100     -0.3272000      0.7464000    
 C   -5.008900     -0.3947000     -0.1854000    
 C    5.914200     -0.4049000     -0.5775000    
 H    1.360400     -0.8270000       1.398100    
 H    1.518500      -1.082900     -0.3668000    
 H   0.8260000       1.642500      9.3599997E-02
 H  -0.6562000      -1.736900      0.4232000    
 H   -1.400300       2.476700     -0.2393000    
 H   -3.032100      -2.185500      0.2567000    
 H   -3.779300       2.028500     -0.4055000    
 H    3.627500      -1.626300      0.7816000    
 H    5.765000      -1.042400       1.431100    
 H    5.418400      0.6765000       1.167000    
 H   -6.701100      0.5329000     -0.4771000    


%chk=000161267-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000161267

0 1
O 3.040198 1.510972 0.354560
O -5.882805 0.811896 -0.299946
O -5.649025 -1.495566 -0.157154
N 0.512748 0.611539 0.214320
N 3.965934 -0.607157 0.622205
N 6.897491 -1.125863 -1.231100
C -0.847872 0.366863 0.117512
C 1.520282 -0.422050 0.345742
C -1.378674 -0.961526 0.143348
C -1.756400 1.465734 -0.010478
C -3.661043 -0.079440 -0.078687
C -2.762232 -1.171557 0.046853
C -3.134891 1.243512 -0.106573
C 2.898977 0.255427 0.438292
C 5.344848 -0.101264 0.686448
C -5.104566 -0.360258 -0.176004
C 6.202757 -0.661804 -0.380009
H 1.357219 -1.044351 1.253651
H 1.520008 -1.116221 -0.524719
H 0.879115 1.568354 0.176667
H -0.710356 -1.823679 0.236263
H -1.361814 2.488633 -0.032758
H -3.175364 -2.185824 0.065935
H -3.825057 2.086208 -0.204202
H 3.807859 -1.615260 0.674291
H 5.804839 -0.320243 1.668799
H 5.282225 0.998169 0.580080
H -6.837502 0.540854 -0.360638


