%chk=000152983.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152983

0 1
 O    1.080800     -0.5979000      2.2299999E-02
 O  -0.1075000       1.409800     -1.1400000E-02
 O    4.566200       1.331600       1.020400    
 O    4.662200      -1.363000     -2.1400001E-02
 O    2.335300       2.827100     -0.1910000    
 O   0.9333000      -3.249600     -0.6869000    
 N   -2.098000      0.4353000       1.621500    
 C    3.592300      0.7917000      0.1258000    
 C    3.471700     -0.7063000      0.4061000    
 C    2.256200       1.503600      0.3378000    
 C    2.271600      -1.302400     -0.3335000    
 C    1.117200      0.7717000     -0.3721000    
 C    2.061200      -2.770600      2.2600001E-02
 C   -1.251700      0.8870000     -0.5489000    
 C   -2.252300      0.3961000      0.2845000    
 C   -1.377400      0.8626000      -1.939600    
 C   -3.413500     -0.1344000     -0.3156000    
 C   -2.523800      0.3387000      -2.523800    
 C   -3.541100     -0.1595000      -1.714700    
 C   -4.422000     -0.6291000      0.5224000    
 C   -4.265900     -0.5901000       1.900500    
 C   -3.095000     -5.2299999E-02   2.395000    
 H    3.969300      0.9729000     -0.8883000    
 H    3.377800     -0.8684000       1.486900    
 H    2.044200       1.602300       1.409100    
 H    2.405000      -1.233600      -1.421800    
 H    1.260500      0.8424000      -1.458100    
 H    1.862200      -2.899000       1.091800    
 H    2.925800      -3.382000     -0.2512000    
 H    5.397800      0.8501000      0.8705000    
 H    4.750100      -1.230900     -0.9807000    
 H    2.525200       2.761200      -1.142400    
 H   0.1734000      -2.694500     -0.4412000    
 H  -0.6019000       1.267800      -2.583100    
 H   -2.628400      0.3223000      -3.604300    
 H   -4.435000     -0.5664000      -2.182200    
 H   -5.335100      -1.047700      0.1054000    
 H   -5.035400     -0.9682000       2.563100    
 H   -2.917000      4.6000001E-03   3.463800    


%chk=000152983-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000152983

0 1
O 1.500745 -1.079303 0.537723
O -0.175393 0.485367 0.483105
O 4.410319 1.800008 -0.341680
O 5.198826 -1.034697 -0.320943
O 1.659011 2.319541 -0.956796
O 1.895740 -3.847579 0.664235
N -2.533188 -0.505792 1.538991
C 3.463916 0.703577 -0.558837
C 3.886093 -0.576493 0.181164
C 2.094754 1.222279 -0.091636
C 2.778667 -1.640054 0.032967
C 1.034756 0.109567 -0.196137
C 2.989891 -2.904025 0.874632
C -1.354962 0.642653 -0.270477
C -2.576730 0.147126 0.316567
C -1.364642 1.310508 -1.501714
C -3.813240 0.356177 -0.416197
C -2.590948 1.486190 -2.210970
C -3.796499 1.021097 -1.683995
C -5.021517 -0.131272 0.182636
C -4.969818 -0.778945 1.417199
C -3.697375 -0.944797 2.054378
H 3.397301 0.472026 -1.649705
H 4.070140 -0.358987 1.247474
H 2.166512 1.543418 0.966933
H 2.657194 -1.921675 -1.040657
H 0.836789 -0.147757 -1.261066
H 3.076192 -2.612571 1.942724
H 3.911207 -3.423643 0.566965
H 5.327536 1.439175 -0.458590
H 5.087211 -1.387906 -1.242652
H 2.364800 3.015614 -0.932011
H 1.051800 -3.362171 0.862074
H -0.434077 1.743467 -1.882827
H -2.575703 2.011737 -3.171874
H -4.738577 1.166454 -2.225445
H -5.973795 0.013150 -0.341066
H -5.874169 -1.160977 1.900994
H -3.630467 -1.457588 3.021812


