%chk=000072830.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072830

0 1
 O   -1.894800       1.141900       2.085100    
 O   0.8759000       2.572600     -0.6468000    
 O  -0.4909000      -1.761800      0.2543000    
 O   -4.194600      -1.444800     -0.9431000    
 N  -0.2177000      0.5307000     -0.2204000    
 N   -3.263100     -0.2289000      0.8039000    
 C   -1.602200      0.9482000     -0.3185000    
 C   -2.400500      0.1315000      -1.328300    
 C   -2.252500      0.6765000       1.012900    
 C   0.8530000       1.382800     -0.3916000    
 C   0.1742000     -0.7625000      5.4400001E-02
 C    2.046900      0.5606000     -0.1990000    
 C    1.636500     -0.7366000      7.0699997E-02
 C   -3.400000     -0.6281000     -0.5011000    
 C    3.381000      0.9078000     -0.2544000    
 C    2.538800      -1.755200      0.2990000    
 C    4.313500     -0.1080000     -2.5500000E-02
 C    3.896500      -1.426700      0.2484000    
 H   -1.659600       2.018400     -0.5431000    
 H   -1.794700     -0.5565000      -1.924700    
 H   -2.953000      0.7926000      -2.004700    
 H   -3.839700     -0.5928000       1.554500    
 H    3.701900       1.921000     -0.4655000    
 H    2.218600      -2.768800      0.5092000    
 H    5.375800      0.1194000     -5.9099998E-02
 H    4.643300      -2.197100      0.4222000    


%chk=000072830-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072830

0 1
O -1.875678 0.693448 2.241409
O 0.714178 2.546216 -0.715414
O -0.443019 -1.890422 0.339432
O -4.821892 -0.760569 -1.112287
N -0.189851 0.402091 -0.223467
N -3.572399 -0.052512 0.764801
C -1.597681 0.771624 -0.259163
C -2.464980 0.058928 -1.330797
C -2.311435 0.474214 1.093034
C 0.875774 1.336755 -0.427023
C 0.292918 -0.899983 0.104756
C 2.132548 0.551088 -0.226744
C 1.784246 -0.786287 0.090333
C -3.770116 -0.307401 -0.613298
C 3.471997 0.959337 -0.307885
C 2.764577 -1.758779 0.336075
C 4.471361 -0.017809 -0.060589
C 4.123091 -1.355394 0.256205
H -1.611323 1.869303 -0.406590
H -1.991514 -0.876604 -1.675103
H -2.674083 0.682352 -2.213954
H -4.273433 -0.287667 1.472173
H 3.729138 1.994944 -0.550676
H 2.485152 -2.787713 0.582712
H 5.528408 0.263486 -0.112764
H 4.916613 -2.086446 0.443623


