%chk=000111104.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111104

0 1
 O   0.5435000      0.9056000       1.646600    
 O   -2.936200     -0.4289000      -1.575500    
 O    3.317900      -1.532100      -1.308900    
 O    4.936900      -1.381200      0.2630000    
 N   -1.764400      0.4601000      0.2187000    
 N    1.777900      0.2991000     -0.2217000    
 N   -5.263600     -0.2602000     -0.1056000    
 C  -0.5659000      0.8085000     -0.5088000    
 C   0.6209000      0.6893000      0.4389000    
 C    3.038400      0.1025000      0.4560000    
 C   -3.994500     -0.3831000      0.6071000    
 C  -0.6708000       2.229600      -1.047900    
 C   -2.863600     -0.1372000     -0.3834000    
 C    3.829400       1.401700      0.4875000    
 C   -3.866700      -1.771800       1.220700    
 C    3.860800      -1.001800     -0.1868000    
 H  -0.4488000      0.1070000      -1.342900    
 H   -1.801900      0.6786000       1.210500    
 H    2.821600     -0.2220000       1.480700    
 H   -3.967400      0.3765000       1.396200    
 H   0.2346000       2.506800      -1.598200    
 H  -0.7990000       2.954300     -0.2355000    
 H   -1.526600       2.332200      -1.723500    
 H    1.754200      0.1671000      -1.228900    
 H    4.067200       1.743400     -0.5265000    
 H    3.262500       2.197500      0.9824000    
 H    4.775600       1.275200       1.024200    
 H   -2.921000      -1.867200       1.765500    
 H   -3.879100      -2.554800      0.4535000    
 H   -4.681600      -1.969900       1.925300    
 H   -6.034600     -0.4168000      0.5431000    
 H   -5.339300     -0.9963000     -0.8074000    
 H    3.883400      -2.235700      -1.692800    


%chk=000111104-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000111104

0 1
O 0.548718 0.423073 1.578958
O -3.218513 -0.212626 -1.485670
O 3.870634 -0.833616 -1.680049
O 5.320060 -0.992457 0.132026
N -1.759161 0.280212 0.249928
N 1.860249 0.115505 -0.311721
N -5.381947 0.181677 0.169189
C -0.578765 0.381328 -0.613954
C 0.652595 0.302875 0.314217
C 3.114380 0.056098 0.456126
C -4.117645 -0.201660 0.810566
C -0.580392 1.694398 -1.445190
C -3.002197 -0.032158 -0.242447
C 3.610541 1.462853 0.897112
C -4.090492 -1.669157 1.343766
C 4.215532 -0.647932 -0.329032
H -0.583124 -0.474580 -1.318145
H -1.580072 0.410390 1.253546
H 2.929375 -0.533986 1.373996
H -3.904715 0.477930 1.662068
H 0.282626 1.736536 -2.134533
H -0.544895 2.574464 -0.779876
H -1.505953 1.731052 -2.042243
H 1.916365 -0.024167 -1.323274
H 3.802147 2.104632 0.019714
H 2.833023 1.928798 1.523402
H 4.538488 1.369969 1.485939
H -3.139303 -1.906035 1.857373
H -4.227586 -2.378572 0.507794
H -4.913297 -1.818389 2.067576
H -6.222150 -0.167577 0.636344
H -5.365118 0.009121 -0.843251
H 4.620395 -1.271998 -2.164656


