%chk=000016816.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016816

0 1
 O  -0.9334000      -1.657700      0.2783000    
 O    4.358100       1.388300      -1.174500    
 O    4.986200      0.3861000      0.6749000    
 N    4.120400      0.6369000     -0.1980000    
 C   -2.014000     -0.8572000      6.8899997E-02
 C   -3.169800       1.234100      0.4265000    
 C   0.3229000      -1.087400      0.1600000    
 C   -2.061800      0.4141000      0.6409000    
 C   -3.074100      -1.308500     -0.7175000    
 C   -4.229700      0.7827000     -0.3600000    
 C   0.5873000     -0.2578000     -0.9148000    
 C    1.280800      -1.361300       1.119700    
 C   -4.181900     -0.4886000     -0.9320000    
 C    2.831800      5.2900001E-02 -7.6899998E-02
 C    1.852500      0.3170000      -1.034400    
 C    2.546000     -0.7862000       1.000100    
 C   -3.221400       2.592800       1.038600    
 H   -1.254300      0.7732000       1.274600    
 H   -3.042300      -2.297700      -1.166100    
 H   -5.097900       1.412000     -0.5364000    
 H  -0.1505000     -5.5799998E-02  -1.685800    
 H    1.058900      -2.014100       1.958600    
 H   -5.006900     -0.8398000      -1.544800    
 H    2.041400      0.9614000      -1.889200    
 H    3.283800      -1.014500       1.765000    
 H   -2.778800       2.587400       2.040400    
 H   -2.674600       3.306800      0.4146000    
 H   -4.253200       2.944100       1.146000    


%chk=000016816-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000016816

0 1
O -0.872741 -1.397866 0.550731
O 4.682504 1.283025 -1.143482
O 5.390338 -0.324446 0.315674
N 4.458734 0.306661 -0.323614
C -2.038406 -0.654401 0.185705
C -3.449537 1.337777 0.355453
C 0.412757 -0.896102 0.311215
C -2.237556 0.663084 0.649427
C -3.021989 -1.341075 -0.551969
C -4.442888 0.653549 -0.393331
C 0.693361 0.161079 -0.593936
C 1.458964 -1.562895 0.999489
C -4.232111 -0.671194 -0.838383
C 3.061990 -0.110925 -0.105367
C 2.027014 0.552939 -0.802369
C 2.789758 -1.170812 0.792753
C -3.668929 2.764859 0.826739
H -1.462945 1.155233 1.248575
H -2.836986 -2.368765 -0.877043
H -5.387819 1.159823 -0.621214
H -0.117334 0.656674 -1.134453
H 1.203462 -2.376966 1.683137
H -5.012596 -1.186931 -1.407919
H 2.281463 1.357489 -1.497202
H 3.618627 -1.661388 1.309124
H -3.220955 2.938097 1.821089
H -3.207035 3.489428 0.128522
H -4.743645 3.007251 0.889351


