%chk=000032966.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032966

0 1
 O   -5.381000      -1.846000      7.8999996E-03
 O    5.305300      -1.979700     -3.5900000E-02
 O  -5.2400000E-02   3.115600      0.7827000    
 N  -6.5000001E-03   1.198100     -0.1046000    
 N   0.2981000       2.476700     -0.2167000    
 C   -1.333700      0.8974000     -0.6289000    
 C   0.9851000      0.2977000     -0.7158000    
 C   -2.010900     -0.1741000      0.2237000    
 C    2.152700      6.5600000E-02  0.2415000    
 C   -3.400700     -0.5110000     -0.3140000    
 C    3.198800     -0.8599000     -0.3774000    
 C   -4.102400      -1.548100      0.5528000    
 C    4.347700      -1.132300      0.5846000    
 H   -1.302100      0.6015000      -1.686900    
 H   -1.985400       1.784000     -0.5931000    
 H   0.5432000     -0.6860000     -0.9238000    
 H    1.338400      0.6840000      -1.682300    
 H   -2.096700      0.1788000       1.259500    
 H   -1.406400      -1.088900      0.2468000    
 H    1.781900     -0.3743000       1.176200    
 H    2.630200       1.018700      0.5008000    
 H   -3.329800     -0.8848000      -1.343000    
 H   -4.017600      0.3949000     -0.3657000    
 H    3.594600     -0.4219000      -1.302200    
 H    2.737800      -1.811800     -0.6695000    
 H   -4.237500      -1.186600       1.577300    
 H   -3.527200      -2.478400      0.5902000    
 H    3.995100      -1.618800       1.499700    
 H    4.851800     -0.2017000      0.8630000    
 H   -5.892800      -1.019300     -7.1000000E-03
 H    4.855600      -2.810700     -0.2658000    


%chk=000032966-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000032966

0 1
O -5.003578 -2.074940 0.838078
O 5.036787 -2.273263 0.378191
O -1.232937 3.222117 -0.081181
N 0.030612 1.479711 -0.730095
N -0.033007 2.785850 -0.271003
C -1.192835 0.694437 -1.005882
C 1.388639 0.961263 -0.972105
C -1.838092 0.082478 0.262502
C 1.785005 -0.208943 -0.043356
C -3.141455 -0.673275 -0.080638
C 3.230899 -0.682598 -0.318329
C -3.792329 -1.305581 1.164013
C 3.644258 -1.853026 0.593866
H -0.928040 -0.096489 -1.731129
H -1.920924 1.382870 -1.477233
H 1.472108 0.639766 -2.030335
H 2.071195 1.816502 -0.821276
H -2.050854 0.898908 0.977552
H -1.123029 -0.607096 0.751913
H 1.085543 -1.057398 -0.185956
H 1.689404 0.116973 1.010660
H -2.941916 -1.476187 -0.817790
H -3.859389 0.029278 -0.553984
H 3.941867 0.151969 -0.164081
H 3.324920 -0.993785 -1.381041
H -4.010293 -0.522362 1.922414
H -3.115966 -2.048570 1.620370
H 2.945687 -2.708653 0.461423
H 3.615893 -1.546135 1.653179
H -5.681085 -1.459833 0.458640
H 5.136107 -2.595289 -0.553389


