%chk=000002902.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002902

0 1
 O   -1.259400      -2.653100     -0.2614000    
 O   -1.179900       2.673200     -0.3594000    
 N  -0.1644000      0.6603000     -0.8263000    
 N   -2.189100     -0.6322000      0.3237000    
 C   0.1381000     -0.6984000     -0.4038000    
 C    1.057900     -0.7418000      0.8071000    
 C    2.425600     -7.7399999E-02  0.5674000    
 C   -1.166100      -1.432000     -0.1483000    
 C    3.175900     -0.6987000     -0.6116000    
 C    2.241400       1.423400      0.3303000    
 C   -1.971200      0.7208000      0.7886000    
 C   -1.108700       1.455900     -0.2061000    
 H   0.5981000      -1.189400      -1.268200    
 H   0.5846000     -0.2788000       1.681100    
 H    1.224400      -1.790600       1.087400    
 H    3.023500     -0.2165000       1.476800    
 H   0.4004000       1.075300      -1.559800    
 H    2.699400     -0.4859000      -1.573500    
 H    3.249600      -1.785000     -0.4965000    
 H    4.195400     -0.3001000     -0.6606000    
 H    2.074100       1.693400     -0.7141000    
 H    3.178600       1.929300      0.5973000    
 H    1.472400       1.860100      0.9746000    
 H   -1.487200      0.6961000       1.767800    
 H   -2.946100       1.209800      0.8642000    
 H   -3.074100      -1.077500      0.5460000    


%chk=000002902-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000002902

0 1
O -0.756906 -2.561578 -0.333615
O -1.930236 2.785756 0.049427
N -0.397774 1.092968 -0.388614
N -2.243505 -0.873826 0.233018
C 0.123767 -0.288511 -0.284829
C 1.168850 -0.467542 0.864611
C 2.637136 -0.090483 0.511970
C -0.996408 -1.332560 -0.134179
C 3.255530 -1.081350 -0.504278
C 2.812969 1.371975 0.033153
C -2.589356 0.507674 0.598179
C -1.613373 1.558634 0.059858
H 0.613558 -0.542809 -1.243734
H 0.824303 0.126416 1.734264
H 1.155146 -1.533801 1.160462
H 3.203795 -0.193805 1.461302
H 0.247200 1.816265 -0.719705
H 2.748193 -1.031387 -1.486755
H 3.180852 -2.123537 -0.144644
H 4.323274 -0.850743 -0.674655
H 2.398467 1.521440 -0.984530
H 3.885795 1.631520 -0.027694
H 2.330159 2.091753 0.720341
H -2.640969 0.636994 1.699237
H -3.584363 0.767620 0.197294
H -2.962904 -1.596882 0.326817


