%chk=000176098.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176098

0 1
 O   0.1306000      -3.095000      0.1075000    
 O    1.237100      -1.210500      -1.488100    
 O   -3.236000       1.049700       1.399300    
 O   -1.895900       2.992600     -0.7176000    
 C   -1.527400      -1.360800      9.8000001E-03
 C   -1.816600      9.6699998E-02 -0.2674000    
 C   -1.891700     -0.9140000      -1.383600    
 C  -0.1343000      -1.736400      0.4458000    
 C   0.9639000     -0.8293000     -0.1386000    
 C  -0.6817000       1.042600     -0.1923000    
 C   0.6048000      0.6393000     -0.1246000    
 C    2.274500     -0.8570000      0.6558000    
 C   -2.588500      -2.156000      0.7197000    
 C    2.991900      0.4680000      0.3031000    
 C    1.839500       1.478500      0.1009000    
 C   -3.088500      0.6543000      0.2477000    
 C  -0.9388000       2.494100     -0.1561000    
 C    3.913800      0.9005000       1.451700    
 C    3.843300      0.3427000     -0.9731000    
 H   -2.869200      -1.178300      -1.775900    
 H   -1.140700     -0.9019000      -2.162000    
 H  -0.1054000      -1.669200       1.541000    
 H    2.066200     -0.8940000       1.733200    
 H    2.892000      -1.726200      0.4021000    
 H   -2.428500      -3.229900      0.5750000    
 H   -2.564100      -1.953800       1.796200    
 H   -3.601800      -1.941300      0.3623000    
 H    2.026500       2.141700     -0.7505000    
 H    1.708400       2.090800       1.000400    
 H   -3.919900      0.7109000     -0.4758000    
 H   0.1546000      -3.156700     -0.8628000    
 H    1.075000     -0.4618000      -2.085700    
 H  -0.1909000       3.118200      0.3568000    
 H    4.707300      0.1633000       1.617500    
 H    4.387000       1.864900       1.236000    
 H    3.359500       1.007700       2.390900    
 H    4.581000     -0.4614000     -0.8746000    
 H    3.246000      0.1404000      -1.865300    
 H    4.391500       1.272400      -1.165500    


%chk=000176098-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000176098

0 1
O 0.136374 -3.124018 -0.133726
O 1.264278 -1.194096 -1.589082
O -3.123162 1.419026 1.481779
O -2.047198 3.022020 -0.807003
C -1.599998 -1.363005 -0.011196
C -1.871436 0.183171 -0.203566
C -2.011414 -0.822832 -1.374572
C -0.154202 -1.765550 0.339206
C 0.957280 -0.804913 -0.154348
C -0.691939 1.115931 -0.168255
C 0.607198 0.672533 -0.112855
C 2.290744 -0.892514 0.607013
C -2.606342 -2.222500 0.756514
C 3.045256 0.455321 0.337790
C 1.893003 1.484269 0.015561
C -3.121615 0.673924 0.472328
C -0.961528 2.566288 -0.356639
C 3.844522 0.894835 1.588685
C 4.011030 0.320500 -0.868634
H -3.029015 -1.055558 -1.709950
H -1.292782 -0.745644 -2.194312
H -0.094062 -1.830607 1.441486
H 2.078293 -0.997368 1.688505
H 2.872189 -1.774737 0.290804
H -2.332473 -3.283314 0.617034
H -2.584312 -1.998755 1.839253
H -3.641786 -2.084402 0.401394
H 2.121441 2.052616 -0.906607
H 1.799253 2.232133 0.825897
H -4.077469 0.277231 0.046546
H 0.486401 -3.010148 -1.061610
H 0.783220 -0.581630 -2.202210
H -0.114298 3.251775 -0.119514
H 4.603238 0.135383 1.855532
H 4.374779 1.848827 1.407608
H 3.181225 1.033354 2.463385
H 4.819578 -0.399377 -0.641500
H 3.477868 -0.045819 -1.762490
H 4.482364 1.293453 -1.105049


