%chk=000178690.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178690

0 1
 O  -0.1176000      -1.134500      -1.752800    
 O  -0.5303000      -3.044500      0.2827000    
 O   -3.150300      -2.176900       1.044400    
 O   -3.761600      0.2561000     -0.8633000    
 C   4.1499998E-02 -0.7837000     -0.3752000    
 C  -0.8495000      -1.669500      0.4970000    
 C  -0.3994000      0.6465000     -0.1494000    
 C   -2.335600      -1.442900      0.1224000    
 C   -2.800700      3.9099999E-02  0.1688000    
 C    1.530800     -0.6710000     -0.1193000    
 C   -1.706200       1.061300      3.2900002E-02
 C   0.7032000       1.507500     -1.3000000E-02
 C    1.901400      0.6943000      1.4500000E-02
 C   -1.911900       2.432600      0.2120000    
 C   0.4988000       2.861900      0.1698000    
 C    2.481100      -1.676900     -7.7900000E-02
 C    3.226100       1.052600      0.1985000    
 C  -0.8210000       3.323900      0.2573000    
 C    3.816400      -1.312800      0.1081000    
 C    4.185100      3.6899999E-02  0.2428000    
 H  -0.6923000      -1.468700       1.564800    
 H   -2.535300      -1.882100     -0.8634000    
 H   -3.313900      0.2228000       1.121100    
 H   -2.917100       2.821100      0.3558000    
 H  -0.1817000      -2.103300      -1.809600    
 H    1.326800       3.554400      0.2762000    
 H    2.208100      -2.719100     -0.1986000    
 H   -1.144300      -3.572300      0.8214000    
 H    3.524300       2.088900      0.3159000    
 H   -1.007100       4.384000      0.4114000    
 H   -4.076200      -2.061500      0.7700000    
 H   -3.298400      0.2198000      -1.718000    
 H    4.583300      -2.082200      0.1437000    
 H    5.231700      0.2926000      0.3869000    


%chk=000178690-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178690

0 1
O -0.105394 -1.162336 -1.760700
O -0.529617 -3.097605 0.169410
O -3.157647 -2.386034 0.744730
O -4.066175 0.285795 -0.379885
C 0.061884 -0.789737 -0.323297
C -0.866465 -1.705059 0.491992
C -0.392380 0.650439 -0.152254
C -2.315898 -1.405622 0.042656
C -2.787864 0.038751 0.330453
C 1.559908 -0.684813 -0.018989
C -1.709460 1.079531 0.055628
C 0.720411 1.528198 -0.074046
C 1.945887 0.692647 -0.002564
C -1.935151 2.478800 0.174571
C 0.496197 2.914578 0.039619
C 2.514941 -1.703654 0.107865
C 3.301143 1.049798 0.134265
C -0.844579 3.378681 0.126682
C 3.879763 -1.340667 0.257674
C 4.267623 0.020796 0.262944
H -0.757708 -1.520516 1.580241
H -2.365598 -1.572762 -1.053942
H -3.090315 0.097807 1.393614
H -2.953920 2.850985 0.329088
H 0.029548 -2.150268 -1.782544
H 1.327484 3.625586 0.095647
H 2.209763 -2.755034 0.101319
H -1.308930 -3.652069 0.438107
H 3.610233 2.101003 0.149256
H -1.035167 4.454409 0.212557
H -4.099905 -2.228006 0.481875
H -3.861132 0.440436 -1.338539
H 4.640439 -2.121053 0.371395
H 5.326281 0.281397 0.373071


