%chk=000156765.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156765

0 1
 O    2.147400      -1.268500      0.7520000    
 O  -0.7544000      -2.532600      0.8454000    
 O    2.704500       1.614300       1.196200    
 C   5.1899999E-02  0.8545000      5.0900001E-02
 C    2.071400     -0.6791000     -0.5486000    
 C    1.475500      0.7025000     -0.6340000    
 C  -0.8254000     -0.3885000     -0.3560000    
 C    1.226700      -1.860100     -0.1807000    
 C   -2.378200     -0.2759000     -0.1578000    
 C  -0.6047000       2.148700     -0.5142000    
 C  -0.1889000      -1.671500      0.1882000    
 C   -2.865000       1.070800     -0.7504000    
 C   -2.096200       2.276500     -0.2268000    
 C   0.1932000       1.014100       1.583800    
 C    3.278200     -0.9489000      -1.381800    
 C    2.524200       1.734400     -0.1991000    
 C   -2.879300     -0.3906000       1.296800    
 C   -3.080900      -1.400100     -0.9637000    
 H    1.317300      0.8709000      -1.709600    
 H  -0.7016000     -0.4838000      -1.448600    
 H    1.484200      -2.833000     -0.5821000    
 H  -0.4753000       2.177700      -1.604700    
 H  -9.6799999E-02   3.040200     -0.1270000    
 H   -3.934100       1.211300     -0.5451000    
 H   -2.766100       1.047900      -1.844400    
 H   -2.267200       2.416500      0.8452000    
 H   -2.476500       3.181300     -0.7163000    
 H   0.5745000       2.001600       1.863800    
 H  -0.7697000      0.9575000       2.086600    
 H   0.8086000      0.2431000       2.050900    
 H    3.484900      -2.021200      -1.473400    
 H    3.148800     -0.5572000      -2.396100    
 H    4.171700     -0.4913000     -0.9456000    
 H    2.177100       2.750700     -0.4069000    
 H    3.489500       1.620100     -0.6997000    
 H   -2.695300      0.5059000       1.889400    
 H   -3.968400     -0.5265000       1.314100    
 H   -2.453500      -1.240500       1.832800    
 H   -2.764600      -1.396300      -2.013000    
 H   -2.867100      -2.392200     -0.5545000    
 H   -4.169900      -1.272700     -0.9526000    
 H    3.160900      0.7731000       1.367300    


%chk=000156765-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156765

0 1
O 2.221331 -1.220725 0.892273
O -0.839965 -2.623467 0.732722
O 3.223156 1.488126 1.034695
C 0.047764 0.869270 0.073733
C 2.097930 -0.687302 -0.550901
C 1.461523 0.708527 -0.631543
C -0.848768 -0.378901 -0.344012
C 1.257121 -1.843533 -0.107220
C -2.410984 -0.276315 -0.165214
C -0.607961 2.160765 -0.517986
C -0.223680 -1.676011 0.176642
C -2.884984 1.084321 -0.761637
C -2.112975 2.299433 -0.214645
C 0.176562 1.022314 1.615495
C 3.336036 -0.948398 -1.389899
C 2.513215 1.779075 -0.217506
C -2.904713 -0.408287 1.303533
C -3.081941 -1.409377 -0.997207
H 1.269104 0.876272 -1.714937
H -0.695375 -0.447149 -1.452176
H 1.545880 -2.868006 -0.378126
H -0.479484 2.158990 -1.622043
H -0.068033 3.048004 -0.134932
H -3.969818 1.191953 -0.564419
H -2.764752 1.055501 -1.866274
H -2.283830 2.410813 0.873004
H -2.492574 3.228241 -0.682813
H 0.901729 1.816879 1.862591
H -0.788358 1.303537 2.066023
H 0.521561 0.093747 2.099837
H 3.690311 -1.982429 -1.241397
H 3.118260 -0.804347 -2.464529
H 4.155663 -0.266286 -1.106497
H 2.029147 2.766715 -0.103756
H 3.272752 1.876537 -1.019392
H -2.612007 0.446847 1.934601
H -4.010365 -0.456318 1.306780
H -2.523951 -1.331647 1.768230
H -2.723428 -1.406033 -2.045571
H -2.883825 -2.402088 -0.561544
H -4.177538 -1.256159 -1.019717
H 2.961662 0.590010 1.366433


