%chk=000101689.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101689

0 1
 O  -0.2897000      0.2724000      -1.921400    
 O    1.037600       1.044200       1.695600    
 O  -0.9993000       3.087600     -0.6016000    
 O   -4.472200     -0.6493000       1.433200    
 O   -4.237900      -2.139400     -0.4478000    
 O    4.997100      -1.452500      0.9646000    
 C  -0.4180000       1.885800     -0.1052000    
 C   0.4898000       1.250900      -1.177800    
 C   -1.491200      0.8580000     -3.0099999E-02
 C   0.3274000       2.176300       1.190800    
 C    1.707700      0.5719000     -0.5973000    
 C   -1.363700     -1.2900000E-02  -1.115600    
 C    1.905000      0.4968000      0.7868000    
 C   -2.523000      0.7137000      0.8855000    
 C   -2.246600      -1.053400      -1.346200    
 C    2.649900     -2.2900000E-02  -1.449000    
 C   -3.397400     -0.3330000      0.6583000    
 C   -3.264000      -1.187700     -0.4224000    
 C    2.998900     -0.1959000       1.311200    
 C    3.753800     -0.6968000     -0.9253000    
 C    3.925100     -0.7877000      0.4542000    
 C   -4.995900      -1.793300      0.7290000    
 C    5.906600      -2.032700      3.0600000E-02
 H   0.8247000       2.014400      -1.892300    
 H    1.030300       3.010600       1.058200    
 H  -0.3694000       2.503300       1.971800    
 H   -2.643900       1.385400       1.726000    
 H   -1.568600       2.874000      -1.360700    
 H   -2.142500      -1.721400      -2.191500    
 H    2.521300      2.8100001E-02  -2.527500    
 H    3.134900     -0.2665000       2.387600    
 H    4.434800      -1.131900      -1.648900    
 H   -4.998700      -2.652700       1.409300    
 H   -6.028300      -1.578400      0.4302000    
 H    6.389100      -1.269000     -0.5888000    
 H    5.424200      -2.811000     -0.5704000    
 H    6.697300      -2.520600      0.6100000    


%chk=000101689-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101689

0 1
O -0.295852 0.290887 -1.977799
O 1.101700 1.123102 1.688709
O -0.963479 3.244571 -0.544502
O -4.628230 -0.649085 1.386116
O -4.393557 -2.105080 -0.501276
O 5.006280 -1.519463 1.008490
C -0.424042 1.922128 -0.133459
C 0.534546 1.328891 -1.219473
C -1.507876 0.866778 -0.042662
C 0.327717 2.259879 1.163553
C 1.762609 0.652545 -0.651097
C -1.392833 -0.003779 -1.152221
C 1.968743 0.530343 0.751949
C -2.565510 0.732310 0.891485
C -2.302946 -1.054080 -1.416836
C 2.703444 0.039954 -1.510125
C -3.461190 -0.310055 0.643559
C -3.331870 -1.170495 -0.476545
C 3.050417 -0.200415 1.275052
C 3.800859 -0.692226 -1.016201
C 3.962743 -0.817152 0.390454
C -5.082579 -1.936339 0.809202
C 5.994085 -2.170181 0.143480
H 0.781035 2.091241 -1.976920
H 1.007660 3.113146 0.971888
H -0.377300 2.527936 1.964499
H -2.678792 1.397217 1.751355
H -1.740446 3.090662 -1.140970
H -2.201701 -1.719590 -2.275092
H 2.552795 0.115113 -2.593162
H 3.191017 -0.281685 2.355432
H 4.502712 -1.156029 -1.714085
H -4.780106 -2.765551 1.477280
H -6.168294 -1.891820 0.637581
H 6.526033 -1.431828 -0.487366
H 5.522566 -2.938168 -0.499720
H 6.704840 -2.649282 0.832524


