%chk=000168276.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168276

0 1
 O   -3.081600      0.1272000     -0.5259000    
 O   -2.586900      -2.057700     -0.8988000    
 C  -5.2000000E-03   1.152400     -0.3665000    
 C    1.059400      0.1681000     -0.9066000    
 C   0.5472000       2.571500     -0.1067000    
 C  -0.6913000      0.5760000      0.8983000    
 C    2.235200     -0.1073000      3.6800001E-02
 C    3.265100      -1.026100     -0.6241000    
 C  -0.5087000       3.570600      0.3472000    
 C   -1.312500     -0.7859000      0.7012000    
 C    4.419200      -1.337200      0.3155000    
 C   -2.369700      -1.004900     -0.3187000    
 C  -0.9700000      -1.846700       1.448100    
 H  -0.7637000       1.251100      -1.154900    
 H   0.5893000     -0.7806000      -1.191700    
 H    1.456900      0.5882000      -1.840300    
 H    1.007400       2.944200      -1.029900    
 H    1.336800       2.543200      0.6522000    
 H   2.4300000E-02  0.5580000       1.730000    
 H   -1.495100       1.246800       1.223800    
 H    2.728100      0.8303000      0.3142000    
 H    1.880600     -0.5746000      0.9612000    
 H    3.657000     -0.5543000      -1.532600    
 H    2.786500      -1.965100     -0.9258000    
 H   -1.370500       3.568800     -0.3273000    
 H  -0.8561000       3.360300       1.362700    
 H  -8.6599998E-02   4.581000      0.3528000    
 H    5.142700      -1.993900     -0.1775000    
 H    4.939500     -0.4216000      0.6141000    
 H    4.064000      -1.841500       1.219900    
 H  -0.2140000      -1.763500       2.222300    
 H   -1.428300      -2.821400       1.316600    
 H   -3.786000      7.9999998E-04  -1.196700    


%chk=000168276-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168276

0 1
O -3.167573 0.478814 -0.353010
O -3.393261 -1.826690 -0.443197
C 0.007518 1.060647 -0.315221
C 1.130314 0.134049 -0.861165
C 0.530331 2.495465 -0.020630
C -0.705678 0.465631 0.943911
C 2.358299 -0.067237 0.059474
C 3.408969 -1.018001 -0.559531
C -0.581989 3.561123 0.099113
C -1.434937 -0.840374 0.686831
C 4.640943 -1.230556 0.346605
C -2.725672 -0.829049 -0.076560
C -0.993936 -2.056769 1.116068
H -0.760627 1.149891 -1.111843
H 0.699020 -0.860231 -1.097797
H 1.482537 0.554111 -1.826808
H 1.220959 2.788727 -0.837592
H 1.135302 2.488648 0.908943
H 0.042680 0.306626 1.743087
H -1.430558 1.212291 1.315512
H 2.837722 0.909372 0.273062
H 2.041072 -0.479384 1.039875
H 3.733785 -0.611424 -1.539318
H 2.931573 -1.996231 -0.774209
H -1.187441 3.604250 -0.825623
H -1.271150 3.345975 0.935900
H -0.152749 4.565364 0.272151
H 5.373913 -1.915328 -0.118499
H 5.155185 -0.271768 0.548646
H 4.346280 -1.663269 1.321748
H -0.066093 -2.152489 1.690771
H -1.560374 -2.968549 0.896468
H -4.031363 0.422563 -0.844263


