%chk=000093946.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093946

0 1
 O   -3.054800     -0.6365000      -1.176600    
 O   -2.967400      3.7300002E-02  0.9992000    
 C    1.891300     -6.6500001E-02 -0.3466000    
 C    1.181900      0.7324000      0.7920000    
 C    1.204200      -1.308900      0.2974000    
 C    1.382700     -0.5543000       1.642800    
 C  -0.3105000       1.020700      0.5474000    
 C  -0.2745000      -1.479100     -5.9099998E-02
 C  -0.9351000     -0.1100000     -0.3059000    
 C    1.351100      0.2695000      -1.732700    
 C    3.398800     -6.6299997E-02 -0.4532000    
 C  -0.4554000       2.377700     -0.1452000    
 C   -2.412300     -0.2160000     -5.9599999E-02
 H    1.730100       1.596800       1.183300    
 H    1.759000      -2.250900      0.2362000    
 H   0.6332000     -0.7504000       2.415900    
 H    2.370600     -0.6555000       2.106300    
 H  -0.8126000       1.090100       1.520800    
 H  -0.7849000      -2.027100      0.7433000    
 H  -0.3783000      -2.100900     -0.9570000    
 H  -0.9009000      0.1525000      -1.366200    
 H   0.7870000       1.187100      -1.848200    
 H    2.188700      0.4476000      -2.425200    
 H   0.8435000     -0.5726000      -2.215400    
 H    3.881800     -0.3066000      0.4991000    
 H    3.749000     -0.8078000      -1.180400    
 H    3.776500      0.9167000     -0.7575000    
 H   0.4413000       2.722900     -0.6663000    
 H   -1.312300       2.413900     -0.8252000    
 H  -0.6388000       3.141100      0.6221000    
 H   -4.022500     -0.7136000      -1.035400    


%chk=000093946-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093946

0 1
O -3.277730 -0.873862 -0.738414
O -2.832704 -0.163216 1.422107
C 1.912756 -0.014862 -0.430217
C 1.162311 0.754559 0.743843
C 1.210016 -1.306162 0.159209
C 1.187574 -0.591274 1.554712
C -0.324848 1.091218 0.459405
C -0.246076 -1.456938 -0.331309
C -1.040505 -0.079537 -0.306375
C 1.686678 0.350608 -1.910705
C 3.442605 -0.032303 -0.185525
C -0.526890 2.440077 -0.269456
C -2.430469 -0.337912 0.249678
H 1.682959 1.631617 1.169829
H 1.754232 -2.263726 0.067089
H 0.311700 -0.790050 2.196685
H 2.106733 -0.744811 2.141433
H -0.811911 1.175416 1.452081
H -0.748292 -2.201946 0.315850
H -0.278603 -1.857369 -1.361121
H -1.189027 0.226501 -1.356877
H 2.075976 1.364193 -2.126451
H 2.238234 -0.356855 -2.560487
H 0.630211 0.324082 -2.219499
H 3.709143 -0.277212 0.856770
H 3.931362 -0.777689 -0.842251
H 3.878953 0.957878 -0.419261
H -0.048674 2.446197 -1.265011
H -1.602632 2.660129 -0.406816
H -0.090899 3.268105 0.320013
H -4.161782 -1.081557 -0.328829


