%chk=000108019.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108019

0 1
 O    3.829000      -1.042500      -1.265200    
 O    4.275900       1.839000      0.3004000    
 O    4.376200      -1.435800      0.9368000    
 C    1.239800     -0.3314000      0.5365000    
 C    2.621100      0.1085000      0.3685000    
 C   0.1674000      0.3240000      4.9100000E-02
 C   -3.659200      0.3024000     -0.2218000    
 C    1.083000      -1.615400       1.307400    
 C   -1.222300     -6.8300001E-02  0.1870000    
 C   -2.231500      0.6485000     -0.3336000    
 C   -4.019800      -1.001700      7.7399999E-02
 C   -4.613800       1.287300     -0.4179000    
 C    3.710200     -0.8709000      8.0499999E-02
 C    2.987900       1.396800      0.4534000    
 C   -5.371500      -1.329600      0.1831000    
 C   -5.965500      0.9592000     -0.3121000    
 C   -6.344200     -0.3492000     -1.1600000E-02
 C    4.831500      -1.973500      -1.685800    
 C    4.305700       3.152500     -0.2322000    
 H   0.3305000       1.240700     -0.5169000    
 H    1.854100      -1.704300       2.082500    
 H   0.1375000      -1.694200       1.849300    
 H    1.175700      -2.477200      0.6377000    
 H   -1.429200     -0.9736000      0.7421000    
 H   -2.014600       1.568200     -0.8740000    
 H   -3.301100      -1.803300      0.2131000    
 H   -4.334700       2.311200     -0.6514000    
 H    2.288400       2.193500      0.6755000    
 H   -5.667400      -2.349500      0.4115000    
 H   -6.723200       1.722500     -0.4637000    
 H   -7.396700     -0.6047000      6.9399998E-02
 H    4.610500      -2.970700      -1.293300    
 H    5.820200      -1.638700      -1.357700    
 H    4.819700      -2.015400      -2.778100    
 H    3.881600       3.873300      0.4756000    
 H    3.776500       3.203300      -1.190500    
 H    5.350700       3.425600     -0.4068000    


%chk=000108019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108019

0 1
O 4.889328 -0.680647 -0.641958
O 3.952477 1.844726 -0.474330
O 3.308199 -2.355723 -0.948775
C 1.220374 -0.661769 0.232124
C 2.581950 -0.170178 -0.146754
C 0.104751 0.022213 -0.217919
C -3.762549 0.301799 -0.124034
C 1.153128 -1.881569 1.133072
C -1.282086 -0.236795 0.123121
C -2.331998 0.480626 -0.405477
C -4.271026 -0.691356 0.767081
C -4.703511 1.158853 -0.768503
C 3.579188 -1.170340 -0.613409
C 2.812458 1.188433 -0.056871
C -5.654398 -0.816400 0.998591
C -6.088836 1.034162 -0.536603
C -6.573977 0.044688 0.349755
C 5.904004 -1.638754 -1.135861
C 4.001751 3.283790 -0.148598
H 0.268145 0.837966 -0.938491
H 1.703267 -1.705220 2.077731
H 0.118992 -2.161891 1.386078
H 1.632189 -2.741218 0.632245
H -1.491829 -1.042039 0.838664
H -2.090038 1.281562 -1.121514
H -3.580830 -1.370428 1.279931
H -4.334723 1.928263 -1.458742
H 2.019002 1.826188 0.364126
H -6.022057 -1.586997 1.685966
H -6.789452 1.705621 -1.045809
H -7.649408 -0.056476 0.532659
H 5.660556 -1.964338 -2.161538
H 5.949865 -2.526120 -0.481377
H 6.848958 -1.077775 -1.110865
H 4.086727 3.430729 0.943621
H 3.106665 3.808906 -0.533680
H 4.903146 3.664108 -0.649458


