%chk=000095689.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095689

0 1
 O    1.927900     -0.9414000      0.1272000    
 O    2.965200      0.5787000      -1.264500    
 C   -2.200600      2.6200000E-02  0.2399000    
 C   -1.784800      -1.359800     -0.2726000    
 C   -1.215600       1.104100     -0.2335000    
 C  -0.3474000      -1.694200      0.1148000    
 C   0.2203000      0.7628000      0.1534000    
 C   0.6283000     -0.6184000     -0.3550000    
 C   -3.622400      0.3618000     -0.2061000    
 C   -4.607000     -0.6861000      0.3075000    
 C   -4.020900       1.755100      0.2751000    
 C    2.928900     -7.9200000E-02 -0.2339000    
 C    3.986300     -6.6799998E-02  0.8451000    
 C    5.141700      0.8574000      0.5025000    
 H   -2.167800      2.4000001E-03   1.338800    
 H   -1.886300      -1.404800      -1.364300    
 H   -2.423000      -2.145300      0.1446000    
 H   -1.445100       2.076200      0.2147000    
 H   -1.280100       1.223500      -1.322400    
 H  -0.2719000      -1.812700       1.203700    
 H  -5.9900001E-02  -2.664400     -0.3085000    
 H   0.8794000       1.546000     -0.2359000    
 H   0.3302000      0.8008000       1.245500    
 H   0.6473000     -0.6235000      -1.453100    
 H   -3.678500      0.3616000      -1.302800    
 H   -4.501400     -0.8441000       1.386300    
 H   -5.639500     -0.3702000      0.1194000    
 H   -4.484700      -1.647500     -0.1999000    
 H   -3.836700       1.879900       1.347600    
 H   -5.088400       1.932300      0.1009000    
 H   -3.489900       2.543500     -0.2667000    
 H    3.521900      0.2635000       1.780200    
 H    4.363800      -1.086900      0.9721000    
 H    4.795700       1.888400      0.3744000    
 H    5.890100      0.8442000       1.300800    
 H    5.628600      0.5496000     -0.4288000    


%chk=000095689-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095689

0 1
O 1.967781 -0.442962 0.621428
O 3.005136 0.802342 -1.062243
C -2.348237 0.094095 0.276535
C -1.684314 -1.237899 -0.175491
C -1.412488 1.283185 -0.080342
C -0.249654 -1.413260 0.378917
C 0.022142 1.105643 0.475212
C 0.625055 -0.219680 -0.015491
C -3.777653 0.270441 -0.328247
C -4.713921 -0.913183 0.025991
C -4.444237 1.596207 0.120789
C 3.077373 0.129778 -0.007195
C 4.344522 -0.190340 0.773630
C 5.620465 0.319513 0.081390
H -2.455222 0.063670 1.385267
H -1.658401 -1.263421 -1.286078
H -2.292685 -2.101777 0.147418
H -1.824104 2.231009 0.310776
H -1.371111 1.386576 -1.185763
H -0.278635 -1.483571 1.484169
H 0.198894 -2.351357 0.002213
H 0.662200 1.950329 0.161516
H -0.003692 1.093430 1.583190
H 0.777770 -0.177594 -1.111895
H -3.667116 0.300761 -1.435012
H -4.782569 -1.042036 1.124164
H -5.735439 -0.725043 -0.353575
H -4.371309 -1.868436 -0.408401
H -4.498239 1.652313 1.225862
H -5.477332 1.660885 -0.268364
H -3.900246 2.486645 -0.239297
H 4.235636 0.251492 1.783376
H 4.379586 -1.284877 0.931786
H 5.579206 1.411698 -0.069009
H 6.509606 0.081715 0.691834
H 5.744932 -0.143592 -0.912560


