%chk=000096853.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096853

0 1
 O   -1.735600      -3.489000      -1.042600    
 O   -1.046600       3.773400     -0.9681000    
 C  -0.8173000      7.1300000E-02  4.7100000E-02
 C   -1.403300      -1.131600     -0.7705000    
 C   -1.188700       1.376700     -0.7376000    
 C   -1.463100      0.1066000       1.475600    
 C   0.7288000     -6.0300000E-02  9.5200002E-02
 C   -1.167200      -2.517500     -0.1708000    
 C  -0.5969000       2.673500     -0.1834000    
 C   -2.986700      0.1827000       1.531400    
 C    1.324500     -0.1274000       1.322100    
 C    1.401200     -0.1011000      -1.092600    
 C    2.713800     -0.2459000       1.365000    
 C    2.790400     -0.2193000      -1.049700    
 C    3.446800     -0.2921000      0.1790000    
 H   -1.014100      -1.136500      -1.797400    
 H   -2.483200     -0.9930000     -0.9131000    
 H   -2.278600       1.486600     -0.8004000    
 H  -0.8833000       1.296300      -1.790000    
 H   -1.081400      0.9630000       2.045100    
 H   -1.182200     -0.7902000       2.042100    
 H  -0.1016000      -2.742000     -7.5800002E-02
 H   -1.637100      -2.631500      0.8094000    
 H  -0.9202000       2.848900      0.8460000    
 H   0.4960000       2.666500     -0.2159000    
 H   -3.368800       1.091200       1.059300    
 H   -3.459200     -0.6846000       1.063500    
 H   -3.313200      0.2016000       2.577200    
 H   0.8164000     -9.2600003E-02   2.275700    
 H   0.9171000     -4.4100001E-02  -2.060400    
 H    3.225900     -0.3011000       2.321200    
 H    3.361400     -0.2543000      -1.973000    
 H    4.528500     -0.3838000      0.2123000    
 H   -2.690600      -3.313500      -1.094400    
 H  -0.6537000       4.576200     -0.5850000    


%chk=000096853-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096853

0 1
O -1.652147 -3.580308 -1.086322
O -1.070616 3.757901 -1.066095
C -0.847593 0.081837 0.056721
C -1.441325 -1.117359 -0.764823
C -1.205884 1.386591 -0.734778
C -1.470026 0.122579 1.492076
C 0.698752 -0.067288 0.120777
C -1.217379 -2.515805 -0.161561
C -0.725443 2.695029 -0.100466
C -3.005791 0.268600 1.554596
C 1.420600 -0.156954 1.339999
C 1.449704 -0.119086 -1.087206
C 2.829316 -0.291230 1.354514
C 2.853832 -0.252759 -1.079706
C 3.555503 -0.339257 0.145437
H -0.997281 -1.121181 -1.778296
H -2.529504 -0.949114 -0.905496
H -2.301287 1.445975 -0.876922
H -0.766395 1.333339 -1.748497
H -1.017340 0.961691 2.056103
H -1.183082 -0.796824 2.038786
H -0.143045 -2.710511 -0.011195
H -1.736008 -2.623993 0.814380
H -1.233767 2.881440 0.869628
H 0.370329 2.660358 0.072360
H -3.355130 1.194667 1.063541
H -3.524676 -0.581974 1.076306
H -3.340281 0.306159 2.607605
H 0.893031 -0.125924 2.297623
H 0.934698 -0.056081 -2.052869
H 3.355868 -0.360000 2.313609
H 3.399983 -0.291242 -2.029167
H 4.646067 -0.444419 0.154955
H -2.617229 -3.460450 -1.277039
H -0.748253 4.628693 -0.722081


