%chk=000038689.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038689

0 1
 O    2.026700     -3.9500002E-02 -0.3000000    
 O    2.973100      -1.869900      0.7444000    
 C   -2.839900      -1.611500     -0.2189000    
 C   0.1045000       2.130600      0.2428000    
 C   -1.863900     -0.9813000      -1.230300    
 C  -0.2435000      0.6922000     -0.1483000    
 C   -1.378000      0.3796000     -0.8087000    
 C   0.7696000     -0.3365000      0.2938000    
 C   -4.017100     -0.6869000      0.1019000    
 C   -2.096200      -1.967300       1.070600    
 C  -0.3914000       3.204100     -0.7344000    
 C  -0.3976000       2.438100       1.656500    
 C    3.049000     -0.8927000      1.2000000E-02
 C    4.304800     -0.4590000     -0.6814000    
 H   -3.233300      -2.536600     -0.6584000    
 H    1.197700       2.229000      0.2528000    
 H   -1.031700      -1.663800      -1.432400    
 H   -2.377100     -0.8649000      -2.194000    
 H   -2.065800       1.181400      -1.067900    
 H   0.4895000      -1.353000      1.0700000E-02
 H   0.8653000     -0.3060000       1.385800    
 H   -3.706300      0.2114000      0.6454000    
 H   -4.749400      -1.209200      0.7274000    
 H   -4.527500     -0.3753000     -0.8154000    
 H   -1.741700      -1.084400       1.610300    
 H   -1.246300      -2.626500      0.8680000    
 H   -2.765600      -2.508100       1.749600    
 H   -1.480200       3.319000     -0.7045000    
 H  -9.4499998E-02   2.969600      -1.762400    
 H   4.2700000E-02   4.177600     -0.4795000    
 H  -0.1044000       3.448900       1.960300    
 H   -1.490100       2.373100       1.715100    
 H   2.0400001E-02   1.739900       2.389300    
 H    4.579700      0.5469000     -0.3543000    
 H    4.157900     -0.4856000      -1.764000    
 H    5.117400      -1.143900     -0.4227000    


%chk=000038689-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000038689

0 1
O 2.079258 -0.473883 -0.533559
O 3.188071 -0.038461 1.481360
C -3.120593 -1.583774 -0.257805
C 0.300287 1.922777 0.131405
C -1.980557 -1.084595 -1.210297
C -0.176366 0.504127 -0.218504
C -1.375980 0.250850 -0.820853
C 0.762298 -0.611464 0.190065
C -4.293377 -0.577398 -0.180529
C -2.580561 -1.918651 1.151589
C -0.508550 3.050896 -0.546032
C 0.330900 2.138988 1.673788
C 3.212457 -0.198477 0.238497
C 4.442594 -0.142508 -0.642670
H -3.509894 -2.522157 -0.707324
H 1.347319 2.006714 -0.230538
H -1.208995 -1.875103 -1.274097
H -2.411717 -0.984912 -2.227743
H -2.010967 1.116845 -1.050820
H 0.391528 -1.605071 -0.098975
H 0.982082 -0.597964 1.273270
H -3.981327 0.359557 0.316987
H -5.134734 -0.999731 0.399711
H -4.671105 -0.320073 -1.188307
H -2.151230 -1.019089 1.631042
H -1.790662 -2.692817 1.108020
H -3.389034 -2.298738 1.803407
H -1.545862 3.093062 -0.162660
H -0.550211 2.922247 -1.642964
H -0.039459 4.028698 -0.332534
H 0.685624 3.159969 1.907428
H -0.683334 2.022537 2.100089
H 1.011603 1.430220 2.176737
H 4.243173 0.454767 -1.547418
H 4.709867 -1.162652 -0.972053
H 5.284251 0.284760 -0.078511


