%chk=000138575.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138575

0 1
 O  -0.9056000       1.657900      0.6693000    
 O   -2.199100      0.8942000      -1.203700    
 O    1.447100       1.939600      0.6475000    
 O   -1.513100      -1.031500     -6.5000001E-03
 O    1.893100     -0.3693000      0.1750000    
 C   -2.120200       1.762000     -7.2200000E-02
 C   0.2382000       1.997100     -0.1118000    
 C   -2.505300     -0.4563000     -0.8527000    
 C    1.715700      0.6382000       1.170500    
 C   -1.800700      -2.389600      0.2953000    
 C    3.176400     -0.3052000     -0.4326000    
 C  -0.7117000      -2.936200       1.193600    
 C    3.285200      -1.400800      -1.471700    
 H   -2.226400       2.791400     -0.4325000    
 H   -2.958500       1.573400      0.6079000    
 H   0.1367000       3.026900     -0.4702000    
 H   0.3253000       1.336000     -0.9816000    
 H   -2.558800      -1.024600      -1.787200    
 H   -3.487700     -0.4900000     -0.3668000    
 H   0.8888000      0.3285000       1.818800    
 H    2.605300      0.7019000       1.807500    
 H   -2.768400      -2.457800      0.8045000    
 H   -1.843600      -2.974200     -0.6304000    
 H    3.312700      0.6719000     -0.9089000    
 H    3.953700     -0.4426000      0.3272000    
 H   0.2634000      -2.872600      0.6994000    
 H  -0.6399000      -2.348300       2.114700    
 H  -0.9069000      -3.980100       1.454500    
 H    3.138400      -2.383800      -1.012200    
 H    2.507300      -1.287100      -2.234000    
 H    4.263500      -1.381400      -1.959800    


%chk=000138575-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138575

0 1
O -1.090653 2.135536 0.224032
O -2.813734 0.583795 -0.572583
O 1.222641 1.734994 0.137863
O -1.710152 -1.033241 0.867058
O 1.957814 -0.570936 0.201999
C -2.397297 1.972923 -0.369582
C 0.032681 1.735485 -0.656153
C -2.883228 -0.225900 0.653198
C 1.389375 0.521676 0.958485
C -1.585754 -2.157044 -0.096725
C 3.360459 -0.341406 -0.216553
C -0.423946 -3.035492 0.361209
C 3.841922 -1.610247 -0.917247
H -2.459319 2.412898 -1.383881
H -3.079175 2.487628 0.332823
H 0.180326 2.502479 -1.439047
H -0.180737 0.737971 -1.090208
H -3.780114 -0.862999 0.515510
H -2.966793 0.421602 1.544456
H 0.414597 0.155292 1.320490
H 2.060684 0.844566 1.776252
H -2.544607 -2.720830 -0.109590
H -1.409676 -1.747104 -1.110584
H 3.401744 0.536897 -0.889546
H 3.973963 -0.119702 0.683814
H 0.516170 -2.458242 0.364782
H -0.609459 -3.427256 1.376725
H -0.307794 -3.893128 -0.327541
H 3.788496 -2.477056 -0.235961
H 3.217541 -1.825568 -1.801835
H 4.888926 -1.489993 -1.250761


