%chk=000093019.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093019

0 1
 O    1.249800     -0.7432000      -1.359200    
 C   0.9328000     -1.3500000E-02  0.8936000    
 C   0.1744000       1.312900      0.8815000    
 C  -5.9000002E-03  -1.204900       1.109400    
 C  -0.9785000       1.327900     -0.1284000    
 C   -1.775000      4.9300000E-02 -0.1617000    
 C   -1.330600      -1.081100      0.4130000    
 C    1.718400     -0.1694000     -0.3774000    
 C   -3.091000      0.1092000     -0.8794000    
 C    3.105800      0.4130000     -0.3912000    
 H    1.657500     -1.0500000E-02   1.718000    
 H   0.8482000       2.151700      0.6703000    
 H  -0.2354000       1.489300       1.885100    
 H  -0.2093000      -1.309900       2.182700    
 H   0.4783000      -2.136200      0.7905000    
 H  -0.5845000       1.520000      -1.134100    
 H   -1.638200       2.168600      0.1189000    
 H   -1.942900      -1.978800      0.3812000    
 H   -2.940300      0.4075000      -1.922000    
 H   -3.752200      0.8388000     -0.4008000    
 H   -3.605900     -0.8572000     -0.8804000    
 H    3.061700       1.487500     -0.1993000    
 H    3.719700     -8.1400000E-02  0.3658000    
 H    3.561000      0.2513000      -1.372400    


%chk=000093019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093019

0 1
O 1.515144 -1.181088 -1.201049
C 0.948406 -0.124932 0.944258
C 0.198132 1.245293 0.935827
C -0.058640 -1.281437 1.162528
C -0.876384 1.298933 -0.171790
C -1.776791 0.070339 -0.161512
C -1.389522 -1.075540 0.460844
C 1.787641 -0.307067 -0.335716
C -3.096233 0.193018 -0.897895
C 3.010889 0.595669 -0.493501
H 1.673315 -0.097965 1.785915
H 0.909513 2.086018 0.829664
H -0.292267 1.360034 1.921736
H -0.230117 -1.416612 2.251300
H 0.389520 -2.225309 0.795517
H -0.396903 1.394471 -1.170064
H -1.491701 2.212898 -0.044339
H -2.065960 -1.942572 0.449400
H -2.932577 0.451016 -1.963790
H -3.724581 0.999923 -0.469720
H -3.673639 -0.747291 -0.862750
H 2.791530 1.645292 -0.230873
H 3.807186 0.249267 0.194686
H 3.391941 0.538545 -1.524976


