%chk=000031289.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031289

0 1
 O   -4.701700      -1.127700      4.1900001E-02
 C   0.4897000     -0.2723000     -4.4100001E-02
 C    1.808700      0.5023000      1.0000000E-03
 C  -0.7114000      0.6763000     -7.9999998E-04
 C    3.045500     -0.4005000     -8.1000002E-03
 C   -2.032100     -9.9900000E-02 -1.3200000E-02
 C    4.362800      0.3728000      6.2399998E-02
 C   -3.249200      0.8208000     -5.1000002E-03
 C    5.559700     -0.5622000     -2.2700001E-02
 C   -4.572000      9.0400003E-02 -1.1200000E-02
 H   0.4509000     -0.8782000     -0.9572000    
 H   0.4435000     -0.9636000      0.8059000    
 H    1.856900       1.185400     -0.8562000    
 H    1.830600       1.125500      0.9038000    
 H  -0.6616000       1.296400      0.9023000    
 H  -0.6754000       1.354000     -0.8623000    
 H    2.990100      -1.095900      0.8387000    
 H    3.031400      -1.011100     -0.9196000    
 H   -2.071400     -0.7444000     -0.9005000    
 H   -2.073000     -0.7667000      0.8572000    
 H    4.413000       1.095900     -0.7598000    
 H    4.410000      0.9409000      0.9985000    
 H   -3.234700       1.460900      0.8838000    
 H   -3.233400       1.469600     -0.8879000    
 H    5.557400      -1.118400     -0.9655000    
 H    6.491400      9.4999997E-03  3.2000002E-02
 H    5.554000      -1.282300      0.8017000    
 H   -5.460900      0.7433000     -5.5300001E-02


%chk=000031289-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000031289

0 1
O -4.809066 -1.137535 -0.084389
C 0.495815 -0.261110 -0.018677
C 1.833200 0.512416 0.014869
C -0.743789 0.660973 0.011590
C 3.073798 -0.408522 -0.014557
C -2.076866 -0.118129 -0.025042
C 4.411646 0.365396 0.019580
C -3.304198 0.810277 0.007128
C 5.645483 -0.562441 -0.009575
C -4.647875 0.105327 -0.029475
H 0.460209 -0.892832 -0.930649
H 0.454128 -0.959164 0.843276
H 1.875078 1.210189 -0.847877
H 1.868511 1.144607 0.927080
H -0.706791 1.291278 0.925285
H -0.698711 1.360318 -0.850000
H 3.034077 -1.106628 0.847806
H 3.040957 -1.040805 -0.926596
H -2.121103 -0.748741 -0.934006
H -2.128364 -0.819663 0.829956
H 4.450687 1.062666 -0.842337
H 4.443112 0.996949 0.931070
H -3.295469 1.454438 0.914488
H -3.286092 1.527062 -0.843874
H 5.653676 -1.181563 -0.926612
H 6.588557 0.014031 0.017404
H 5.644301 -1.249825 0.857473
H -5.536113 0.791830 -0.003639


