%chk=000006986.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006986

0 1
 O  -0.3834000       2.326800     -0.6586000    
 C  -0.8267000     -3.3599999E-02 -0.6707000    
 C   8.7200001E-02  -1.163700      -1.151700    
 C    2.099900     -0.1273000     -3.6800001E-02
 C    1.280400      -1.410100     -0.2289000    
 C   -1.680400     -0.4318000      0.5290000    
 C    1.229800       1.001400      0.5172000    
 C  -6.2000002E-03   1.200500     -0.3339000    
 C    3.294400     -0.3827000      0.8799000    
 C   -2.608200      0.7126000      0.9331000    
 C   -2.487000      -1.692100      0.2214000    
 H   -1.482500      0.2351000      -1.510500    
 H   0.4870000     -0.8752000      -2.134400    
 H  -0.4522000      -2.097600      -1.331000    
 H    2.485300      0.1815000      -1.018100    
 H   0.9351000      -1.793500      0.7387000    
 H    1.914600      -2.189800     -0.6682000    
 H   -1.045900     -0.6487000       1.397300    
 H    1.798300       1.938600      0.5288000    
 H   0.9090000      0.7944000       1.544000    
 H    2.970800     -0.7006000       1.876900    
 H    3.939800      -1.165600      0.4680000    
 H    3.898100      0.5240000      0.9928000    
 H   -3.231200       1.038200      9.3000002E-02
 H   -3.278400      0.3989000       1.741200    
 H   -2.051800       1.578100       1.305600    
 H   -3.025400      -1.605200     -0.7283000    
 H   -3.229600      -1.875700       1.006400    
 H   -1.854300      -2.583900      0.1865000    


%chk=000006986-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000006986

0 1
O -0.270399 2.348586 -0.921683
C -0.841621 -0.026857 -0.710744
C 0.116698 -1.137546 -1.241271
C 2.134417 -0.136081 -0.023620
C 1.298451 -1.414792 -0.282901
C -1.683306 -0.448116 0.547235
C 1.214314 1.015469 0.485632
C 0.000411 1.222863 -0.420017
C 3.292999 -0.388050 0.964042
C -2.608343 0.711211 0.992889
C -2.522894 -1.717886 0.267919
H -1.561395 0.245851 -1.508290
H 0.521497 -0.811531 -2.221128
H -0.453702 -2.064387 -1.433793
H 2.566144 0.187151 -0.995003
H 0.925186 -1.809711 0.684371
H 1.950771 -2.200178 -0.712362
H -0.989108 -0.677304 1.381844
H 1.769401 1.967377 0.557784
H 0.859064 0.751909 1.504344
H 2.904771 -0.718040 1.947117
H 3.974792 -1.173734 0.588395
H 3.889657 0.528686 1.126726
H -3.327224 0.963550 0.190304
H -3.186802 0.426072 1.890969
H -2.042803 1.630866 1.226806
H -3.167480 -1.574577 -0.620502
H -3.181440 -1.937513 1.128796
H -1.895554 -2.610288 0.094841


