%chk=000093698.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093698

0 1
 O    3.039200      -1.596200      5.6499999E-02
 C   0.5573000     -0.2190000     -0.9060000    
 C  -0.4639000     -0.7849000      0.1034000    
 C   -1.054800      0.4927000      0.7488000    
 C  -0.3141000       1.626400      8.3999997E-03
 C  -0.1431000       1.054500      -1.402200    
 C    1.770000      0.4143000     -0.1764000    
 C    1.147000       1.653300      0.5055000    
 C   -1.650800      -1.528000     -0.5153000    
 C   -2.562900      0.4306000      0.4998000    
 C   -2.846100      -1.049700      0.2947000    
 C    2.522200     -0.4939000      0.7828000    
 H   0.8389000     -0.9191000      -1.696000    
 H  -3.8000001E-03  -1.430100      0.8573000    
 H  -0.8561000      0.5150000       1.827000    
 H  -0.8115000       2.596700      6.6399999E-02
 H   -1.087000      0.8699000      -1.921700    
 H   0.4934000       1.675700      -2.042300    
 H    2.479100      0.7539000     -0.9452000    
 H    1.653200       2.561200      0.1572000    
 H    1.213900       1.626600       1.598000    
 H   -1.525600      -2.613500     -0.4505000    
 H   -1.784000      -1.279500      -1.574000    
 H   -2.852000      0.9997000     -0.3910000    
 H   -3.128700      0.8379000       1.343600    
 H   -2.881300      -1.566800       1.261000    
 H   -3.794400      -1.223600     -0.2217000    
 H    1.914000     -0.8586000       1.614800    
 H    3.370900      4.5100000E-02   1.216900    
 H    2.288100      -2.149400     -0.2170000    


%chk=000093698-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093698

0 1
O 3.066791 -1.718015 0.152073
C 0.570670 -0.210496 -0.938463
C -0.451090 -0.790895 0.087968
C -1.063376 0.514048 0.756558
C -0.317521 1.667416 0.017562
C -0.156337 1.082239 -1.416228
C 1.797905 0.420090 -0.190410
C 1.164253 1.687429 0.504416
C -1.658582 -1.560818 -0.522979
C -2.598790 0.429922 0.515864
C -2.882093 -1.079993 0.300460
C 2.539087 -0.499344 0.793067
H 0.853584 -0.917783 -1.738449
H 0.041322 -1.432654 0.842487
H -0.853441 0.550395 1.842635
H -0.827038 2.643405 0.090833
H -1.114930 0.888829 -1.928362
H 0.472761 1.710940 -2.072259
H 2.529156 0.738352 -0.959113
H 1.676790 2.612812 0.186023
H 1.231090 1.633579 1.608933
H -1.523951 -2.657237 -0.486666
H -1.794307 -1.282215 -1.586825
H -2.873676 0.992726 -0.398254
H -3.180645 0.859801 1.350977
H -2.906638 -1.601584 1.277558
H -3.846390 -1.272515 -0.204260
H 1.889185 -0.760821 1.656310
H 3.436198 0.006978 1.188259
H 2.307112 -2.213391 -0.246913


