%chk=000018027.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018027

0 1
 O    8.441700      -1.401600     -5.6600001E-02
 C   -1.765800     -0.4066000      2.7000001E-03
 C  -0.5166000      0.4785000     -2.7000001E-03
 C   -3.074600      0.3898000     -3.1700000E-02
 C   0.7921000     -0.3178000      3.2800000E-02
 C   -4.326100     -0.4902000      2.4000001E-03
 C    2.043900      0.5620000     -2.0000001E-03
 C   -5.600000      0.3579000     -2.3900000E-02
 C    3.318200     -0.2873000      2.5100000E-02
 C   -6.853500     -0.5181000      4.2100001E-02
 C    4.570300      0.5905000     -4.1499998E-02
 C   -8.125700      0.3304000     -1.7700000E-02
 C    5.880000     -0.2062000      2.0999999E-03
 C   -9.410100     -0.5005000      2.0600000E-02
 C    7.151300      0.6419000      1.9700000E-02
 C   -10.67740      0.3398000     -1.2900000E-02
 C    8.433000     -0.1732000      8.7000001E-03
 C    9.719300      0.6107000      3.2800000E-02
 H   -1.733800      -1.081800     -0.8612000    
 H   -1.753600      -1.038600      0.8992000    
 H  -0.5489000       1.154200      0.8608000    
 H  -0.5285000       1.110000     -0.8996000    
 H   -3.091800       1.009200     -0.9371000    
 H   -3.094800       1.078100      0.8225000    
 H   0.8093000     -0.9363000      0.9387000    
 H   0.8126000      -1.006900     -0.8208000    
 H   -4.318100      -1.172700     -0.8559000    
 H   -4.312900      -1.108300      0.9082000    
 H    2.036000       1.245100      0.8558000    
 H    2.030800       1.179200     -0.9084000    
 H   -5.596400       1.055400      0.8225000    
 H   -5.619100      0.9607000     -0.9400000    
 H    3.317200     -0.9845000     -0.8213000    
 H    3.340200     -0.8895000      0.9412000    
 H   -6.846600      -1.105100      0.9684000    
 H   -6.850100      -1.229500     -0.7924000    
 H    4.548400       1.189400     -0.9603000    
 H    4.558500       1.297400      0.7974000    
 H   -8.117900      0.9325000     -0.9348000    
 H   -8.129200       1.035000      0.8233000    
 H    5.875100     -0.8518000      0.8900000    
 H    5.909200     -0.8813000     -0.8628000    
 H   -9.420600      -1.192100     -0.8303000    
 H   -9.418000      -1.114600      0.9290000    
 H    7.165800       1.296300     -0.8591000    
 H    7.159200       1.269900      0.9175000    
 H   -10.71950       1.016600      0.8462000    
 H   -11.56180     -0.3041000      1.6000001E-02
 H   -10.72240      0.9410000     -0.9265000    
 H    9.743600       1.248000      0.9202000    
 H    10.56950     -7.5999998E-02  7.1099997E-02
 H    9.793700       1.219600     -0.8714000    


%chk=000018027-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000018027

0 1
O 8.575825 -1.403966 0.337675
C -1.775040 -0.391048 0.011444
C -0.499742 0.481693 0.020709
C -3.082129 0.433449 0.008176
C 0.807303 -0.342849 0.022146
C -4.357592 -0.439102 0.000180
C 2.082576 0.529931 0.032444
C -5.664572 0.385599 -0.003784
C 3.388872 -0.295494 0.031356
C -6.940262 -0.486849 -0.011278
C 4.664605 0.576659 0.041698
C -8.247312 0.337795 -0.015163
C 5.964527 -0.257548 0.042153
C -9.523080 -0.535403 -0.022629
C 7.230978 0.618374 0.043973
C -10.823694 0.296988 -0.026302
C 8.544917 -0.165609 0.107588
C 9.825141 0.630809 -0.134032
H -1.758457 -1.054367 -0.878765
H -1.766821 -1.060807 0.896915
H -0.515881 1.144069 0.911689
H -0.508669 1.152307 -0.864206
H -3.090686 1.102532 -0.877881
H -3.098330 1.097451 0.897939
H 0.815891 -1.014097 0.906406
H 0.823607 -1.004639 -0.869149
H -4.341285 -1.103506 -0.889250
H -4.349308 -1.107816 0.886471
H 2.066765 1.190385 0.924896
H 2.072798 1.202311 -0.851187
H -5.680779 1.050248 0.885481
H -5.672999 1.054121 -0.890250
H 3.404337 -0.955986 -0.860669
H 3.398834 -0.967902 0.914389
H -6.931879 -1.155385 0.875206
H -6.924205 -1.151494 -0.900593
H 4.653005 1.249620 -0.841761
H 4.647517 1.236712 0.934857
H -8.257376 1.006296 -0.901683
H -8.265027 1.002465 0.874112
H 5.986485 -0.926815 0.922974
H 5.983634 -0.924131 -0.842222
H -9.504246 -1.199019 -0.911355
H -9.511856 -1.203099 0.863157
H 7.259929 1.281988 -0.845857
H 7.218483 1.308829 0.916171
H -10.881067 0.945347 0.868556
H -11.720540 -0.349695 -0.033296
H -10.871776 0.951796 -0.917015
H 9.777625 1.630630 0.334152
H 10.698239 0.076249 0.244487
H 9.957818 0.786473 -1.222972


