%chk=000041671.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041671

0 1
 O   -5.115200      -1.061600     -0.8421000    
 O   -5.199100      -1.160000       1.459800    
 C   0.3180000      0.2817000      0.4009000    
 C    1.617200      0.5631000     -0.3595000    
 C  -0.8920000      0.8569000     -0.3392000    
 C    2.823900     -3.9099999E-02  0.3640000    
 C   -2.224000      0.5965000      0.3735000    
 C    4.148800      0.1865000     -0.3701000    
 C   -3.423600       1.243500     -0.3304000    
 C    5.364200     -0.3503000      0.3889000    
 C   -4.783500      0.9596000      0.3314000    
 C    6.664600     -3.4100000E-02 -0.3534000    
 C    7.883100     -0.5353000      0.4216000    
 C   -5.936800       1.690000     -0.3552000    
 C   -5.055400     -0.5348000      0.4172000    
 C    9.179100     -0.1943000     -0.2963000    
 C   -5.369200      -2.468300     -0.9109000    
 H   0.3757000      0.7180000       1.405300    
 H   0.1886000     -0.8003000      0.5241000    
 H    1.756100       1.645400     -0.4676000    
 H    1.551400      0.1422000      -1.370100    
 H  -0.9384000      0.4298000      -1.348700    
 H  -0.7570000       1.939000     -0.4593000    
 H    2.892100      0.3957000       1.369000    
 H    2.669600      -1.117200      0.4956000    
 H   -2.371200     -0.4874000      0.4450000    
 H   -2.166300      0.9776000       1.400400    
 H    4.278800       1.262400     -0.5417000    
 H    4.098400     -0.2873000      -1.358300    
 H   -3.444400      0.9045000      -1.374300    
 H   -3.266600       2.329200     -0.3626000    
 H    5.265200      -1.434300      0.5213000    
 H    5.395300      9.6900001E-02   1.389900    
 H   -4.736100       1.322100       1.367200    
 H    6.747300       1.049400     -0.5032000    
 H    6.643300     -0.4971000      -1.347400    
 H    7.818700      -1.621600      0.5540000    
 H    7.899100     -8.6900003E-02   1.421800    
 H   -6.891500       1.445500      0.1228000    
 H   -6.014600       1.411300      -1.411700    
 H   -5.795300       2.774300     -0.3010000    
 H    9.289500      0.8885000     -0.4138000    
 H    9.209500     -0.6530000      -1.289800    
 H    10.03700     -0.5632000      0.2746000    
 H   -4.567900      -3.022100     -0.4125000    
 H   -5.393100      -2.758200      -1.964800    
 H   -6.338900      -2.700600     -0.4607000    


%chk=000041671-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000041671

0 1
O -5.135315 -1.149421 -0.821797
O -5.380855 -1.164130 1.490812
C 0.291128 0.318553 0.361784
C 1.633531 0.640652 -0.332750
C -0.931524 0.938260 -0.351561
C 2.855491 0.015789 0.377467
C -2.272953 0.610525 0.341960
C 4.198039 0.331504 -0.319801
C -3.488274 1.230094 -0.382330
C 5.418515 -0.301494 0.386140
C -4.847044 0.962631 0.321989
C 6.761253 0.007631 -0.313805
C 7.980031 -0.633356 0.388864
C -6.013508 1.679721 -0.408440
C -5.141060 -0.531326 0.436607
C 9.316840 -0.323763 -0.319378
C -5.439332 -2.599756 -0.825410
H 0.325299 0.679501 1.411069
H 0.162588 -0.782824 0.417313
H 1.764274 1.742030 -0.385689
H 1.597502 0.281881 -1.382895
H -0.965234 0.578280 -1.401193
H -0.804799 2.040184 -0.405034
H 2.893869 0.376805 1.426696
H 2.722326 -1.085150 0.433352
H -2.393885 -0.491224 0.395125
H -2.242821 0.970544 1.391348
H 4.334823 1.432190 -0.371404
H 4.157416 -0.025336 -1.370453
H -3.542716 0.845526 -1.419016
H -3.353252 2.329011 -0.450630
H 5.279190 -1.401810 0.440477
H 5.461686 0.057551 1.435930
H -4.791941 1.327625 1.365197
H 6.905460 1.107501 -0.363982
H 6.717588 -0.347475 -1.364971
H 7.833077 -1.731720 0.440744
H 8.024258 -0.276520 1.438283
H -6.979241 1.502900 0.098355
H -6.096060 1.321791 -1.449346
H -5.831416 2.769627 -0.426160
H 9.502285 0.766544 -0.355945
H 9.308275 -0.696421 -1.361259
H 10.171325 -0.794452 0.201110
H -4.703039 -3.148318 -0.213877
H -5.378852 -2.897377 -1.881795
H -6.448547 -2.780378 -0.418001


