%chk=000081045.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081045

0 1
 O   -3.145000     -0.2328000     -0.4647000    
 O   -3.258500      -1.518100       1.450000    
 C    1.313800      -1.628600     -0.6894000    
 C  -5.4600000E-02  -1.960300     -8.9000002E-02
 C    2.397400      -1.381300      0.3644000    
 C   -1.100200      -2.185000      -1.186400    
 C    3.759500      -1.024700     -0.2351000    
 C   -2.484300      -2.488500     -0.6198000    
 C   -1.520000       2.168200     -0.2548000    
 C    4.818400     -0.8602000      0.8560000    
 C   -2.455100       1.662400      0.8425000    
 C  -0.2973000       2.916100      0.2840000    
 C   -3.637100      0.8982000      0.2609000    
 C   0.6257000       3.443600     -0.8151000    
 C   -3.004900      -1.379200      0.2604000    
 C    6.183000     -0.5434000      0.2648000    
 C    1.859200       4.113600     -0.2287000    
 H    1.631200      -2.449800      -1.343900    
 H    1.223100     -0.7363000      -1.321500    
 H   2.4400000E-02  -2.858700      0.5346000    
 H  -0.3598000      -1.136500      0.5661000    
 H    2.073800     -0.5709000       1.029500    
 H    2.497800      -2.279800      0.9859000    
 H   -1.148900      -1.297800      -1.829500    
 H  -0.7881000      -3.021500      -1.823200    
 H    3.674500     -9.7199999E-02 -0.8140000    
 H    4.069100      -1.813600     -0.9311000    
 H   -2.452000      -3.409300     -2.5599999E-02
 H   -3.205800      -2.655900      -1.427300    
 H   -1.168400       1.326700     -0.8638000    
 H   -2.078000       2.832400     -0.9266000    
 H    4.525400     -5.5399999E-02   1.540200    
 H    4.890100      -1.779900       1.448200    
 H   -1.888700       1.012800       1.520100    
 H   -2.825600       2.509300       1.431100    
 H   0.2689000       2.242300      0.9395000    
 H  -0.6332000       3.754700      0.9065000    
 H   -4.343100      0.6011000       1.044900    
 H   -4.190100       1.526100     -0.4459000    
 H   8.4100001E-02   4.161200      -1.442000    
 H   0.9402000       2.617400      -1.463300    
 H    6.154600      0.3878000     -0.3099000    
 H    6.519500      -1.346700     -0.3985000    
 H    6.924100     -0.4283000       1.062000    
 H    1.581000       4.960900      0.4060000    
 H    2.440000       3.407800      0.3739000    
 H    2.504500       4.486600      -1.030200    


%chk=000081045-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081045

0 1
O -3.213031 -0.298205 -0.626174
O -3.610111 -1.342884 1.422136
C 1.193402 -1.657876 -0.765843
C -0.167148 -1.960261 -0.099406
C 2.253487 -1.131646 0.228222
C -1.253687 -2.386795 -1.111147
C 3.614804 -0.818692 -0.432183
C -2.640917 -2.630371 -0.459786
C -1.304773 2.050620 -0.242005
C 4.660553 -0.258791 0.559287
C -2.496503 1.706774 0.679135
C -0.104962 2.650622 0.524541
C -3.657882 1.005101 -0.040524
C 1.104827 2.961545 -0.386220
C -3.199988 -1.399830 0.239400
C 6.023350 0.037668 -0.103051
C 2.308445 3.544894 0.384972
H 1.575243 -2.574161 -1.262901
H 1.044798 -0.907069 -1.570714
H -0.038835 -2.751435 0.668031
H -0.507706 -1.054853 0.444172
H 1.866231 -0.212664 0.717697
H 2.400607 -1.875694 1.038840
H -1.358661 -1.609171 -1.891036
H -0.939592 -3.318526 -1.622559
H 3.464864 -0.087447 -1.254491
H 4.015587 -1.739842 -0.905102
H -2.589484 -3.435356 0.293655
H -3.362320 -2.940859 -1.240474
H -0.978794 1.134313 -0.772910
H -1.636597 2.763287 -1.025952
H 4.262300 0.669169 1.019403
H 4.800165 -0.982153 1.388630
H -2.161016 1.067220 1.518188
H -2.896705 2.636321 1.134787
H 0.211962 1.942729 1.319628
H -0.421002 3.579090 1.045070
H -4.496357 0.810718 0.651587
H -4.004856 1.576512 -0.917784
H 0.791928 3.671355 -1.179073
H 1.413941 2.031128 -0.906468
H 5.915674 0.781717 -0.914888
H 6.456849 -0.879441 -0.545126
H 6.751085 0.437363 0.627048
H 2.034369 4.487919 0.894643
H 2.663802 2.837797 1.159080
H 3.157252 3.759660 -0.290133


