%chk=000085911.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085911

0 1
 O  -0.3656000       1.970200     -0.5037000    
 O    2.290400     -2.9200001E-02  0.3406000    
 O    2.417700       2.275500      0.2487000    
 C  -0.4966000      0.5520000     -0.6153000    
 C   0.3199000       1.175100      0.4720000    
 C   -1.834300     -2.0000000E-02 -0.2937000    
 C    1.780300       1.235200      0.3414000    
 C   -1.948500      -1.358200      8.3099999E-02
 C   -2.972900      0.7822000     -0.3714000    
 C   -3.201200      -1.894300      0.3818000    
 C   -4.225500      0.2460000     -7.2600000E-02
 C   -4.339500      -1.092300      0.3040000    
 C    3.713400     -0.1182000      0.2179000    
 C    4.107200      -1.557900      0.2335000    
 C    4.755000      -2.166100     -0.7664000    
 H   3.6600001E-02  9.1600001E-02  -1.442200    
 H  -7.0100002E-02   1.201100       1.482300    
 H   -1.067400      -1.991400      0.1468000    
 H   -2.909700       1.825300     -0.6693000    
 H   -3.290100      -2.936300      0.6751000    
 H   -5.112400      0.8698000     -0.1346000    
 H   -5.314800      -1.509800      0.5362000    
 H    4.029100      0.3721000     -0.7106000    
 H    4.183300      0.3903000       1.067600    
 H    3.850800      -2.136700       1.116900    
 H    5.015200      -3.216400     -0.6935000    
 H    5.035400      -1.633500      -1.668400    


%chk=000085911-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085911

0 1
O -0.168859 1.563828 -0.966040
O 2.422651 0.369924 -0.519077
O 2.375408 1.241704 1.651008
C -0.462876 0.148063 -0.536762
C 0.311856 1.080625 0.375634
C -1.885093 -0.214161 -0.263590
C 1.790386 0.925053 0.587006
C -2.279019 -1.574836 -0.326569
C -2.848078 0.774941 0.063235
C -3.613277 -1.945361 -0.048767
C -4.181656 0.403860 0.334906
C -4.567689 -0.957143 0.285394
C 3.918441 0.211391 -0.414922
C 4.280007 -1.068222 0.293352
C 4.919433 -2.100854 -0.309605
H 0.142410 -0.590932 -1.077759
H -0.205029 1.526345 1.233739
H -1.542050 -2.343244 -0.591353
H -2.550799 1.829866 0.066907
H -3.908354 -2.999325 -0.097721
H -4.922433 1.173267 0.579149
H -5.604043 -1.242995 0.496582
H 4.252505 0.215225 -1.463581
H 4.309040 1.092510 0.126200
H 4.014460 -1.119218 1.357331
H 5.192696 -3.006633 0.242664
H 5.195661 -2.067579 -1.371160


