%chk=000083036.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083036

0 1
 O   0.7149000      0.3494000     -0.2667000    
 O   -1.336100       1.505600     -8.2999997E-02
 C    4.202400      -1.125800     -0.2484000    
 C   -4.412700     -0.6972000     -0.2163000    
 C    2.729100     -0.8960000     -0.6222000    
 C   -3.493400      0.5197000     -0.4095000    
 C    2.071900      0.2444000      0.1460000    
 C   -2.083800      0.3159000      0.1329000    
 C   8.8999998E-03   1.397400      0.4012000    
 C    5.008400      0.1501000     -0.5030000    
 C    4.372800      -1.562500       1.207300    
 C   -3.806400      -1.921400     -0.9061000    
 C   -4.665200      -1.008000       1.259600    
 C   0.6893000       2.728500      0.1082000    
 H    4.592800      -1.921000     -0.8955000    
 H   -5.375300     -0.4695000     -0.6907000    
 H    2.158200      -1.818800     -0.4564000    
 H    2.647400     -0.6958000      -1.698700    
 H   -3.940900       1.400200      6.9200002E-02
 H   -3.432200      0.7711000      -1.476500    
 H    2.101500      6.4099997E-02   1.225000    
 H    2.605000       1.167800     -8.4899999E-02
 H   -2.105600      0.1041000       1.206600    
 H   -1.591900     -0.5123000     -0.3852000    
 H  -1.6799999E-02   1.210600       1.481900    
 H    4.830200      0.5361000      -1.512100    
 H    4.781500      0.9414000      0.2185000    
 H    6.080200     -6.1799999E-02 -0.4173000    
 H    3.758600      -2.443000       1.422700    
 H    5.417000      -1.828800       1.404400    
 H    4.098000     -0.7722000       1.912700    
 H   -4.536100      -2.739000     -0.9265000    
 H   -2.918900      -2.298100     -0.3880000    
 H   -3.535800      -1.697200      -1.943300    
 H   -3.759900      -1.345900       1.773400    
 H   -5.413200      -1.802400       1.358100    
 H   -5.046800     -0.1249000       1.782500    
 H   0.9162000       2.828500     -0.9592000    
 H    1.621200       2.851400      0.6678000    
 H   3.4200002E-02   3.563300      0.3815000    


%chk=000083036-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083036

0 1
O 0.817279 0.876323 -0.604676
O -1.361102 1.714546 -0.237667
C 4.007768 -1.237364 -0.207960
C -4.200662 -0.879206 -0.056584
C 2.671696 -0.663220 -0.758699
C -3.417131 0.444793 -0.286037
C 2.036721 0.441780 0.096231
C -1.937599 0.396337 0.111678
C 0.014422 1.862772 0.152724
C 5.138175 -0.178893 -0.172162
C 3.838198 -1.916845 1.173667
C -3.685755 -2.034151 -0.951453
C -4.225111 -1.301501 1.433779
C 0.430778 3.294167 -0.178239
H 4.319066 -2.025113 -0.926205
H -5.248622 -0.670085 -0.358820
H 1.933003 -1.481940 -0.863872
H 2.838726 -0.252556 -1.773402
H -3.903649 1.263493 0.279856
H -3.470423 0.721235 -1.357076
H 1.772027 0.067190 1.110054
H 2.733416 1.299075 0.215531
H -1.812930 0.228200 1.204183
H -1.383785 -0.389995 -0.433274
H 0.135000 1.630228 1.242239
H 5.257241 0.312210 -1.156201
H 4.934787 0.609383 0.577391
H 6.104354 -0.646492 0.094186
H 3.027405 -2.669342 1.153155
H 4.770295 -2.429911 1.475255
H 3.597057 -1.179113 1.962321
H -4.343988 -2.919092 -0.867963
H -2.666543 -2.349807 -0.659671
H -3.653653 -1.731368 -2.014753
H -3.219554 -1.602723 1.783636
H -4.900876 -2.163576 1.586450
H -4.576191 -0.474372 2.079250
H 0.270077 3.476859 -1.253510
H 1.498763 3.449812 0.055266
H -0.169984 4.016260 0.401375


