%chk=000102718.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102718

0 1
 O    2.446000      0.6912000       1.127600    
 O    1.015700     -0.8097000     -2.7899999E-02
 C    3.389900      -1.245100     -9.9999998E-03
 C    2.198800     -0.6660000      0.7525000    
 C    3.766800     -0.3683000      -1.201000    
 C    3.931400       1.080900     -0.7604000    
 C    2.708900       1.548100      1.6799999E-02
 C   -1.348900     -0.4859000     -0.2325000    
 C   -2.607300      7.4800000E-02  0.4279000    
 C  -0.1202000     -0.2832000      0.6441000    
 C   -3.876300     -0.1351000     -0.4030000    
 C   -5.131800      0.4479000      0.2468000    
 C   -6.373100      0.1504000     -0.5808000    
 H    3.166500      -2.258700     -0.3609000    
 H    4.253400      -1.300900      0.6641000    
 H    2.071000      -1.242600       1.676400    
 H    2.986100     -0.4319000      -1.968700    
 H    4.695100     -0.7313000      -1.655800    
 H    4.816000       1.152800     -0.1157000    
 H    4.101100       1.726300      -1.628400    
 H    2.883600       2.554600      0.4104000    
 H    1.827100       1.601900     -0.6316000    
 H   -1.187100     -6.3999998E-03  -1.205900    
 H   -1.474800      -1.555500     -0.4412000    
 H   -2.742400     -0.3969000       1.409200    
 H   -2.472200       1.148500      0.6090000    
 H   8.5000005E-03  0.7866000      0.8413000    
 H  -0.2540000     -0.8032000       1.600100    
 H   -3.738000      0.3192000      -1.392100    
 H   -4.018700      -1.210700     -0.5665000    
 H   -5.259900      2.6699999E-02   1.250500    
 H   -5.021000       1.532300      0.3608000    
 H   -7.259300      0.5776000     -0.1011000    
 H   -6.288400      0.5813000      -1.583500    
 H   -6.528500     -0.9285000     -0.6818000    


%chk=000102718-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000102718

0 1
O 2.573254 0.838692 1.123075
O 1.055283 -0.745194 0.090554
C 3.411896 -1.235361 0.018092
C 2.294731 -0.575524 0.841424
C 3.709726 -0.431533 -1.269385
C 3.997334 1.048324 -0.919093
C 2.827450 1.629758 -0.105818
C -1.346104 -0.457054 -0.113256
C -2.672398 -0.009326 0.542702
C -0.148243 -0.309567 0.828712
C -3.883274 -0.129323 -0.410108
C -5.212391 0.333117 0.228860
C -6.414207 0.220563 -0.734193
H 3.110881 -2.271408 -0.219281
H 4.318453 -1.278219 0.651849
H 2.196090 -1.015420 1.854754
H 2.833434 -0.487788 -1.942820
H 4.568182 -0.878687 -1.804113
H 4.928418 1.120910 -0.323223
H 4.140224 1.649864 -1.838015
H 3.040632 2.646109 0.264318
H 1.905914 1.650147 -0.723244
H -1.155258 0.143458 -1.024315
H -1.421334 -1.513071 -0.438110
H -2.862040 -0.615985 1.452985
H -2.580711 1.043365 0.883713
H -0.021863 0.741781 1.157570
H -0.272145 -0.943817 1.734745
H -3.689873 0.469752 -1.324544
H -3.984707 -1.182721 -0.745271
H -5.408962 -0.268934 1.139607
H -5.106435 1.383829 0.568483
H -7.352364 0.553722 -0.253330
H -6.257732 0.841325 -1.636652
H -6.557860 -0.824585 -1.067973


