%chk=000012397.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012397

0 1
 O    9.463600      0.3361000      0.1205000    
 C  -0.6311000      0.3967000     -0.1822000    
 C   0.6595000     -0.4292000     -0.1370000    
 C   -1.935600     -0.4073000     -0.1519000    
 C    1.925400      0.4287000     -7.4400000E-02
 C   -3.190700      0.4688000     -0.1350000    
 C    3.216100     -0.3973000     -3.6899999E-02
 C   -4.461500     -0.3832000     -9.5500000E-02
 C    4.514600      0.4088000      8.5299999E-02
 C   -5.748600      0.4460000     -4.3400001E-02
 C    5.773400     -0.4604000      2.7899999E-02
 C   -7.054800     -0.3527000      2.2500001E-02
 C    7.070000      0.3471000      9.5399998E-02
 C   -8.334100      0.4777000      0.1452000    
 C    8.325300     -0.5146000      7.2200000E-02
 C   -9.591500     -0.3652000      0.2874000    
 H  -0.6203000       1.019600      -1.085600    
 H  -0.6311000       1.088400      0.6699000    
 H   0.7003000      -1.076900      -1.021100    
 H   0.6304000      -1.089600      0.7384000    
 H   -1.933800      -1.052100      0.7357000    
 H   -1.964500      -1.070800      -1.025000    
 H    1.884500       1.066800      0.8168000    
 H    1.954100       1.098300     -0.9427000    
 H   -3.204800       1.109700      -1.024600    
 H   -3.164400       1.129500      0.7398000    
 H    3.263700      -1.007700     -0.9478000    
 H    3.162500      -1.100300      0.8040000    
 H   -4.429200      -1.041800      0.7812000    
 H   -4.491800      -1.033300     -0.9786000    
 H    4.551400       1.146900     -0.7253000    
 H    4.501800      0.9718000       1.026400    
 H   -5.783900       1.100900     -0.9232000    
 H   -5.702000       1.107200      0.8312000    
 H    5.765900      -1.046600     -0.8993000    
 H    5.750900      -1.178500      0.8568000    
 H   -7.125800     -0.9852000     -0.8714000    
 H   -6.998000      -1.035800      0.8796000    
 H    7.076500      0.9624000       1.004300    
 H    7.107000       1.058100     -0.7398000    
 H   -8.432100       1.122400     -0.7361000    
 H   -8.253200       1.139600       1.015500    
 H    8.353100      -1.186400      0.9359000    
 H    8.372600      -1.109400     -0.8454000    
 H   -9.542500     -0.9919000       1.183400    
 H   -9.723900      -1.017600     -0.5814000    
 H   -10.47340      0.2779000      0.3689000    
 H    10.24860     -0.2376000      0.1044000    


%chk=000012397-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000012397

0 1
O 9.530342 0.428997 -0.018663
C -0.626060 0.427114 0.008105
C 0.656867 -0.434297 -0.006282
C -1.925484 -0.409348 0.001591
C 1.956889 0.401182 0.000464
C -3.209150 0.450918 0.015710
C 3.239371 -0.460874 -0.014670
C -4.508155 -0.386149 0.010224
C 4.538303 0.375925 -0.007218
C -5.792325 0.473686 0.025475
C 5.821041 -0.486092 -0.021623
C -7.091098 -0.364024 0.020200
C 7.113305 0.361499 -0.012787
C -8.375632 0.496184 0.035175
C 8.381503 -0.495348 -0.026922
C -9.667674 -0.349404 0.027950
H -0.622167 1.104772 -0.871326
H -0.617110 1.082465 0.904265
H 0.647532 -1.089962 -0.902291
H 0.652576 -1.111721 0.873419
H -1.929126 -1.086544 0.881471
H -1.934124 -1.065397 -0.894141
H 1.966508 1.056144 0.896894
H 1.960984 1.079228 -0.878655
H -3.205985 1.128035 -0.864232
H -3.200350 1.107150 0.911326
H 3.229789 -1.115443 -0.911460
H 3.234917 -1.139015 0.864467
H -4.510787 -1.063476 0.890005
H -4.517450 -1.042131 -0.885544
H 4.543423 1.053370 -0.886441
H 4.547795 1.030713 0.889004
H -5.790069 1.151124 -0.854212
H -5.783329 1.129303 0.921504
H 5.809579 -1.139627 -0.919352
H 5.813242 -1.163927 0.857943
H -7.101495 -1.020188 -0.875440
H -7.095030 -1.040991 0.900250
H 7.135252 1.008963 0.885266
H 7.132037 1.032660 -0.893340
H -8.369805 1.173502 -0.843299
H -8.364573 1.150266 0.931057
H 8.402585 -1.158270 0.866373
H 8.397452 -1.135755 -0.936622
H -9.710720 -1.013508 0.911989
H -9.716386 -0.989432 -0.873395
H -10.571155 0.287839 0.039437
H 10.372548 -0.092116 -0.026649


