%chk=000008181.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008181

0 1
 O   -8.946500      0.6575000      0.2393000    
 O   -7.887400      -1.383700      3.9200000E-02
 C    2.338800     -0.4352000     -0.1536000    
 C    1.094100      0.4521000     -0.2239000    
 C    3.618500      0.4035000     -0.1310000    
 C  -0.2229000     -0.3326000     -0.2119000    
 C    4.860700     -0.4842000     -2.4700001E-02
 C   -1.502900      0.5087000     -0.2505000    
 C    6.141800      0.3525000     -2.9899999E-02
 C   -2.784700     -0.3244000     -0.1772000    
 C    7.420500     -0.4886000      4.3299999E-02
 C   -4.023600      0.5727000     -0.1382000    
 C    8.697500      0.3529000      0.1159000    
 C   -5.344400     -0.2012000     -4.4199999E-02
 C    9.973900     -0.4898000      0.1863000    
 C   -6.599300      0.6632000      6.6000000E-02
 C    11.24600      0.3374000      0.2895000    
 C   -7.863500     -0.1617000      0.1097000    
 C   -10.21670      1.1000000E-03  0.2958000    
 H    2.354700      -1.113200      -1.015300    
 H    2.291400      -1.058200      0.7478000    
 H    1.134700       1.064100      -1.133400    
 H    1.097300       1.147400      0.6248000    
 H    3.590600       1.096900      0.7183000    
 H    3.674800       1.010200      -1.042900    
 H  -0.2298000      -1.021200      -1.066400    
 H  -0.2447000     -0.9591000      0.6890000    
 H    4.814100      -1.078200      0.8959000    
 H    4.882600      -1.189300     -0.8644000    
 H   -1.509200       1.108400      -1.169000    
 H   -1.482900       1.215600      0.5882000    
 H    6.172300      0.9671000     -0.9381000    
 H    6.120100       1.045600      0.8204000    
 H   -2.839200     -0.9946000      -1.043200    
 H   -2.762500     -0.9547000      0.7198000    
 H    7.371500      -1.139900      0.9248000    
 H    7.468800      -1.145900     -0.8336000    
 H   -4.044900       1.203500      -1.035400    
 H   -3.951000       1.249700      0.7221000    
 H    8.747700       1.009200     -0.7616000    
 H    8.648400       1.004900      0.9967000    
 H   -5.299400     -0.8720000      0.8238000    
 H   -5.430400     -0.8516000     -0.9245000    
 H    10.03680      -1.127000     -0.7038000    
 H    9.918500      -1.159600       1.052800    
 H   -6.659100       1.333200     -0.7986000    
 H   -6.548600       1.265100      0.9800000    
 H    11.23530      0.9585000       1.190600    
 H    11.35520      0.9943000     -0.5793000    
 H    12.12250     -0.3164000      0.3356000    
 H   -10.99080      0.7662000      0.3992000    
 H   -10.26130     -0.6632000       1.164100    
 H   -10.39560     -0.5574000     -0.6280000    


%chk=000008181-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000008181

0 1
O -9.059007 0.685215 -0.022119
O -8.074562 -1.425360 -0.038786
C 2.338192 -0.401450 0.004925
C 1.061228 0.468688 -0.011249
C 3.643375 0.425912 -0.001272
C -0.244556 -0.357799 -0.004237
C 4.920976 -0.443275 0.015132
C -1.520517 0.513795 -0.021039
C 6.225749 0.384841 0.008550
C -2.826427 -0.312094 -0.011042
C 7.503868 -0.483854 0.025756
C -4.101086 0.561115 -0.029789
C 8.808519 0.344519 0.017860
C -5.401834 -0.271278 -0.016261
C 10.086886 -0.524653 0.036146
C -6.660678 0.616666 -0.036022
C 11.384898 0.311730 0.026966
C -7.955119 -0.179276 -0.032204
C -10.387763 0.027491 -0.021525
H 2.330362 -1.079746 -0.874018
H 2.323957 -1.056185 0.901514
H 1.075515 1.123117 -0.908082
H 1.069628 1.147201 0.867580
H 3.650882 1.104345 0.877641
H 3.657492 1.080662 -0.897888
H -0.253036 -1.036777 -0.882543
H -0.259246 -1.011552 0.892965
H 4.907260 -1.097796 0.911910
H 4.913611 -1.121869 -0.863616
H -1.506055 1.166317 -0.919286
H -1.510266 1.193985 0.856500
H 6.239696 1.038948 -0.888518
H 6.232811 1.063877 0.886975
H -2.836303 -0.993487 -0.887203
H -2.841540 -0.963143 0.887870
H 7.490545 -1.137217 0.923427
H 7.496561 -1.163554 -0.852186
H -4.084867 1.210346 -0.930595
H -4.087852 1.243942 0.845842
H 8.823719 0.997432 -0.880114
H 8.817107 1.024699 0.895439
H -5.423314 -0.920022 0.880443
H -5.420667 -0.954751 -0.886639
H 10.076876 -1.204616 -0.840237
H 10.070849 -1.175901 0.934019
H -6.666797 1.272883 -0.928884
H -6.677182 1.301612 0.834380
H 11.431884 0.978806 0.908560
H 11.439160 0.947986 -0.876721
H 12.283789 -0.331917 0.041742
H -11.110810 0.855102 -0.017411
H -10.502149 -0.605234 0.874906
H -10.505962 -0.599822 -0.921261


