%chk=000088167.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088167

0 1
 S  -0.4501000       2.259400       1.162200    
 S   0.3997000       2.611400     -0.6781000    
 O   -3.237800       3.332900      0.4992000    
 O   0.3159000      0.4824000      -2.874300    
 C   -2.860700      -2.290900      0.2016000    
 C    4.375100     -0.3859000      0.9500000    
 C   -2.953400     -0.7583000      0.2860000    
 C    3.299200     -0.1482000     -5.5100001E-02
 C   -3.208800      -2.754200      -1.229600    
 C   -3.854800      -2.927300       1.197200    
 C   -1.459500      -2.851900      0.5346000    
 C    5.784000     -0.3918000      0.2799000    
 C    4.188400      -1.760300       1.664700    
 C    4.465400      0.6718000       2.099700    
 C   -1.827200     -5.5799998E-02  0.6348000    
 C    2.459700      0.9586000      6.9899999E-02
 C   -4.158300     -0.1630000      8.8000000E-03
 C    3.132500      -1.033500      -1.120100    
 C   -1.911700       1.334400      0.7115000    
 C    1.451300       1.183500     -0.8699000    
 C   -4.242700       1.227200      8.5500002E-02
 C    2.126200     -0.8116000      -2.060200    
 C   -3.119500       1.975800      0.4370000    
 C    1.286700      0.2952000      -1.935300    
 H   -2.542500      -2.290600      -1.967000    
 H   -4.237100      -2.503900      -1.512000    
 H   -3.107900      -3.841600      -1.327600    
 H   -4.896300      -2.681100      0.9635000    
 H   -3.777000      -4.020900       1.187400    
 H   -3.658200      -2.589100       2.221500    
 H   -1.152000      -2.609100       1.558600    
 H  -0.6942000      -2.485900     -0.1603000    
 H   -1.451400      -3.946500      0.4583000    
 H    6.577800     -0.5377000       1.021700    
 H    5.881900      -1.193900     -0.4599000    
 H    5.974200      0.5576000     -0.2346000    
 H    4.244900      -2.598200      0.9613000    
 H    4.961800      -1.923300       2.424200    
 H    3.212400      -1.810900       2.161600    
 H    5.276000      0.4277000       2.797200    
 H    4.672700       1.674800       1.708600    
 H    3.539900      0.7086000       2.686100    
 H  -0.8750000     -0.5222000      0.8561000    
 H    2.577900       1.670200      0.8803000    
 H   -5.044400     -0.7245000     -0.2666000    
 H    3.771800      -1.903200      -1.241500    
 H   -5.190400       1.712700     -0.1320000    
 H    2.008600      -1.510200      -2.884500    
 H   -4.149800       3.585700      0.2749000    
 H   0.3579000     -0.2377000      -3.526700    


%chk=000088167-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088167

0 1
S -0.803829 2.650733 1.546102
S 0.565783 3.150167 -0.298885
O -3.295546 3.430905 -0.051372
O -0.285254 1.048508 -2.333272
C -2.508085 -2.316648 0.362024
C 4.293617 -0.598220 0.854603
C -2.716769 -0.786320 0.273713
C 3.074952 -0.143151 0.018780
C -2.318052 -2.892027 -1.074311
C -3.757314 -2.977373 1.018593
C -1.259615 -2.690941 1.201757
C 5.501691 -0.860518 -0.094508
C 3.937736 -1.913882 1.611147
C 4.716905 0.465096 1.900271
C -1.827840 0.143513 0.862717
C 2.442300 1.108708 0.196392
C -3.828053 -0.254219 -0.436543
C 2.542181 -0.999208 -0.986297
C -2.016991 1.545072 0.761075
C 1.324453 1.514753 -0.577162
C -4.041652 1.133525 -0.548848
C 1.435898 -0.622658 -1.769068
C -3.135221 2.047051 0.043817
C 0.812407 0.636367 -1.570184
H -1.411663 -2.466890 -1.545223
H -3.182879 -2.663706 -1.723276
H -2.202266 -3.991700 -1.036143
H -4.678031 -2.779444 0.440463
H -3.624428 -4.074205 1.077338
H -3.911086 -2.591122 2.042620
H -1.344410 -2.329774 2.243289
H -0.332061 -2.277016 0.763926
H -1.153566 -3.790873 1.235993
H 6.378420 -1.202665 0.486963
H 5.270172 -1.637178 -0.845686
H 5.782784 0.061352 -0.635620
H 3.662068 -2.725041 0.913129
H 4.804547 -2.259670 2.205109
H 3.087322 -1.753799 2.299015
H 5.588625 0.096195 2.471140
H 5.009799 1.417350 1.420859
H 3.907297 0.675246 2.623433
H -0.948455 -0.198350 1.414564
H 2.799427 1.810733 0.954523
H -4.549402 -0.930618 -0.910374
H 2.997924 -1.979656 -1.166889
H -4.913676 1.509638 -1.100639
H 1.054355 -1.303334 -2.542416
H -4.073755 3.654809 -0.620927
H -0.589564 0.317183 -2.927112


