%chk=000094687.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094687

0 1
 S   -6.053000       1.205200       1.192400    
 O   -4.085400      -1.485300      -1.706900    
 C    4.585400      0.9311000     -0.4667000    
 C    5.683600      0.2582000      0.3637000    
 C    3.169400      0.8630000      0.1190000    
 C    7.056200      0.2737000     -0.3129000    
 C    2.062000       1.476700     -0.7435000    
 C    8.129400     -0.4705000      0.4904000    
 C   0.6615000       1.327100     -0.1399000    
 C    9.507200     -0.4366000     -0.1790000    
 C  -0.4290000       1.961100      -1.013000    
 C    10.57300      -1.228900      0.5836000    
 C   -1.823900       1.749800     -0.4765000    
 C    11.95330      -1.170400     -7.1599998E-02
 C   -2.558000      0.6286000     -0.8608000    
 C   -3.857400      0.4173000     -0.3666000    
 C   -2.379400       2.670400      0.4023000    
 C   -4.420300       1.341500      0.5172000    
 C    12.97890      -1.961300      0.7261000    
 C   -3.668800       2.468000      0.8941000    
 C   -4.577700     -0.7972000     -0.8167000    
 C   -5.867900      -1.213200     -0.2181000    
 C   -6.577000     -0.4069000      0.6761000    
 C   -6.381100      -2.471800     -0.5783000    
 C   -7.794600     -0.8767000       1.197900    
 C   -7.589400      -2.925400     -5.0799999E-02
 C   -8.296900      -2.127400      0.8385000    
 H    4.567600      0.4690000      -1.462100    
 H    4.852300       1.984100     -0.6204000    
 H    5.392500     -0.7816000      0.5577000    
 H    5.751800      0.7544000       1.339400    
 H    2.923100     -0.1901000      0.3055000    
 H    3.171500       1.357600       1.098500    
 H    7.371100       1.313400     -0.4643000    
 H    6.974700     -0.1818000      -1.307500    
 H    2.078000       1.004300      -1.733400    
 H    2.279000       2.540900     -0.8973000    
 H    7.818500      -1.513800      0.6244000    
 H    8.204200     -2.9400000E-02   1.491900    
 H   0.4450000      0.2607000      2.0999999E-03
 H   0.6437000       1.784200      0.8575000    
 H    9.423700     -0.8385000      -1.196300    
 H    9.832700      0.6065000     -0.2764000    
 H  -0.2394000       3.037300      -1.117400    
 H  -0.3717000       1.553400      -2.030800    
 H    10.25290      -2.275300      0.6634000    
 H    10.64220     -0.8403000       1.607300    
 H    12.28280     -0.1281000     -0.1507000    
 H    11.89800      -1.572300      -1.089800    
 H   -2.103200     -8.3999999E-02  -1.545700    
 H   -1.821700       3.549400      0.7140000    
 H    13.07940      -1.562600       1.740600    
 H    12.69240      -3.015400      0.7975000    
 H    13.95870      -1.907700      0.2415000    
 H   -4.079900       3.207700       1.578900    
 H   -5.850000      -3.121500      -1.269700    
 H   -8.372400     -0.2714000       1.894200    
 H   -7.975200      -3.899800     -0.3348000    
 H   -9.239100      -2.474300       1.252100    


%chk=000094687-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094687

0 1
S -5.947464 1.093487 1.687349
O -4.408236 -1.476934 -1.768817
C 4.615649 0.600009 -0.628288
C 5.747905 -0.003059 0.233263
C 3.219761 0.481879 0.024505
C 7.141249 0.101720 -0.426777
C 2.095483 1.120428 -0.821749
C 8.278683 -0.472909 0.447435
C 0.696945 0.979180 -0.181677
C 9.670814 -0.375500 -0.216494
C -0.418691 1.658081 -1.025344
C 10.811685 -0.930522 0.665966
C -1.797580 1.507227 -0.404737
C 12.203135 -0.837557 -0.001000
C -2.695167 0.516397 -0.839683
C -3.977754 0.329543 -0.247387
C -2.207708 2.349647 0.669680
C -4.352874 1.186446 0.822446
C 13.338087 -1.384097 0.892103
C -3.464648 2.195001 1.276163
C -4.836591 -0.757088 -0.804593
C -6.197066 -1.006444 -0.239328
C -6.780269 -0.274426 0.831673
C -6.961251 -2.058927 -0.824774
C -8.083342 -0.586238 1.300042
C -8.249001 -2.372235 -0.367637
C -8.813137 -1.629287 0.703170
H 4.600178 0.097534 -1.618121
H 4.837852 1.669658 -0.826779
H 5.521353 -1.069446 0.443318
H 5.770209 0.509050 1.218178
H 2.986045 -0.589205 0.198251
H 3.242008 0.961215 1.025655
H 7.358700 1.166278 -0.655725
H 7.125010 -0.428051 -1.402348
H 2.084854 0.655297 -1.829700
H 2.321236 2.196383 -0.978714
H 8.059036 -1.535352 0.683571
H 8.298808 0.062858 1.419744
H 0.450827 -0.093881 -0.052963
H 0.706940 1.421205 0.835606
H 9.655020 -0.923028 -1.182301
H 9.884283 0.685470 -0.465156
H -0.168383 2.732071 -1.139001
H -0.412975 1.218025 -2.040924
H 10.598464 -1.990379 0.919361
H 10.831555 -0.379528 1.629791
H 12.412292 0.220569 -0.260476
H 12.184729 -1.394286 -0.960271
H -2.437891 -0.157842 -1.664463
H -1.533774 3.138001 1.026527
H 13.399602 -0.821097 1.842716
H 13.166210 -2.447762 1.144170
H 14.321070 -1.310150 0.391268
H -3.764051 2.855655 2.097432
H -6.491216 -2.607341 -1.647485
H -8.517766 -0.012389 2.126112
H -8.817165 -3.184324 -0.832525
H -9.818374 -1.863936 1.069644


