%chk=000126639.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126639

0 1
 S  -0.4158000      0.5837000     -0.9787000    
 O    6.597500     -0.4550000     -3.2600001E-02
 O    10.11000      0.1213000     -0.4378000    
 O    8.955900      -1.812600     -9.7000003E-02
 C    1.699700     -0.5789000      0.4075000    
 C    2.929800      0.3163000      0.2346000    
 C   -2.740600       2.067200     -0.8728000    
 C   -3.987300       1.168300      -1.058700    
 C   0.4299000      0.2321000      0.4682000    
 C   -1.621100       1.452100     -0.1270000    
 C    4.215800     -0.5073000      0.2098000    
 C   -4.662700      0.7255000      0.2489000    
 C  -0.1942000      0.7657000       1.574400    
 C   -1.382300       1.472400       1.229400    
 C    5.441000      0.3701000     -4.4000000E-03
 C   -5.888600     -0.1393000      9.2500001E-02
 C   -7.149600      0.4493000     -4.1999999E-03
 C   -5.761500      -1.527600      4.4000000E-02
 C   -8.283300     -0.3502000     -0.1492000    
 C   -6.895400      -2.327000     -0.1011000    
 C    7.781100      0.3112000     -0.2122000    
 C   -8.156200      -1.738300     -0.1976000    
 C    8.977800     -0.5989000     -0.2360000    
 H    1.793200      -1.158100       1.335100    
 H    1.646600      -1.309100     -0.4097000    
 H    2.843900      0.8907000     -0.6963000    
 H    2.978000       1.046500       1.052500    
 H   -3.052900       2.984100     -0.3555000    
 H   -2.402900       2.393700      -1.865200    
 H   -4.716400       1.714600      -1.670700    
 H   -3.706000      0.2782000      -1.636300    
 H    4.327200      -1.066800       1.146900    
 H    4.167900      -1.261300     -0.5860000    
 H   -4.929300       1.615300      0.8345000    
 H   -3.944200      0.1778000      0.8711000    
 H   0.1806000      0.6570000       2.584100    
 H   -2.025700       1.969600       1.944200    
 H    5.528000       1.097900      0.8110000    
 H    5.355300      0.9116000     -0.9538000    
 H   -7.261000       1.529800      2.9999999E-02
 H   -4.784300      -1.997900      0.1157000    
 H   -9.265000      0.1081000     -0.2251000    
 H   -6.796500      -3.407900     -0.1395000    
 H    7.894500       1.013600      0.6203000    
 H    7.730000      0.8455000      -1.166900    
 H   -9.039000      -2.360800     -0.3108000    
 H    10.90780     -0.4491000     -0.4584000    


%chk=000126639-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126639

0 1
S -0.663648 1.038264 -0.167873
O 6.207151 -0.764850 -0.107274
O 9.555303 -1.084197 -1.506891
O 8.487420 -2.371636 0.115723
C 1.560594 0.146631 1.446614
C 2.696006 0.602385 0.489091
C -3.034729 2.687804 -0.200684
C -3.971464 1.567735 -0.734590
C 0.312476 0.985414 1.367042
C -1.853874 2.187358 0.591227
C 3.949777 -0.290865 0.617791
C -4.635061 0.738641 0.398029
C -0.271468 1.794146 2.328134
C -1.478890 2.462883 1.896101
C 5.076719 0.155738 -0.315942
C -5.497362 -0.390253 -0.146408
C -6.900661 -0.239856 -0.290636
C -4.904706 -1.612180 -0.561475
C -7.691663 -1.277392 -0.835877
C -5.690110 -2.652339 -1.106185
C 7.337089 -0.433199 -0.949366
C -7.088422 -2.488288 -1.246862
C 8.464416 -1.418183 -0.679590
H 1.930620 0.184696 2.489886
H 1.328474 -0.917520 1.236184
H 2.321733 0.580055 -0.554309
H 2.950264 1.657921 0.710283
H -3.614250 3.369839 0.452580
H -2.687699 3.295374 -1.060983
H -4.758356 2.026106 -1.365000
H -3.395599 0.888591 -1.393750
H 4.327054 -0.275074 1.658367
H 3.695504 -1.343029 0.386032
H -5.245335 1.417935 1.025532
H -3.835183 0.333029 1.046719
H 0.152992 1.905639 3.329804
H -2.058202 3.132570 2.537823
H 5.390830 1.199720 -0.087620
H 4.748425 0.118306 -1.379730
H -7.376712 0.695155 0.031408
H -3.821358 -1.748034 -0.449136
H -8.775081 -1.143494 -0.935793
H -5.215232 -3.590387 -1.416406
H 7.718924 0.593853 -0.752786
H 7.082152 -0.484461 -2.031726
H -7.699550 -3.295182 -1.666900
H 10.300391 -1.722270 -1.339381


