%chk=000088528.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088528

0 1
 S    5.597900     -0.4588000      0.1886000    
 O    5.629300      -1.602300     -0.7772000    
 O    8.460400      1.8300001E-02   1.113300    
 C   -2.257300     -0.2514000      0.2066000    
 C  -0.9718000      0.5159000     -0.1159000    
 C   -3.531700      0.5135000     -0.1613000    
 C   0.3020000     -0.2775000      0.1838000    
 C   -4.779600     -0.3291000      0.1162000    
 C    1.554300      0.5472000     -0.1264000    
 C   -6.088600      0.3945000     -0.2128000    
 C    2.829600     -0.2375000      0.2003000    
 C   -7.337500     -0.4191000      0.1333000    
 C    4.103200      0.5108000     -0.1763000    
 C   -8.612300      0.3777000     -0.1477000    
 C   -9.856400     -0.4106000      0.2299000    
 C    6.762600      0.7914000     -0.4027000    
 C    8.196000      0.3171000     -0.2516000    
 H   -2.273500     -0.4929000       1.276600    
 H   -2.243800      -1.206700     -0.3331000    
 H  -0.9627000       1.450900      0.4578000    
 H  -0.9780000      0.7959000      -1.176700    
 H   -3.505000      0.7868000      -1.222800    
 H   -3.578100       1.446300      0.4131000    
 H   0.3083000      -1.199200     -0.4103000    
 H   0.3077000     -0.5724000       1.240000    
 H   -4.788300     -0.6180000       1.174700    
 H   -4.729300      -1.258300     -0.4648000    
 H    1.556000      0.8246000      -1.187400    
 H    1.541300       1.478300      0.4527000    
 H   -6.115200       1.344200      0.3362000    
 H   -6.102300      0.6463000      -1.280500    
 H    2.845200     -0.4746000       1.271800    
 H    2.803800      -1.198900     -0.3288000    
 H   -7.343300      -1.348500     -0.4485000    
 H   -7.307400     -0.7007000       1.192900    
 H    4.164600       1.448600      0.3856000    
 H    4.102200      0.7469000      -1.245700    
 H   -8.598300       1.316200      0.4186000    
 H   -8.659900      0.6405000      -1.210800    
 H   -9.918000      -1.342800     -0.3406000    
 H   -9.855000     -0.6592000       1.296000    
 H   -10.75570      0.1767000      1.9300001E-02
 H    6.545400       1.020900      -1.450200    
 H    6.605600       1.691400      0.2008000    
 H    8.379500     -0.5855000     -0.8440000    
 H    8.889700       1.098200     -0.5779000    
 H    9.385700     -0.2759000       1.166600    


%chk=000088528-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000088528

0 1
S 5.847309 -0.014823 1.135674
O 5.594941 -1.551449 0.451257
O 7.577439 -1.240411 -1.345613
C -2.094240 -0.153906 0.431511
C -0.817818 0.639530 0.071944
C -3.383908 0.463780 -0.154081
C 0.469128 0.023782 0.665049
C -4.659793 -0.332453 0.200994
C 1.745824 0.814740 0.298688
C -5.950685 0.287240 -0.380176
C 3.022912 0.182896 0.905591
C -7.226244 -0.511216 -0.028656
C 4.281214 0.965782 0.525560
C -8.517496 0.110032 -0.608515
C -9.786228 -0.696424 -0.256137
C 7.149279 0.823328 -0.062170
C 7.100798 0.130087 -1.434893
H -2.187500 -0.217254 1.536034
H -1.990567 -1.197915 0.068733
H -0.924113 1.685224 0.429940
H -0.722468 0.697022 -1.032684
H -3.289869 0.530385 -1.258407
H -3.489758 1.506848 0.211688
H 0.574303 -1.022263 0.310737
H 0.374471 -0.029416 1.769672
H -4.752375 -0.402668 1.305229
H -4.555620 -1.374417 -0.167950
H 1.844884 0.856367 -0.805856
H 1.639756 1.863547 0.646178
H -6.056653 1.328416 -0.008967
H -5.857370 0.359876 -1.484261
H 2.921606 0.134454 2.008238
H 3.136864 -0.857312 0.543068
H -7.122665 -1.551951 -0.401516
H -7.320680 -0.585720 1.075199
H 4.354271 1.956878 1.007472
H 4.398225 1.055226 -0.568818
H -8.621750 1.148834 -0.233426
H -8.420882 0.186647 -1.710988
H -9.719973 -1.729419 -0.647246
H -9.921895 -0.762331 0.840102
H -10.694700 -0.231591 -0.681720
H 6.893252 1.898040 -0.082636
H 8.120641 0.658485 0.430280
H 6.072925 0.181943 -1.858813
H 7.780162 0.660029 -2.127521
H 6.906342 -1.707282 -0.747087


