%chk=000137251.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137251

0 1
 S    3.299500      1.2200000E-02  -1.189500    
 O  -0.7694000      -2.519000     -0.1453000    
 O   -2.008400      -1.578600       1.560000    
 C  -0.8476000       3.475900      0.4650000    
 C   -1.351300       3.038000     -0.9130000    
 C   0.2850000       2.646200       1.072900    
 C   -1.796900       1.578600      -1.047900    
 C    1.510700       2.501400      0.1684000    
 C   -2.860600       1.157300     -3.3000000E-02
 C    2.659100       1.818700      0.9203000    
 C   -3.584800     -0.1459000     -0.3997000    
 C    3.781700       1.297800      2.0900000E-02
 C   -2.688700      -1.330600     -0.7599000    
 C    2.075400      -2.435100     -0.8524000    
 C    2.485800      -1.183200     -8.0200002E-02
 C    1.430500      -3.502600      4.4199999E-02
 C   0.1839000      -3.036900      0.7953000    
 C   -1.803900      -1.794200      0.3738000    
 H  -0.5129000       4.518300      0.3867000    
 H   -1.687500       3.484000       1.170600    
 H  -0.5735000       3.233300      -1.661400    
 H   -2.194400       3.686000      -1.185500    
 H   0.5841000       3.120400       2.016200    
 H  -8.8699996E-02   1.649400       1.335300    
 H  -0.9255000      0.9203000     -0.9608000    
 H   -2.189500       1.443600      -2.063500    
 H    1.232500       1.925000     -0.7178000    
 H    1.842600       3.486400     -0.1805000    
 H   -3.616300       1.947400      5.7599999E-02
 H   -2.403500       1.052000      0.9570000    
 H    3.091600       2.547300       1.618600    
 H    2.278300       1.007100       1.550100    
 H   -4.240700      5.4099999E-02  -1.256500    
 H   -4.242700     -0.4221000      0.4337000    
 H    4.213800       2.130400     -0.5446000    
 H    4.584000      0.8846000      0.6416000    
 H   -2.064100      -1.076100      -1.623000    
 H   -3.318000      -2.181100      -1.046700    
 H    2.955000      -2.883700      -1.331700    
 H    1.377700      -2.169400      -1.656700    
 H    1.596200     -0.7077000      0.3391000    
 H    3.171300      -1.445100      0.7319000    
 H    1.156800      -4.349200     -0.5979000    
 H    2.167500      -3.872400      0.7665000    
 H  -0.2691000      -3.888200       1.315400    
 H   0.4437000      -2.274400       1.537800    


%chk=000137251-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000137251

0 1
S 3.299367 0.041322 -1.189115
O -0.808659 -2.596580 -0.129636
O -1.834223 -1.389095 1.583736
C -0.903125 3.537593 0.419500
C -1.373299 3.070609 -0.983667
C 0.226487 2.696013 1.063109
C -1.829547 1.591892 -1.082756
C 1.512497 2.575901 0.213281
C -2.918315 1.193636 -0.057352
C 2.643734 1.853101 0.979681
C -3.655806 -0.129256 -0.390016
C 3.802437 1.347896 0.098479
C -2.746830 -1.331633 -0.729676
C 2.065460 -2.465342 -0.876026
C 2.740435 -1.362238 -0.040479
C 1.416610 -3.577349 -0.012565
C 0.221132 -3.104907 0.823439
C -1.790426 -1.735462 0.380687
H -0.564228 4.591337 0.337086
H -1.770225 3.547008 1.109900
H -0.560854 3.239027 -1.718813
H -2.214481 3.723066 -1.297817
H 0.480510 3.143487 2.046907
H -0.148798 1.674924 1.282261
H -0.948488 0.928720 -0.964770
H -2.210257 1.416852 -2.111519
H 1.299290 2.011677 -0.715121
H 1.856186 3.584618 -0.097487
H -3.677103 2.001051 -0.000603
H -2.470837 1.111269 0.950308
H 3.067939 2.535261 1.746620
H 2.213051 1.002158 1.545215
H -4.317408 0.034121 -1.264688
H -4.309300 -0.398080 0.461802
H 4.229000 2.164120 -0.512323
H 4.613443 0.913663 0.710164
H -2.151398 -1.145564 -1.641355
H -3.370699 -2.219308 -0.959021
H 2.813954 -2.922680 -1.550736
H 1.285483 -2.015282 -1.517821
H 2.034197 -0.929880 0.687796
H 3.624101 -1.747367 0.500092
H 1.083264 -4.396958 -0.677052
H 2.165083 -4.011065 0.682023
H -0.227004 -3.935858 1.398725
H 0.476347 -2.296219 1.531005


