%chk=000038851.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038851

0 1
 S   -1.483600       3.356000      0.3351000    
 O   -3.072100     -0.6633000     -0.9921000    
 O   -4.079200      -1.580200      0.8653000    
 O  -2.6799999E-02   3.483000     -0.3878000    
 O   -1.290600       2.879300       1.692700    
 O   -2.248900       4.557700      5.4900002E-02
 C   -2.135200      -2.668000     -0.1373000    
 C  -0.7425000      -2.059700     -0.1108000    
 C   -3.444700       1.532900     -0.1160000    
 C   -4.004900      0.4081000     -0.9735000    
 C   -3.218700      -1.605300     -5.4000001E-03
 C   -2.115600       2.036400     -0.6511000    
 C   -2.312400      -3.757000      0.9246000    
 C   6.0100000E-02  -2.177600      -1.228100    
 C  -0.3195000      -1.406800       1.029900    
 C    1.787600     -0.9551000     -6.2500000E-02
 C    1.338200      -1.619500      -1.203600    
 C   0.9586000     -0.8487000       1.054300    
 C    3.113300     -0.3764000     -3.7200000E-02
 C    4.197800      -1.135500      0.4024000    
 C    3.307200      0.9404000     -0.4541000    
 C    5.476200     -0.5779000      0.4246000    
 C    4.585500       1.498100     -0.4317000    
 C    5.670100      0.7390000      7.6000001E-03
 H   -2.309500      -3.149700      -1.109600    
 H   -3.310600       1.180000      0.9135000    
 H   -4.170100       2.353900     -7.9700001E-02
 H   -4.139400      0.7476000      -2.006300    
 H   -4.990000      8.8200003E-02 -0.6145000    
 H   -1.363900       1.241000     -0.6371000    
 H   -2.217000       2.408600      -1.675500    
 H   -2.247800      -3.357100       1.942700    
 H   -1.547400      -4.534300      0.8198000    
 H   -3.293600      -4.235000      0.8268000    
 H  -0.2794000      -2.692000      -2.121900    
 H  -0.9562000      -1.309400       1.903900    
 H    1.971500      -1.711300      -2.083000    
 H    1.292100     -0.3318000       1.951000    
 H    4.064500      -2.163700      0.7306000    
 H    2.474400       1.544500     -0.8046000    
 H    6.320700      -1.168900      0.7665000    
 H    4.736700       2.523000     -0.7576000    
 H    6.665500       1.173100      2.4700001E-02
 H   0.6104000       2.759600     -0.1819000    


%chk=000038851-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038851

0 1
S -0.610744 2.767286 0.345121
O -3.460823 -0.701098 -0.924788
O -3.900883 -1.549823 1.205602
O 0.769409 2.539563 -0.881807
O -0.219415 2.022412 1.731650
O -1.063553 4.316948 0.377110
C -2.359656 -2.760029 -0.336111
C -0.945689 -2.161447 -0.248144
C -3.143856 1.506678 0.179229
C -4.131911 0.576385 -0.555687
C -3.332953 -1.657984 0.097582
C -1.885267 1.733727 -0.661116
C -2.544346 -4.033115 0.517564
C -0.148266 -2.006410 -1.408541
C -0.434941 -1.692426 0.989323
C 1.619738 -0.885077 -0.106496
C 1.115795 -1.384677 -1.338278
C 0.822160 -1.060893 1.057508
C 2.918740 -0.156315 -0.040321
C 3.758437 -0.251043 1.103821
C 3.343259 0.673528 -1.118080
C 4.978447 0.455135 1.169763
C 4.565038 1.379331 -1.052473
C 5.388880 1.274917 0.092446
H -2.570939 -2.982315 -1.398177
H -2.880464 1.053427 1.152047
H -3.657488 2.465598 0.381895
H -4.463159 0.992315 -1.520433
H -4.999971 0.362442 0.091797
H -1.336624 0.809633 -0.893326
H -2.036964 2.349676 -1.561781
H -2.392089 -3.816774 1.588060
H -1.816472 -4.802452 0.207748
H -3.563394 -4.442198 0.400948
H -0.521128 -2.369216 -2.373733
H -1.039479 -1.781232 1.899597
H 1.721437 -1.293542 -2.246783
H 1.157213 -0.644140 2.012516
H 3.464547 -0.900143 1.936272
H 2.706273 0.779398 -2.003558
H 5.611640 0.361484 2.058999
H 4.867732 2.017191 -1.890474
H 6.335097 1.824228 0.144740
H 1.627431 2.437246 -0.373231


