%chk=000061389.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061389

0 1
 S   -2.538400      -3.226200     -4.6100002E-02
 S   -4.096700       1.887300      2.1100000E-02
 S    4.710300      -1.018300      2.3000000E-02
 O    3.007500       3.729400      8.3400004E-02
 O   -2.147500      -3.802500       1.429900    
 O   -4.068600       2.591000      -1.451000    
 O    4.697000      -1.678900      -1.469300    
 O   -3.986800      -3.250100     -0.1485000    
 O   -1.705600      -3.889700      -1.032300    
 O   -5.313700       1.098900      9.9200003E-02
 O   -3.791600       2.897100       1.017800    
 O    5.926800     -0.2334000      0.1364000    
 O    4.395300      -2.057100      0.9865000    
 C  -0.3707000      0.2281000      1.5300000E-02
 C   0.9848000      0.6410000      2.8500000E-02
 C  -0.6899000      -1.149600     -6.6999998E-03
 C   -1.403800       1.193900      2.4400000E-02
 C    2.017900     -0.3248000      1.9400001E-02
 C    1.303900       2.018700      5.0299998E-02
 C   -2.036200      -1.542300     -1.9400001E-02
 C   -2.740500      0.7693000      1.1400000E-02
 C    3.354600      9.9699996E-02  3.2600001E-02
 C   0.3471000      -2.092200     -1.5300000E-02
 C   -1.068700       2.554400      4.6100002E-02
 C    1.682700      -1.685300     -2.3000001E-03
 C   -3.053100     -0.5889000     -1.0100000E-02
 C   0.2670000       2.961300      5.8699999E-02
 C    2.650200       2.411300      6.2899999E-02
 C    3.667100       1.458000      5.4000001E-02
 H   0.1888000      -3.163000      7.4999998E-03
 H   -1.796300       3.355400      7.7000000E-03
 H    2.411000      -2.485300     -4.9899999E-02
 H   -4.090000     -0.9048000     -1.9800000E-02
 H   0.4522000       4.031500      8.0700003E-02
 H    4.694500       1.811000      6.1000001E-02
 H    2.324800       4.271600     -0.3412000    
 H   -2.600500      -3.365400       2.188900    
 H   -4.188500       1.979500      -2.215200    
 H    4.824700      -1.045400      -2.214100    


%chk=000061389-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000061389

0 1
S -2.622437 -3.311162 -0.005950
S -4.249252 1.929516 -0.006743
S 4.874877 -0.954434 0.030842
O 3.098640 3.832521 0.002648
O -2.106546 -3.631499 1.747276
O -4.025853 2.461946 -1.772692
O 4.647075 -1.514580 -1.722425
O -4.232535 -3.338522 -0.126131
O -1.728313 -4.252950 -0.971534
O -5.595881 1.051410 0.140119
O -4.028528 3.230550 0.932287
O 6.213915 -0.060392 0.155909
O 4.673871 -2.235912 0.998498
C -0.377592 0.260326 0.001314
C 0.997700 0.688876 0.007555
C -0.687971 -1.158021 0.000885
C -1.439005 1.248219 -0.002825
C 2.051725 -0.301638 0.013930
C 1.308315 2.098176 0.000260
C -2.063461 -1.511749 -0.003303
C -2.773202 0.763706 -0.002723
C 3.379724 0.201437 0.017060
C 0.389622 -2.114038 0.007294
C -1.095488 2.649604 -0.007477
C 1.708122 -1.700304 0.017244
C -3.114213 -0.591751 -0.004595
C 0.226607 3.048143 -0.008370
C 2.678792 2.507865 0.004575
C 3.717439 1.553403 0.006098
H 0.157159 -3.180952 -0.004678
H -1.893233 3.395528 0.002880
H 2.507217 -2.445236 0.036316
H -4.161175 -0.920253 -0.005026
H 0.430674 4.126419 -0.014034
H 4.760676 1.882961 0.006638
H 2.348947 4.477636 0.006237
H -2.331066 -4.582935 1.966312
H -4.789228 3.065722 -2.010077
H 5.364983 -2.182435 -1.928096


