%chk=000178046.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178046

0 1
 S  -0.1435000       1.069200       1.348900    
 O    2.192700     -0.9628000      0.3897000    
 O  -0.4529000       2.453200       1.647100    
 O   0.3500000      0.1819000       2.383300    
 O   0.5800000     -0.9575000      -1.264400    
 C    1.023400       1.033700      2.1800000E-02
 C    2.346100       1.681000      0.4178000    
 C   0.5614000       1.880200      -1.161300    
 C    2.993400       2.053000     -0.9113000    
 C    1.842000       2.300000      -1.883900    
 C    1.216400     -0.4019000     -0.3792000    
 C   -1.594300      0.3475000      0.6483000    
 C   -1.779600      -1.022400      0.7354000    
 C   -2.522200       1.163200      2.2200000E-02
 C    2.480300      -2.336900      0.1125000    
 C   -2.925400      -1.592700      0.1808000    
 C   -3.668000      0.5929000     -0.5323000    
 C   -3.869600     -0.7850000     -0.4530000    
 C    2.904400      -2.476200      -1.341700    
 C    3.559500      -2.825200       1.066700    
 C   -5.094200      -1.395200      -1.047300    
 H    3.014600       1.079500       1.040400    
 H    2.163800       2.605700      0.9818000    
 H   4.6500001E-02   2.790700     -0.8320000    
 H  -0.1188000       1.365700      -1.848000    
 H    3.612100       1.223800      -1.274700    
 H    3.642800       2.928700     -0.8155000    
 H    1.791400       3.352300      -2.183200    
 H    1.986500       1.708800      -2.795100    
 H   -1.056700      -1.669100       1.223100    
 H   -2.383800       2.237200     -5.4000001E-02
 H    1.575500      -2.930300      0.2957000    
 H   -3.069900      -2.667900      0.2466000    
 H   -4.395100       1.232200      -1.026200    
 H    3.428300      -3.425400      -1.501100    
 H    2.061800      -2.486100      -2.037200    
 H    3.573200      -1.662200      -1.643000    
 H    3.786600      -3.883700      0.9077000    
 H    3.239300      -2.688300       2.105200    
 H    4.480400      -2.244700      0.9430000    
 H   -5.938100     -0.6977000      -1.016300    
 H   -4.907200      -1.673600      -2.089200    
 H   -5.398100      -2.290100     -0.4938000    


%chk=000178046-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178046

0 1
S 0.094122 0.012461 1.016235
O 3.002660 -1.161364 0.097993
O 0.259322 1.322573 1.996248
O 0.375834 -1.496760 1.596283
O 1.602007 -1.839980 -1.650527
C 1.407272 0.409680 -0.707578
C 2.259769 1.593290 -0.242825
C 0.515654 0.871267 -1.865179
C 1.966612 2.725355 -1.270486
C 0.530492 2.415931 -1.768128
C 2.003208 -0.968651 -0.835676
C -1.695740 0.024816 0.413835
C -2.244945 -1.179545 -0.058615
C -2.428478 1.218390 0.513435
C 3.500400 -2.576255 0.305980
C -3.597732 -1.171893 -0.462240
C -3.781356 1.198135 0.106659
C -4.382639 0.010680 -0.388119
C 4.736516 -2.785951 -0.577469
C 3.752077 -2.689078 1.810285
C -5.844151 -0.007846 -0.796799
H 3.322902 1.316477 -0.158793
H 1.926507 1.910030 0.771034
H -0.492687 0.423405 -1.860803
H 0.996238 0.530037 -2.804162
H 2.677356 2.668236 -2.117158
H 2.058590 3.727794 -0.818751
H -0.211716 2.760120 -1.022389
H 0.289638 2.899200 -2.730504
H -1.640201 -2.091419 -0.089077
H -1.963227 2.119013 0.927715
H 2.679072 -3.243507 -0.012442
H -4.050170 -2.097487 -0.836627
H -4.377251 2.115126 0.180224
H 5.137874 -3.804269 -0.421881
H 4.481155 -2.675791 -1.645219
H 5.527417 -2.059521 -0.319409
H 4.075188 -3.716489 2.059784
H 2.824218 -2.460709 2.360506
H 4.541452 -1.986900 2.132335
H -6.213899 1.004413 -1.033776
H -6.009355 -0.649826 -1.679975
H -6.475005 -0.407682 0.020360


