%chk=000124419.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124419

0 1
 S  -0.4819000      0.2499000       1.990600    
 O   -1.373100      -2.856600       1.693500    
 O   -2.039000       1.906400     -0.6632000    
 O  -0.3052000     -0.5420000       3.199800    
 O  -0.9792000       1.615200       2.086400    
 O   -3.636900      0.5245000      -1.566600    
 O    4.915000       1.268300      -1.767900    
 O    5.501300     -0.6094000     -0.7936000    
 N   -1.459000     -0.6156000      0.9091000    
 N    4.680700      0.3219000     -0.9779000    
 C   -2.184900      -1.912800     -0.5926000    
 C   -1.618100     -0.4774000     -0.5546000    
 C   -1.645500      -2.014900      0.8696000    
 C   -1.534300      -2.903200      -1.545500    
 C   -2.557700      0.6842000     -0.9966000    
 C   -2.119300      -2.772200      -2.945000    
 C    1.031400      0.2708000       1.119700    
 C    1.313500       1.312600      0.2361000    
 C    1.958700     -0.7542000       1.308300    
 C   -2.836200       3.041300      -1.019100    
 C    2.522700       1.329400     -0.4592000    
 C    3.167900     -0.7372000      0.6130000    
 C    3.449800      0.3047000     -0.2707000    
 C   -3.770700       3.366400      0.1266000    
 H   -3.281300      -1.979300     -0.6047000    
 H  -0.6487000     -0.4035000      -1.064700    
 H  -0.4478000      -2.762600      -1.582500    
 H   -1.713100      -3.925200      -1.190900    
 H   -1.657200      -3.497800      -3.621200    
 H   -3.199700      -2.949600      -2.936500    
 H   -1.947500      -1.768800      -3.347600    
 H   0.6084000       2.122200      7.4000001E-02
 H    1.756600      -1.578800       1.986100    
 H   -3.382600       2.880900      -1.955200    
 H   -2.149800       3.877700      -1.185900    
 H    2.708400       2.156900      -1.139300    
 H    3.865700      -1.553000      0.7835000    
 H   -4.358100       4.262300     -9.3699999E-02
 H   -4.458300       2.536800      0.3203000    
 H   -3.206500       3.533800       1.049900    


%chk=000124419-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124419

0 1
S -0.060385 0.878025 1.315757
O -0.312282 -2.704456 0.962963
O -3.574741 1.386614 -1.336658
O -0.338600 0.640174 2.888776
O -0.436142 2.271520 0.564785
O -3.835201 0.276282 0.708251
O 6.449244 0.399338 -0.656794
O 6.375367 -1.338394 0.819772
N -0.924106 -0.440049 0.295864
N 5.833888 -0.352063 0.191383
C -2.053206 -1.844541 -0.786820
C -1.948704 -0.261582 -0.786253
C -0.954037 -1.856586 0.327255
C -1.716319 -2.572872 -2.095340
C -3.207815 0.480554 -0.353979
C -2.826711 -2.406108 -3.156056
C 1.758554 0.475699 0.958396
C 2.432188 1.300581 0.043371
C 2.343867 -0.604392 1.639679
C -4.766573 2.251101 -1.039513
C 3.791945 1.024872 -0.209517
C 3.702911 -0.878898 1.380879
C 4.396549 -0.060183 0.462220
C -4.339467 3.471083 -0.220465
H -3.017399 -2.174949 -0.359100
H -1.536725 0.174451 -1.708506
H -0.751711 -2.199085 -2.491136
H -1.567511 -3.644794 -1.863799
H -2.557390 -2.931656 -4.089187
H -3.786238 -2.822795 -2.798213
H -2.991861 -1.341329 -3.404048
H 1.911802 2.135667 -0.436452
H 1.764708 -1.212000 2.341829
H -5.514038 1.640863 -0.502517
H -5.139420 2.523731 -2.039248
H 4.381845 1.627283 -0.904663
H 4.223254 -1.704912 1.871538
H -5.207156 4.141856 -0.080326
H -3.970637 3.170385 0.773953
H -3.543247 4.033662 -0.736281


