%chk=000109334.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000109334

0 1
 S   -3.687400     -0.2512000      0.3963000    
 O   -1.964800       1.515100      -1.344100    
 O    4.491400     -0.9204000      0.8079000    
 O    1.845000      -2.193700      -1.099400    
 O    2.838000       2.190600      0.8127000    
 O   -4.102100      -1.828200      0.3926000    
 O   -4.348300      0.4095000     -0.7130000    
 O   -3.785300      0.2548000       1.752200    
 N   0.9601000      7.9899997E-02  0.4022000    
 C    2.364600     -6.3800000E-02 -1.3600000E-02
 C   0.1838000      0.7125000     -0.6482000    
 C   -1.290000      0.8718000     -0.2607000    
 C    3.121400     -0.7398000       1.147500    
 C    2.423100     -0.9100000      -1.303800    
 C    2.928800       1.338900     -0.3235000    
 C   -1.978300     -0.4659000     -5.1000002E-03
 H   0.5809000     -0.8433000      0.6079000    
 H   0.1822000      0.1543000      -1.588700    
 H   0.5245000       1.725500     -0.8801000    
 H   -1.374100       1.524300      0.6170000    
 H    3.078700     -0.1279000       2.056200    
 H    2.699400      -1.720700       1.393100    
 H    3.467700      -1.071700      -1.598500    
 H    1.959800     -0.4457000      -2.178400    
 H    2.485300       1.838400      -1.189600    
 H    3.995900       1.257800     -0.5631000    
 H   -1.526400      -1.013800      0.8261000    
 H   -1.948800      -1.085000     -0.9088000    
 H   -2.804100       1.868800      -1.005000    
 H    4.921100      -1.343800       1.570500    
 H    2.450200      -2.707300     -0.5388000    
 H    1.899300       2.249700       1.058400    
 H   -4.138000      -2.255800     -0.4952000    


%chk=000109334-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000109334

0 1
S -3.667685 0.208278 0.795376
O -1.962734 1.091528 -1.852507
O 4.472403 -1.074428 0.832340
O 3.220560 -2.057092 -1.442073
O 1.856093 1.921236 1.199940
O -4.660812 -1.300525 0.365805
O -4.170788 1.468044 -0.109520
O -3.606986 0.390619 2.398386
N 0.955093 -0.354995 -0.023005
C 2.433182 -0.097769 -0.099975
C 0.112101 0.140068 -1.139764
C -1.270150 0.644562 -0.651509
C 3.040680 -0.845370 1.117543
C 3.092316 -0.595957 -1.417080
C 2.655675 1.429998 0.078621
C -2.027802 -0.494214 0.047304
H 0.794535 -1.357918 0.142641
H -0.051319 -0.618827 -1.932001
H 0.589754 1.009232 -1.621816
H -1.110952 1.479975 0.064007
H 2.905325 -0.228994 2.025853
H 2.534795 -1.823344 1.255308
H 4.081073 -0.111512 -1.541778
H 2.461562 -0.339032 -2.284417
H 2.403256 1.978943 -0.854012
H 3.716308 1.622061 0.315706
H -1.511766 -0.911988 0.925900
H -2.391249 -1.258513 -0.657067
H -2.831908 1.505149 -1.579338
H 4.957376 -1.266726 1.671195
H 3.957805 -2.269374 -0.807160
H 1.062579 1.307902 1.227579
H -5.584720 -1.187118 0.732519


