%chk=000095529.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095529

0 1
 S   -1.008600      -1.558200     -0.6172000    
 O  -0.8216000       2.181200     -0.6250000    
 N   0.9589000      0.7882000     -0.2515000    
 C    1.475500     -0.5037000      0.1756000    
 C   -1.284900     -6.3999998E-03  0.3063000    
 C   0.8178000      -1.623300     -0.6302000    
 C    2.993400     -0.5485000      2.6000001E-02
 C  -0.3898000       1.092100     -0.2494000    
 C   -2.761200      0.3642000      0.2165000    
 C    3.663600      0.5371000      0.8465000    
 C   -3.643200     -0.7226000      0.8024000    
 H    1.224600     -0.6222000       1.237600    
 H   -1.021900     -0.1677000       1.358300    
 H    1.126500      -1.571600      -1.680600    
 H    1.125800      -2.602500     -0.2486000    
 H    3.281800     -0.4282000      -1.025500    
 H    3.367000      -1.526000      0.3535000    
 H    1.597400       1.492300     -0.6082000    
 H   -3.063100      0.5738000     -0.8176000    
 H   -2.932800       1.291800      0.7777000    
 H    3.439000       1.540900      0.4750000    
 H    3.362700      0.4821000       1.897800    
 H    4.751200      0.4143000      0.8056000    
 H   -3.701900      -1.610900      0.1670000    
 H   -3.303700      -1.023300       1.799100    
 H   -4.666900     -0.3456000      0.9051000    


%chk=000095529-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000095529

0 1
S -1.011671 -1.674453 -0.645585
O -0.856238 2.202686 -0.708830
N 0.933378 0.783808 -0.290367
C 1.497995 -0.515646 0.124671
C -1.321674 -0.009884 0.287738
C 0.887476 -1.657268 -0.721808
C 3.040376 -0.488299 -0.002338
C -0.418776 1.090390 -0.285512
C -2.814042 0.340682 0.184174
C 3.725550 0.504977 0.962247
C -3.732963 -0.655552 0.920427
H 1.243794 -0.703461 1.189920
H -1.045409 -0.199941 1.343047
H 1.179254 -1.542125 -1.779378
H 1.229835 -2.634656 -0.342801
H 3.310936 -0.254477 -1.052337
H 3.415639 -1.509779 0.197748
H 1.554939 1.497190 -0.680456
H -3.091614 0.415239 -0.883086
H -2.938979 1.358306 0.599624
H 3.412654 1.548935 0.778139
H 3.481628 0.266589 2.013869
H 4.823602 0.462205 0.851022
H -3.658204 -1.672608 0.494873
H -3.474214 -0.720745 1.994461
H -4.787673 -0.334811 0.846738


