%chk=000077739.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077739

0 1
 S    1.720800     -0.5522000      0.9336000    
 S   -1.721800     -0.5516000      0.9326000    
 P  -3.9999999E-04 -0.1323000     -0.2084000    
 O   2.7999999E-03   1.433800     -0.6505000    
 O   1.8000000E-03  -1.019800      -1.428800    
 C    3.111800     -0.1932000     -0.1571000    
 C   -3.113300     -0.1951000     -0.1586000    
 C    4.432500     -0.4590000      0.5565000    
 C   -4.433900     -0.4610000      0.5554000    
 C    5.615900     -0.1641000     -0.3536000    
 C   -5.617600     -0.1605000     -0.3524000    
 C   1.4000000E-03   2.455000      0.3314000    
 H    3.049800      0.8536000     -0.4714000    
 H    3.027100     -0.8190000      -1.051300    
 H   -3.028200     -0.8217000      -1.052200    
 H   -3.051800      0.8515000     -0.4739000    
 H    4.514900      0.1662000       1.454000    
 H    4.489500      -1.506000      0.8785000    
 H   -4.492200      -1.508900      0.8739000    
 H   -4.514400      0.1613000       1.455000    
 H    5.615000      0.8835000     -0.6711000    
 H    6.555900     -0.3591000      0.1720000    
 H    5.589700     -0.7947000      -1.248100    
 H   -5.593200     -0.7876000      -1.249400    
 H   -6.557500     -0.3558000      0.1733000    
 H   -5.615300      0.8885000     -0.6658000    
 H   0.8939000       2.384400      0.9569000    
 H  -0.8961000       2.387900      0.9503000    
 H   5.1000002E-03   3.423100     -0.1758000    


%chk=000077739-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000077739

0 1
S 1.196389 0.473151 1.273163
S -2.219495 1.642304 1.099548
P -0.308413 1.429182 -0.178297
O 0.268474 3.052589 -0.452774
O -0.489530 0.674275 -1.570356
C 2.544894 0.056291 -0.025892
C -3.303460 0.538871 -0.027328
C 3.332130 -1.177118 0.449327
C -3.151149 -0.957194 0.282660
C 4.456202 -1.532853 -0.551729
C -4.098162 -1.803068 -0.599976
C 0.405024 3.958906 0.704538
H 3.191297 0.942121 -0.133755
H 2.023952 -0.141303 -0.978943
H -3.025675 0.767923 -1.070202
H -4.328082 0.904129 0.164876
H 3.771930 -0.983698 1.446907
H 2.638737 -2.031162 0.562220
H -2.103320 -1.260333 0.101759
H -3.363429 -1.139626 1.352857
H 5.179360 -0.702701 -0.655063
H 5.011658 -2.425315 -0.211574
H 4.044298 -1.751413 -1.554300
H -3.881447 -1.653939 -1.673779
H -3.977875 -2.878683 -0.377829
H -5.157895 -1.538425 -0.424419
H 1.107238 3.542572 1.451424
H -0.580219 4.150567 1.169502
H 0.808767 4.891150 0.282434


