%chk=000030319.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030319

0 1
 S   -1.338000      -2.751100       1.218400    
 P  -0.2788000      -1.686100     -0.2514000    
 O   -1.104300     -0.3624000     -0.7089000    
 O    1.068500      -1.060000      0.4097000    
 O   2.6600000E-02  -2.582200      -1.423800    
 C   -2.238600       1.726400     -0.4463000    
 C    3.095900      0.2084000      0.4437000    
 C   -1.485400      0.6046000      0.2544000    
 C    1.912600     -0.2540000     -0.3947000    
 C   -2.667000       2.815300      0.5333000    
 C    4.041600       1.097600     -0.3585000    
 C   -3.380900       3.954200     -0.1769000    
 C    5.198900       1.592200      0.4943000    
 C   -2.851200      -3.302800      0.4066000    
 H   -1.602100       2.152200      -1.232100    
 H   -3.114100       1.311900     -0.9615000    
 H    2.724900      0.7469000       1.324900    
 H    3.632700     -0.6664000      0.8313000    
 H  -0.5938000      0.9957000      0.7540000    
 H   -2.128500      0.1365000       1.005600    
 H    1.351100      0.6074000     -0.7693000    
 H    2.257300     -0.8438000      -1.250500    
 H   -3.332000       2.390700       1.294400    
 H   -1.789100       3.213500       1.055200    
 H    4.436800      0.5418000      -1.216700    
 H    3.495000       1.961100     -0.7550000    
 H   -3.680000       4.721900      0.5435000    
 H   -4.281700       3.595900     -0.6854000    
 H   -2.729100       4.422500     -0.9213000    
 H    4.837300       2.181700       1.342900    
 H    5.785700      0.7539000      0.8832000    
 H    5.864300       2.225700     -0.1004000    
 H   -3.467400      -3.863200       1.114000    
 H   -3.416900      -2.439400      4.7600001E-02
 H   -2.606300      -3.947600     -0.4411000    


%chk=000030319-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030319

0 1
S -0.855742 -2.034903 0.972655
P -0.478176 -0.855540 -0.990681
O -1.643322 0.399778 -1.122059
O 0.912439 0.092030 -0.576017
O -0.409092 -1.788097 -2.275125
C -3.049467 2.209147 -0.356373
C 3.226829 0.442929 0.042211
C -1.861992 1.327143 0.028412
C 2.233815 -0.594192 -0.482318
C -3.386982 3.232220 0.755354
C 4.652816 -0.145176 0.171930
C -4.585964 4.128495 0.377712
C 5.666227 0.891938 0.701837
C -1.518777 -3.616198 0.161620
H -2.812371 2.739896 -1.297788
H -3.926904 1.565936 -0.558279
H 3.238243 1.310261 -0.645068
H 2.880144 0.810899 1.026830
H -0.941148 1.918530 0.185662
H -2.076331 0.729361 0.937498
H 2.518189 -0.958703 -1.487558
H 2.146630 -1.457234 0.208160
H -3.610078 2.694327 1.699156
H -2.500370 3.866955 0.957246
H 4.631932 -1.022025 0.850431
H 4.989724 -0.520061 -0.815644
H -4.813833 4.853604 1.180074
H -5.493691 3.521874 0.200923
H -4.378558 4.699536 -0.546478
H 5.730552 1.764862 0.025681
H 5.369545 1.261797 1.701136
H 6.678026 0.456039 0.788890
H -1.051827 -4.463558 0.684888
H -2.612682 -3.645308 0.259487
H -1.223802 -3.617562 -0.901207


