%chk=000085520.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085520

0 1
 S    4.610200      0.8948000     -1.0500000E-02
 O  -0.5138000      0.3418000      4.3000001E-03
 O   -1.759500      -1.600000      3.1000001E-03
 C    1.884000      0.5185000      3.5999999E-03
 C   0.6917000     -0.4298000      3.3000000E-03
 C   -2.844500      0.5767000      4.1000000E-03
 C   -4.182700     -0.1577000     -2.2200000E-02
 C    3.200000     -0.2490000     -1.2800000E-02
 C   -1.673900     -0.3797000      4.0000002E-03
 C   -5.352000      0.8129000      1.1000000E-02
 C    5.940300     -0.3285000      1.2200000E-02
 H    1.810300       1.182800     -0.8673000    
 H    1.822000       1.167300      0.8869000    
 H   0.7138000      -1.062800     -0.8916000    
 H   0.7151000      -1.065000      0.8966000    
 H   -2.778600       1.194600      0.9068000    
 H   -2.760500       1.222100     -0.8775000    
 H    3.257200     -0.8778000     -0.9075000    
 H    3.267000     -0.8947000      0.8691000    
 H   -4.250700     -0.7782000     -0.9237000    
 H   -4.254000     -0.8373000      0.8356000    
 H   -6.299600      0.2657000     -9.8000001E-03
 H   -5.331100       1.421500      0.9206000    
 H   -5.328500       1.484700     -0.8530000    
 H    5.888400     -0.9648000     -0.8752000    
 H    5.876100     -0.9454000      0.9123000    
 H    6.904100      0.1874000      1.3300000E-02


%chk=000085520-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085520

0 1
S 4.659897 0.942235 0.007099
O -0.523365 0.316295 0.008577
O -1.789929 -1.639699 0.001150
C 1.897082 0.457743 0.008214
C 0.714270 -0.515064 0.006333
C -2.910250 0.575652 0.013208
C -4.277463 -0.135623 -0.020750
C 3.234769 -0.304972 0.004088
C -1.735678 -0.388428 0.006713
C -5.448955 0.867702 -0.001819
C 6.095890 -0.273696 -0.003364
H 1.833527 1.112894 -0.879996
H 1.835643 1.107133 0.900797
H 0.703934 -1.162908 -0.890257
H 0.704418 -1.167177 0.899839
H -2.821711 1.217363 0.912218
H -2.798092 1.260550 -0.850216
H 3.332663 -0.936006 -0.898138
H 3.334548 -0.942679 0.901408
H -4.334764 -0.771705 -0.923694
H -4.350605 -0.824813 0.840965
H -6.420857 0.342941 -0.028849
H -5.428953 1.491711 0.911788
H -5.409798 1.548122 -0.873575
H 6.065595 -0.898276 -0.910857
H 6.071100 -0.907450 0.897919
H 7.017885 0.328254 -0.003100


