%chk=000032969.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032969

0 1
 S   -1.553500       3.111800     -0.4150000    
 O   -1.074200       3.188100      -1.973100    
 O   -2.996600       3.273600     -0.3993000    
 O  -0.6931000       3.975800      0.3720000    
 C   0.3095000     -0.3526000      0.6687000    
 C   0.1099000      0.9881000      0.2617000    
 C   -2.099800     -0.6874000      0.7061000    
 C   -3.273200      -1.577300      0.9426000    
 C    2.715400      4.4999998E-03  0.6246000    
 C   -1.199300       1.464400      8.4700003E-02
 C    4.099000     -0.5180000      0.8172000    
 C  -0.8061000      -1.177500      0.8868000    
 C   -3.695700      -2.332500     -0.3268000    
 C    1.618700     -0.8290000      0.8457000    
 C   -2.296000      0.6309000      0.3059000    
 C    4.674200      -1.129800     -0.4692000    
 C    1.225500       1.812800      4.3699998E-02
 C    2.519200       1.322800      0.2244000    
 C   -4.923100      -3.210300     -8.2699999E-02
 C    6.076200      -1.697800     -0.2498000    
 C   -5.360100      -3.923100      -1.352600    
 C    6.623000      -2.337600      -1.515900    
 H   -3.040500      -2.295000       1.740100    
 H   -4.116400     -0.9843000       1.319900    
 H    4.755100      0.2886000       1.169200    
 H    4.101500      -1.268400       1.618700    
 H  -0.6628000      -2.210900       1.198100    
 H   -2.864300      -2.954200     -0.6825000    
 H   -3.915300      -1.613700      -1.126800    
 H    1.782400      -1.859600       1.156500    
 H   -3.315000      0.9812000      0.1687000    
 H    4.705600     -0.3692000      -1.259700    
 H    4.010100      -1.927200     -0.8266000    
 H    1.161300       2.831900     -0.3163000    
 H    3.366800       1.977200      3.7300002E-02
 H   -4.699900      -3.953800      0.6911000    
 H   -5.752400      -2.595900      0.2867000    
 H    6.753900     -0.8994000      7.3799998E-02
 H    6.053000      -2.447900      0.5493000    
 H   -4.563200      -4.569800      -1.733200    
 H   -5.623200      -3.204400      -2.135400    
 H   -6.237900      -4.546000      -1.154500    
 H    6.687400      -1.606800      -2.328300    
 H    5.984300      -3.163200      -1.845800    
 H    7.626700      -2.735500      -1.336600    
 H   -1.543000       2.579000      -2.590800    


%chk=000032969-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000032969

0 1
S -1.625765 2.972631 -0.674252
O -1.066714 2.641129 -2.420529
O -3.231096 3.179609 -0.662574
O -0.680449 4.149230 -0.083549
C 0.317198 -0.488078 0.725017
C 0.144863 0.854494 0.193707
C -2.141189 -0.848339 0.786536
C -3.354180 -1.723404 1.051438
C 2.774939 -0.193852 0.686883
C -1.211424 1.256642 -0.008855
C 4.183654 -0.721491 0.900438
C -0.833415 -1.294949 1.007486
C -3.967486 -2.312097 -0.250192
C 1.645478 -0.972650 0.958358
C -2.324125 0.471613 0.257086
C 4.901190 -1.080630 -0.431201
C 1.307438 1.648063 -0.074326
C 2.579162 1.130793 0.166051
C -5.228358 -3.162910 0.021034
C 6.347928 -1.577824 -0.212588
C -5.832915 -3.758780 -1.268283
C 7.065533 -1.924558 -1.534655
H -3.075963 -2.556092 1.725782
H -4.136342 -1.136150 1.572847
H 4.792680 0.038155 1.431243
H 4.158765 -1.619644 1.547363
H -0.673297 -2.301567 1.414127
H -3.204340 -2.927791 -0.767324
H -4.223518 -1.485775 -0.943853
H 1.767000 -1.985902 1.361981
H -3.330030 0.866759 0.075052
H 4.913461 -0.192005 -1.094354
H 4.315147 -1.856927 -0.962873
H 1.190563 2.667231 -0.452337
H 3.459005 1.753274 -0.037162
H -4.973858 -3.981380 0.725293
H -5.987243 -2.536395 0.532829
H 6.922784 -0.799020 0.329343
H 6.333207 -2.469079 0.447611
H -5.104843 -4.414061 -1.782291
H -6.123069 -2.959967 -1.976409
H -6.734234 -4.360414 -1.050476
H 7.122250 -1.041174 -2.198242
H 6.526689 -2.720425 -2.082412
H 8.097152 -2.277871 -1.353643
H -1.148136 3.504177 -2.922525


