%chk=000068575.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068575

0 1
 S    5.976300      0.1532000     -0.6672000    
 O   -5.600800      0.8915000      -1.434900    
 O    5.136400      7.9499997E-02  0.7451000    
 O    7.522400     -0.1124000     -0.2159000    
 O    5.564700     -0.9475000      -1.519000    
 O    5.896400       1.517100      -1.157200    
 C   -3.291600      0.4419000     -0.6577000    
 C   -2.722600     -0.7824000      9.4700001E-02
 C   -1.199300     -0.8821000     -1.4300000E-02
 C   -4.820200      0.2048000     -0.4661000    
 C  -0.5635000      0.3931000      0.6165000    
 C   -2.693400       1.711500     -2.5900001E-02
 C   -3.572900      -1.942300     -0.4175000    
 C   -1.152200       1.683200     -1.3200000E-02
 C   -4.962900      -1.325000     -0.6767000    
 C  -0.6414000      -2.118100      0.6953000    
 C   -2.957200      0.4519000      -2.179000    
 C   0.9609000      0.3109000      0.6145000    
 C   0.8550000      -2.239400      0.4241000    
 C    1.611700     -0.9414000      0.5649000    
 C   -5.317300      0.5731000      0.8743000    
 C    1.752300       1.465300      0.7512000    
 C    3.016100      -1.003200      0.5973000    
 C    3.146200       1.388900      0.7922000    
 C    3.778800      0.1555000      0.7098000    
 C   -5.721600      0.8721000       1.964400    
 H   -2.951500     -0.6822000       1.167700    
 H  -0.9110000     -0.9535000      -1.070800    
 H  -0.8451000      0.4128000       1.680900    
 H   -3.023100       1.822200       1.013700    
 H   -3.040900       2.606200     -0.5564000    
 H   -3.632600      -2.754800      0.3139000    
 H   -3.164900      -2.361700      -1.344000    
 H  -0.7631000       1.813400      -1.029900    
 H  -0.8229000       2.563600      0.5509000    
 H   -5.284800      -1.562100      -1.698200    
 H   -5.708900      -1.769800     -6.8000001E-03
 H   -1.137600      -3.032400      0.3514000    
 H  -0.8209000      -2.044700       1.775800    
 H   -1.883400      0.4632000      -2.380800    
 H   -3.366900     -0.4161000      -2.704700    
 H   -3.375300       1.345400      -2.657700    
 H    1.003700      -2.605500     -0.5999000    
 H    1.274300      -2.989700       1.105400    
 H   -6.516100      0.5680000      -1.371700    
 H    1.301300       2.449300      0.8373000    
 H    3.515300      -1.968300      0.5383000    
 H    3.729000       2.300500      0.8942000    
 H   -6.079400       1.137400       2.931600    
 H    7.827200      0.4042000      0.5666000    


%chk=000068575-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068575

0 1
S 6.404583 0.308984 -0.842619
O -5.609178 1.097380 -1.368183
O 5.153574 -0.096255 0.865788
O 7.718320 0.712147 0.379291
O 6.988794 -0.877901 -1.766898
O 5.863485 1.659318 -1.554569
C -3.314359 0.445820 -0.658565
C -2.770959 -0.808392 0.094017
C -1.247045 -0.963578 -0.048474
C -4.858088 0.269170 -0.397201
C -0.563985 0.313589 0.539228
C -2.657261 1.711451 -0.064545
C -3.696563 -1.965924 -0.369320
C -1.107110 1.622348 -0.110423
C -5.078509 -1.276733 -0.631083
C -0.691419 -2.213909 0.664631
C -3.075056 0.392326 -2.191694
C 0.963357 0.198169 0.546686
C 0.807870 -2.382400 0.352497
C 1.605716 -1.089319 0.499789
C -5.265428 0.647943 0.974404
C 1.777106 1.367101 0.654073
C 3.007295 -1.160978 0.567776
C 3.172830 1.297093 0.724952
C 3.809930 0.013776 0.707150
C -5.681091 0.948616 2.096268
H -2.973492 -0.639987 1.176204
H -0.989152 -1.044242 -1.126097
H -0.873138 0.348157 1.612583
H -2.981097 1.831965 0.988412
H -2.991886 2.613813 -0.610734
H -3.770624 -2.760742 0.392937
H -3.306228 -2.432440 -1.293665
H -0.742088 1.691503 -1.153048
H -0.705749 2.505355 0.420455
H -5.401719 -1.409888 -1.678989
H -5.871927 -1.676695 0.023119
H -1.238239 -3.118964 0.341473
H -0.848113 -2.112794 1.758228
H -2.002123 0.470054 -2.436029
H -3.452620 -0.539151 -2.647082
H -3.602121 1.231189 -2.674681
H 0.918156 -2.740146 -0.692345
H 1.256074 -3.165617 0.992498
H -6.559341 1.128291 -1.087720
H 1.300319 2.350692 0.681253
H 3.520491 -2.129348 0.534876
H 3.791863 2.196700 0.796703
H -6.031333 1.218316 3.075749
H 7.219976 0.759241 1.249426


