%chk=000062290.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062290

0 1
 S    5.674900       1.204900     -0.5104000    
 O    7.213400      -1.394600      -1.237200    
 C   -2.146400      7.5999998E-02 -0.2452000    
 C  -0.9724000      0.9086000      0.2828000    
 C   -3.502400      0.5220000      0.3085000    
 C   0.3867000      0.4495000     -0.2522000    
 C   -4.683600     -0.2626000     -0.2721000    
 C    1.559000       1.277700      0.2871000    
 C   -6.033800      0.1286000      0.3328000    
 C    2.910500      0.8724000     -0.3124000    
 C   -7.174200     -0.6789000     -0.2915000    
 C   -8.520100     -0.3188000      0.3375000    
 C    4.084500       1.695900      0.2177000    
 C   -9.650900      -1.143000     -0.2571000    
 C    5.992700     -0.2502000      0.5132000    
 C    7.297700     -0.9360000      0.1102000    
 C    7.564400      -2.151500      0.9885000    
 H   -1.984300     -0.9790000      7.6000001E-03
 H   -2.165300      0.1403000      -1.340100    
 H   -1.128800       1.960800      1.4800000E-02
 H  -0.9619000      0.8588000       1.378600    
 H   -3.646200       1.589200      9.9299997E-02
 H   -3.496300      0.4114000       1.399800    
 H   0.3774000      0.5088000      -1.347500    
 H   0.5421000     -0.6049000      7.3000002E-03
 H   -4.713600     -0.1100000      -1.358200    
 H   -4.514300      -1.334200     -0.1082000    
 H    1.600800       1.175100       1.378300    
 H    1.378400       2.338600      7.4100003E-02
 H   -6.210200       1.199400      0.1754000    
 H   -6.010300     -4.0300000E-02   1.416200    
 H    2.855700      0.9759000      -1.403700    
 H    3.070900     -0.1916000     -0.1024000    
 H   -6.981900      -1.750100     -0.1552000    
 H   -7.210200     -0.4919000      -1.371600    
 H   -8.729700      0.7461000      0.1835000    
 H   -8.483400     -0.4892000       1.419800    
 H    4.145100       1.635300       1.309500    
 H    3.925300       2.750200     -3.3700000E-02
 H   -9.735300     -0.9729000      -1.335200    
 H   -10.60400     -0.8684000      0.2058000    
 H   -9.487400      -2.212300     -8.9400001E-02
 H    5.161900     -0.9510000      0.3853000    
 H    6.038600      5.4200001E-02   1.564000    
 H    8.139900     -0.2380000      0.1850000    
 H    6.768700      -2.897200      0.8814000    
 H    8.497300      -2.643200      0.6915000    
 H    7.642600      -1.870100       2.043000    
 H    8.068300      -1.798200      -1.464900    


%chk=000062290-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062290

0 1
S 5.757373 1.186068 -0.617072
O 8.101008 -0.842665 -1.033746
C -2.193553 0.038306 -0.246347
C -1.002219 0.873360 0.274857
C -3.560410 0.520326 0.290063
C 0.360215 0.417072 -0.294236
C -4.750456 -0.328242 -0.211778
C 1.555210 1.232533 0.250876
C -6.118919 0.168853 0.306864
C 2.907266 0.805475 -0.369752
C -7.309139 -0.686640 -0.182687
C -8.677680 -0.182671 0.330408
C 4.096650 1.599743 0.197349
C -9.861150 -1.045554 -0.158509
C 6.013012 -0.553888 0.097186
C 7.501361 -0.835466 0.318007
C 7.738197 -2.182442 1.030590
H -2.044649 -1.025981 0.032663
H -2.205003 0.069150 -1.356087
H -1.164790 1.941696 0.020158
H -0.974462 0.819513 1.383505
H -3.715815 1.579330 -0.005032
H -3.543908 0.507144 1.400202
H 0.338789 0.495570 -1.401173
H 0.514048 -0.657642 -0.062223
H -4.758247 -0.328408 -1.322034
H -4.603120 -1.384427 0.097249
H 1.599290 1.124504 1.355065
H 1.384594 2.310925 0.049741
H -6.269931 1.221899 -0.011151
H -6.107817 0.179031 1.417156
H 2.873796 0.943965 -1.468132
H 3.066387 -0.278026 -0.195475
H -7.163091 -1.738759 0.140665
H -7.318968 -0.702248 -1.292888
H -8.824277 0.867309 0.003771
H -8.665301 -0.163520 1.439509
H 4.203817 1.447233 1.287724
H 3.969627 2.682760 0.016308
H -9.914628 -1.054546 -1.263719
H -10.826640 -0.665178 0.223253
H -9.753258 -2.093723 0.179270
H 5.591111 -1.297539 -0.599438
H 5.474417 -0.597314 1.060783
H 7.936416 -0.008612 0.920463
H 7.309528 -3.010876 0.438735
H 8.820876 -2.373659 1.155789
H 7.277889 -2.189418 2.036145
H 9.086453 -0.902720 -0.952575


