%chk=000128116.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128116

0 1
 S    1.099200      -3.256000     -0.1271000    
 S   5.0600000E-02   3.619000     -0.9779000    
 S   -1.930900       3.901900     -0.5078000    
 O    2.183900       1.217900      0.7462000    
 O    1.879400      -4.592800     -0.6423000    
 O   0.6341000     -0.2619000      -1.136100    
 O  -0.1670000      -3.155200     -0.8311000    
 O    1.165400      -3.208700       1.322900    
 O    4.508200     -0.3191000       1.361500    
 O    3.351400       2.047800      -1.063600    
 N    2.478700     -4.1700002E-02  0.2611000    
 N   -3.751800      -1.684300      0.5606000    
 N   -4.958900      -1.861400      0.2860000    
 N   -6.060100      -2.029500      3.7500001E-02
 C    2.219400      -2.065300     -0.7877000    
 C    3.556100      -2.049400     -3.9799999E-02
 C    1.656000     -0.6794000     -0.6133000    
 C    3.605000     -0.7034000      0.6346000    
 C    2.701000       2.223400     -4.1999999E-02
 C    2.344000       3.572900      0.5420000    
 C   0.8347000       3.754700      0.6534000    
 C   -2.475100       2.233300     -0.1896000    
 C   -2.989000       1.895000       1.062300    
 C   -2.385900       1.266700      -1.191300    
 C   -3.413700      0.5902000       1.312300    
 C   -2.810500     -3.8100000E-02 -0.9412000    
 C   -3.324500     -0.3764000      0.3106000    
 H    2.352900      -2.270700      -1.854300    
 H    3.673100      -2.845600      0.6998000    
 H    4.388400      -2.101800     -0.7501000    
 H    1.846200      -4.755400      -1.614300    
 H    2.817100       3.654900       1.526900    
 H    2.785500       4.352800     -8.9800000E-02
 H   0.6244000       4.744700       1.071300    
 H   0.4066000       3.000600       1.322100    
 H   -3.064900       2.634500       1.855600    
 H   -1.997400       1.507300      -2.177900    
 H   -3.811600      0.3363000       2.291400    
 H   -2.736600     -0.7841000      -1.728300    


%chk=000128116-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128116

0 1
S 0.865095 -3.362400 -0.417853
S 0.177729 3.957906 -1.170692
S -2.056038 4.102743 -0.743846
O 1.964149 1.256629 0.607342
O 1.132252 -4.368618 -1.947884
O 0.880238 -0.171553 -1.702512
O -0.612066 -2.714651 -0.429866
O 1.355420 -4.192052 0.880257
O 4.070707 -0.365060 1.767165
O 3.655223 2.019896 -0.862658
N 2.324747 -0.046767 0.190086
N -3.991171 -1.370558 1.068305
N -3.674286 -2.484295 0.555285
N -3.524459 -3.612979 0.224216
C 2.324003 -2.069515 -0.954866
C 3.435129 -2.124175 0.093249
C 1.719142 -0.668626 -0.930982
C 3.374191 -0.778083 0.826114
C 2.781679 2.300404 -0.041513
C 2.379897 3.641243 0.536571
C 0.858553 3.897442 0.603108
C -2.500998 2.401848 -0.196972
C -3.463419 2.297233 0.840080
C -1.987935 1.236035 -0.812474
C -3.945148 1.032400 1.226738
C -2.440509 -0.033815 -0.405164
C -3.438828 -0.135600 0.602808
H 2.535454 -2.442432 -1.966456
H 3.299507 -2.949039 0.820381
H 4.428207 -2.251106 -0.370079
H 0.445695 -5.096083 -1.979287
H 2.783323 3.686943 1.567919
H 2.893687 4.417221 -0.055965
H 0.657371 4.866205 1.085519
H 0.338635 3.089600 1.139247
H -3.837197 3.198113 1.337772
H -1.213975 1.308831 -1.582329
H -4.698953 0.933239 2.013229
H -2.011651 -0.932824 -0.861396


