%chk=000072287.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072287

0 1
 S  -0.8838000       1.938900       1.820800    
 O    4.222700      0.9053000      -1.016200    
 N  -0.5839000      0.2141000     -0.7484000    
 N   6.2799998E-02  -3.672200      0.9903000    
 C   0.1365000      -2.159900     -0.9838000    
 C  -0.4611000     -0.9204000      -1.672900    
 C  -0.6119000      -2.581200      0.2953000    
 C   0.2196000      -3.345200      -1.952200    
 C   0.6152000      0.7758000     -0.2413000    
 C   -1.888500      0.7028000     -0.4846000    
 C   0.6053000       1.595500      0.9046000    
 C   -2.146500       1.515300      0.6372000    
 C    1.861600      0.5734000     -0.8735000    
 C   -2.976100      0.4325000      -1.343700    
 C  -0.6604000      -4.029500       2.211600    
 C    1.444000      -3.305100       1.306400    
 C    1.796400       2.156000       1.399100    
 C   -3.440900       2.003400      0.8901000    
 C    3.041800       1.136700     -0.3805000    
 C   -4.259500      0.9243000      -1.090400    
 C    3.009700       1.926200      0.7588000    
 C   -4.492900       1.707700      2.9600000E-02
 C    5.390000       1.505500     -0.4565000    
 H    1.167700      -1.905000     -0.7331000    
 H   0.1103000     -0.6379000      -2.565900    
 H   -1.411200      -1.275000      -2.074700    
 H   -1.629100      -2.890700      2.1800000E-02
 H  -0.7147000      -1.724700      0.9726000    
 H   0.7699000      -4.190300      -1.527500    
 H   0.7395000      -3.051900      -2.871000    
 H  -0.7794000      -3.696800      -2.232700    
 H    1.949600     -1.2400000E-02  -1.784600    
 H   -2.872200     -0.1118000      -2.276400    
 H  -0.6941000      -3.202400       2.930300    
 H  -0.1917000      -4.891700       2.698900    
 H   -1.689100      -4.325200       1.977100    
 H    2.091000      -3.325700      0.4246000    
 H    1.886300      -4.042300       1.988000    
 H    1.518300      -2.324700       1.791700    
 H    1.790000       2.779100       2.291300    
 H   -3.643200       2.621800       1.762300    
 H   -5.070200      0.7047000      -1.779000    
 H    3.883100       2.393000       1.200400    
 H   -5.487600       2.093400      0.2302000    
 H    5.596200       1.123500      0.5491000    
 H    5.331400       2.599000     -0.4812000    
 H    6.236400       1.216400      -1.088000    


%chk=000072287-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072287

0 1
S -0.877845 1.527510 2.098411
O 4.073840 1.060798 -1.336440
N -0.621846 0.098570 -0.586589
N 0.200423 -3.841267 1.136159
C 0.212334 -2.281754 -0.853462
C -0.546847 -1.081781 -1.481670
C -0.580985 -2.852956 0.349081
C 0.460424 -3.368757 -1.921108
C 0.588490 0.728088 -0.167577
C -1.863449 0.791568 -0.430297
C 0.614182 1.504047 1.027640
C -2.122093 1.548080 0.747724
C 1.777545 0.626895 -0.927451
C -2.866124 0.767684 -1.438497
C -0.667235 -4.748445 1.915902
C 1.222253 -3.205512 1.995967
C 1.784781 2.169454 1.426003
C -3.333044 2.247052 0.917316
C 2.965183 1.264595 -0.496638
C -4.096054 1.435655 -1.252215
C 2.982225 2.048081 0.681573
C -4.338054 2.178171 -0.075442
C 5.326790 1.723750 -0.970592
H 1.193746 -1.923012 -0.490964
H -0.090586 -0.822716 -2.461151
H -1.581960 -1.405555 -1.687614
H -1.478952 -3.371137 -0.044034
H -0.940803 -2.010830 0.991547
H 0.892114 -4.261626 -1.437167
H 1.156061 -3.020387 -2.707674
H -0.487038 -3.669438 -2.411284
H 1.812426 0.065600 -1.864321
H -2.680908 0.241407 -2.379767
H -1.269587 -4.225170 2.702217
H -0.046723 -5.512509 2.418808
H -1.367938 -5.268997 1.238873
H 1.915811 -2.598848 1.389400
H 1.814791 -3.987559 2.504132
H 0.778599 -2.537931 2.777830
H 1.772695 2.773207 2.339496
H -3.492377 2.830662 1.830305
H -4.856082 1.389617 -2.039891
H 3.887827 2.553952 1.025667
H -5.287123 2.704710 0.067499
H 5.697666 1.372546 0.012227
H 5.209290 2.824886 -0.950121
H 6.041457 1.441901 -1.757808


