%chk=000166408.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166408

0 1
 S   -3.409100      -1.215000      0.1585000    
 O    1.508300      -3.075400     -3.0700000E-02
 O    4.431900      0.5615000     -2.4599999E-02
 O   -4.056800     -0.8378000      -1.292600    
 O   -3.285800      -2.662500      0.2092000    
 O   -4.139200     -0.4914000       1.185000    
 N    3.015000      -1.295000     -9.7300000E-02
 N   -2.691000       1.702500      0.2164000    
 C   0.8362000      0.4604000      5.9900001E-02
 C  -0.2664000       1.348900      0.1234000    
 C   0.5954000     -0.9202000      2.9300001E-02
 C    2.134400      0.9890000      3.2400001E-02
 C   -1.570900      0.8332000      0.1534000    
 C   -1.791300     -0.5419000      0.1221000    
 C  -0.7129000      -1.419500      6.0500000E-02
 C    1.730800      -1.866500     -3.6400001E-02
 C    3.300800      8.0700003E-02 -3.3700000E-02
 C  -3.9700001E-02   2.733000      0.1568000    
 C    2.344200       2.373400      6.6900000E-02
 C    1.257400       3.240700      0.1288000    
 C    4.145500      -2.206300     -0.2381000    
 C   -3.337100       2.208300     -0.9491000    
 H  -0.8746000      -2.493000      3.2400001E-02
 H  -0.8552000       3.449500      0.2132000    
 H    3.345400       2.795400      4.5899998E-02
 H    1.420800       4.314200      0.1569000    
 H   -3.302200       1.516000       1.007100    
 H    4.445200      -2.528900      0.7638000    
 H    4.993700      -1.714200     -0.7222000    
 H    3.861600      -3.087000     -0.8216000    
 H   -4.366300       2.497300     -0.7150000    
 H   -3.364100       1.484400      -1.767500    
 H   -2.819900       3.100700      -1.315600    
 H   -3.591600      -1.216900      -2.075100    


%chk=000166408-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166408

0 1
S -3.413189 -1.505795 0.198224
O 1.658741 -3.135466 0.092753
O 4.483944 0.563577 -0.283468
O -3.634388 -1.692067 -1.638771
O -3.282537 -2.972709 0.854295
O -4.592752 -0.499013 0.721967
N 3.060304 -1.284917 -0.111256
N -2.868178 1.541710 -0.037887
C 0.785784 0.468115 -0.055738
C -0.351677 1.363692 -0.029040
C 0.617027 -0.951768 0.035138
C 2.111195 1.005257 -0.132181
C -1.709311 0.804059 0.017210
C -1.778872 -0.623202 0.149967
C -0.669088 -1.483800 0.153787
C 1.771722 -1.875973 0.013347
C 3.304323 0.110305 -0.183510
C -0.088751 2.770199 0.004287
C 2.323081 2.392727 -0.144157
C 1.218786 3.274252 -0.053267
C 4.214294 -2.213283 -0.153089
C -3.095438 2.895553 -0.559308
H -0.792525 -2.569492 0.241057
H -0.906175 3.481869 0.108065
H 3.352482 2.760096 -0.202132
H 1.383179 4.355542 -0.019233
H -3.728862 1.018296 0.212930
H 4.243289 -2.815676 0.769429
H 5.127072 -1.609296 -0.250619
H 4.109520 -2.901027 -1.007914
H -4.138742 2.945756 -0.913470
H -2.435861 3.115141 -1.415689
H -2.966737 3.681780 0.209564
H -4.419160 -2.296841 -1.788890


