%chk=000084609.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084609

0 1
 S    3.173200       3.092600      0.3417000    
 O    2.088500      0.6036000      0.2064000    
 N   0.6050000       2.309500      0.1457000    
 C   0.8377000      7.3799998E-02  0.1066000    
 C  -5.3100001E-02   1.112600      7.0699997E-02
 C   0.7665000      -1.358400      6.6699997E-02
 C   -1.480500      0.9906000     -3.0700000E-02
 C  -0.3523000      -2.023800      0.5792000    
 C    1.815100      -2.102100     -0.4852000    
 C   -2.257200      0.9017000       1.124500    
 C   -2.090000      0.9610000      -1.285000    
 C    1.865100       1.946200      0.2242000    
 C  -0.4218000      -3.416400      0.5400000    
 C    1.745500      -3.494700     -0.5243000    
 C   -3.643400      0.7833000       1.025300    
 C   -3.476200      0.8426000      -1.384100    
 C   0.6271000      -4.151900     -1.1700000E-02
 C   -4.253100      0.7537000     -0.2290000    
 C    4.503900       2.176200     -0.4809000    
 H   -1.176200      -1.501700       1.048300    
 H    2.696000      -1.616300     -0.8986000    
 H   -1.798000      0.9254000       2.110000    
 H   -1.498800       1.029300      -2.195100    
 H   -1.288900      -3.929000      0.9461000    
 H    2.561600      -4.067500     -0.9551000    
 H   -4.248400      0.7143000       1.924600    
 H   -3.951000      0.8195000      -2.360600    
 H   0.5737000      -5.236200     -4.0800001E-02
 H   -5.332400      0.6615000     -0.3062000    
 H    4.207400       1.900700      -1.496700    
 H    4.753300       1.273300      8.3099999E-02
 H    5.394100       2.808200     -0.5363000    


%chk=000084609-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000084609

0 1
S 3.143514 3.170423 0.314938
O 2.080968 0.637922 -0.082534
N 0.508430 2.254272 0.315145
C 0.788254 0.005624 -0.119762
C -0.159970 1.012149 0.094712
C 0.810501 -1.449484 -0.276723
C -1.634735 0.991473 0.070843
C -0.208980 -2.268378 0.287810
C 1.888601 -2.077114 -0.964489
C -2.346484 1.984095 0.799258
C -2.369341 0.048599 -0.699783
C 1.797589 1.994307 0.195371
C -0.159701 -3.669861 0.145765
C 1.934565 -3.479756 -1.098830
C -3.756351 2.012130 0.783506
C -3.779372 0.082230 -0.716451
C 0.908661 -4.284352 -0.550074
C -4.480764 1.058506 0.030197
C 4.617059 1.993114 0.241052
H -1.025986 -1.807648 0.851742
H 2.683494 -1.456941 -1.390911
H -1.776032 2.730050 1.361261
H -1.839423 -0.694379 -1.304827
H -0.950261 -4.284504 0.590309
H 2.769606 -3.945524 -1.633828
H -4.290196 2.780516 1.353738
H -4.330793 -0.646215 -1.321514
H 0.944165 -5.374038 -0.656340
H -5.576110 1.082044 0.015693
H 4.623350 1.458286 -0.718544
H 4.575283 1.283603 1.079103
H 5.502856 2.640452 0.326967


