%chk=000150402.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150402

0 1
 S    3.609100      -1.795200       1.060500    
 O  -0.3679000       2.364000     -0.8786000    
 O    1.785000       2.532900      -1.272500    
 O   -2.438600      -1.706800      -2.262700    
 O  -0.3821000      -1.415000      -1.552000    
 N    2.258000      0.1530000      8.2599998E-02
 N   0.8497000      -1.244800       1.109000    
 N   0.8070000       1.910100     -0.7679000    
 N   -1.618800      -1.256500      -1.429300    
 C   0.1792000     -0.1721000      0.5606000    
 C    1.026700      0.7097000     -8.1400000E-02
 C   -1.248500     -1.3300000E-02  0.6610000    
 C    2.090000     -0.9972000      0.7915000    
 C    3.552800      0.4494000     -0.2710000    
 C   -2.110200     -0.5380000     -0.3021000    
 C   -1.764800      0.6839000       1.753200    
 C    4.409400     -0.4870000      0.1708000    
 C   -3.488300     -0.3655000     -0.1731000    
 C   -3.143000      0.8565000       1.882200    
 C   -4.004700      0.3319000      0.9191000    
 H    3.826200       1.328000     -0.8326000    
 H   -1.108200       1.099700       2.514000    
 H    5.479400     -0.4760000      1.8200001E-02
 H   -4.194700     -0.7578000     -0.9002000    
 H   -3.545100       1.399500       2.732600    
 H   -5.077700      0.4667000       1.020000    


%chk=000150402-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000150402

0 1
S 3.773395 -1.192766 1.835147
O -0.359589 1.739392 -1.726486
O 1.910663 1.912851 -2.035180
O -2.647417 -0.613350 -2.676614
O -0.662212 -1.314953 -1.813850
N 2.376509 0.173193 0.063275
N 0.910249 -0.811350 1.526312
N 0.862062 1.434118 -1.421317
N -1.813888 -0.742409 -1.703508
C 0.187114 -0.099647 0.563403
C 1.080906 0.537825 -0.342975
C -1.286103 -0.031800 0.680950
C 2.203260 -0.637907 1.189435
C 3.711048 0.390944 -0.325860
C -2.228868 -0.249288 -0.361789
C -1.805180 0.288917 1.963157
C 4.591880 -0.258912 0.501192
C -3.615967 -0.096170 -0.158301
C -3.191135 0.427373 2.185526
C -4.100659 0.250566 1.118400
H 3.926568 1.011560 -1.191701
H -1.095953 0.435759 2.783059
H 5.676359 -0.272632 0.435632
H -4.289333 -0.266012 -1.002282
H -3.556946 0.678707 3.186268
H -5.176863 0.366092 1.280006


