%chk=000065466.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065466

0 1
 S   0.5772000     -0.6387000     -0.9836000    
 O  -0.8071000       2.907400     -0.3200000    
 O    4.700200      -1.450400      5.0900001E-02
 O    2.630400      -2.394400     -7.8999996E-03
 N   -1.956700      0.2391000     -0.4758000    
 N    1.094700       1.622800      0.1508000    
 C   -1.733600     -7.9599999E-02  0.9414000    
 C   -2.559800     -0.8968000      -1.187100    
 C   -3.044900     -0.4482000       1.637300    
 C   -3.897900      -1.292200     -0.5609000    
 C   -3.746100      -1.598900      0.9247000    
 C  -0.7019000      0.6348000      -1.114900    
 C  -0.1716000       1.858600     -0.3942000    
 C    1.634100      0.3694000     -5.8499999E-02
 C    1.807200       2.646400      0.9003000    
 C    2.824000     -6.3299999E-02  0.3755000    
 C    3.351600      -1.416000      0.1220000    
 H   -1.328700      0.7765000       1.492500    
 H   -1.050300     -0.9226000       1.095200    
 H   -1.916600      -1.784700      -1.191200    
 H   -2.742600     -0.6227000      -2.233500    
 H   -3.707700      0.4264000       1.658800    
 H   -2.848200     -0.7246000       2.679500    
 H   -4.306300      -2.167100      -1.079500    
 H   -4.620300     -0.4767000     -0.6933000    
 H   -3.161700      -2.518600       1.050900    
 H   -4.728900      -1.777100       1.374600    
 H  -0.8495000      0.9056000      -2.166500    
 H    1.995800       2.288100       1.917000    
 H    1.215100       3.563900      0.9607000    
 H    2.751400       2.875300      0.3967000    
 H    3.492900      0.5922000      0.9254000    
 H    5.037000      -2.356100     -0.1182000    


%chk=000065466-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000065466

0 1
S 0.795778 -0.915092 -0.947796
O -0.780498 2.726077 0.020235
O 5.212811 -1.144134 0.360856
O 3.392339 -2.235024 -0.607068
N -1.938731 -0.025704 -0.324454
N 1.224666 1.515224 0.132088
C -1.922727 -0.333580 1.127968
C -2.715840 -0.987900 -1.144610
C -3.358140 -0.447673 1.678994
C -4.163456 -1.110210 -0.629705
C -4.183255 -1.475781 0.872120
C -0.740577 0.443347 -0.903288
C -0.130460 1.671701 -0.206748
C 1.869069 0.286778 -0.134208
C 1.940038 2.636962 0.767097
C 3.191354 0.066066 0.192696
C 3.865520 -1.193636 -0.071787
H -1.383789 0.475633 1.651564
H -1.365183 -1.283226 1.305913
H -2.226804 -1.992330 -1.120202
H -2.707339 -0.637367 -2.193138
H -3.842424 0.545633 1.620220
H -3.310366 -0.735073 2.746270
H -4.694768 -1.874991 -1.227157
H -4.682100 -0.144351 -0.782445
H -3.753975 -2.489348 1.013284
H -5.223767 -1.511710 1.244700
H -0.882044 0.658722 -1.975292
H 2.305715 2.346711 1.767323
H 1.224469 3.468143 0.863090
H 2.793816 2.953028 0.143127
H 3.789951 0.844316 0.669627
H 5.631917 -2.023410 0.159827


