%chk=000013359.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013359

0 1
 S    1.742500       2.251600     -4.0899999E-02
 O   -1.119200     -3.6200002E-02  0.4008000    
 O  -1.8000000E-03 -0.6404000      -1.523600    
 N    1.696300      -1.787000      0.5843000    
 C    1.203200     -0.4075000      0.5798000    
 C    2.299600      0.5209000      5.5100001E-02
 C  -1.7600000E-02 -0.3921000     -0.3243000    
 C   -2.343500      4.4000000E-02 -0.3358000    
 C   -3.459400      0.4467000      0.6045000    
 H   0.9195000     -0.1313000       1.601800    
 H    3.175600      0.4860000      0.7119000    
 H    2.624800      0.2275000     -0.9496000    
 H   -2.242300      0.7907000      -1.131300    
 H   -2.567400     -0.9325000     -0.7794000    
 H    2.514000      -1.852400       1.189900    
 H    2.021400      -2.042500     -0.3480000    
 H   -4.412400      0.5179000      7.2800003E-02
 H   -3.560800     -0.2812000       1.416200    
 H   -3.240900       1.413400       1.069900    
 H   0.8397000       2.077500      -1.017100    


%chk=000013359-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013359

0 1
S 2.172003 2.372187 -0.209156
O -1.139278 0.009310 0.417789
O 0.026008 -0.131433 -1.595615
N 1.520013 -1.706733 0.681477
C 1.261497 -0.268112 0.548129
C 2.459151 0.499599 -0.058444
C 0.014866 -0.108075 -0.339021
C -2.429584 0.051662 -0.343549
C -3.543547 0.182939 0.689152
H 1.021133 0.138085 1.544608
H 3.339095 0.397381 0.596942
H 2.700897 0.109083 -1.060766
H -2.390758 0.907763 -1.041076
H -2.506516 -0.876096 -0.938808
H 1.877098 -2.046500 1.571562
H 1.837823 -2.201478 -0.151800
H -4.524147 0.215229 0.180100
H -3.539547 -0.674982 1.382796
H -3.427120 1.108273 1.278603
H 1.342214 2.294998 -1.315922


