%chk=000138659.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138659

0 1
 S    3.554200     -6.9999998E-04  -1.380400    
 N    1.829400      6.0000003E-04  0.7906000    
 C  -0.2026000       1.208300      0.2585000    
 C  -0.2016000      -1.207800      0.2589000    
 C   -2.226100     -3.9999999E-04 -0.2714000    
 C   0.4727000      5.0000002E-04  0.4355000    
 C   -1.551900       1.207800     -9.4899997E-02
 C   -1.551000      -1.208300     -9.4599999E-02
 C   0.4962000       2.515800      0.4433000    
 C   0.4982000      -2.514600      0.4443000    
 C   -3.669000     -1.5000000E-03 -0.6486000    
 C    2.551400      3.9999999E-04 -0.1412000    
 H   -2.081100       2.147200     -0.2370000    
 H   -2.079700      -2.148000     -0.2364000    
 H    1.065000       2.528600       1.379100    
 H    1.172200       2.710100     -0.3953000    
 H  -0.2144000       3.348100      0.4969000    
 H    1.174400      -2.708900     -0.3941000    
 H    1.066900      -2.526600       1.380200    
 H  -0.2118000      -3.347400      0.4982000    
 H   -4.183300     -0.8786000     -0.2413000    
 H   -4.181900      0.8819000     -0.2533000    
 H   -3.772300     -8.5000005E-03  -1.738200    


%chk=000138659-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000138659

0 1
S 4.644899 0.000697 0.479623
N 1.815592 0.000696 0.233379
C -0.259021 1.247064 0.046111
C -0.258101 -1.246900 0.044495
C -2.387550 -0.000587 -0.155015
C 0.435959 0.000303 0.108368
C -1.664632 1.216541 -0.082885
C -1.663675 -1.217300 -0.084445
C 0.503059 2.554618 0.117817
C 0.505049 -2.553930 0.114568
C -3.896213 -0.001192 -0.323045
C 3.017051 0.000965 0.340855
H -2.209009 2.167772 -0.127477
H -2.207327 -2.168900 -0.130226
H 1.132201 2.608786 1.025628
H 1.183648 2.672134 -0.746843
H -0.186346 3.414932 0.126850
H 1.186067 -2.669595 -0.749997
H 1.133874 -2.608890 1.022548
H -0.183638 -3.414836 0.122087
H -4.355594 -0.891247 0.141631
H -4.354913 0.895555 0.129152
H -4.177481 -0.008687 -1.394380


