%chk=000137175.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137175

0 1
 S   -2.761800     -0.2626000      -2.707900    
 N  -0.1440000     -6.1099999E-02  -1.908700    
 C   5.0099999E-02  2.0800000E-02 -0.4049000    
 C   -1.142100      0.6817000      0.2004000    
 C   0.2535000      -1.472300      6.7000002E-02
 C    1.393500      0.8245000     -0.1977000    
 C   -1.952100     -2.1900000E-02   1.091800    
 C  -0.3485000      -2.432800     -0.6723000    
 C    1.487000       1.577600      0.9228000    
 C   -1.446900       2.003600     -0.1246000    
 C    1.012900      -1.665300       1.170400    
 C    2.337900      0.6920000      -1.157900    
 C   -3.067000      0.5962000       1.658000    
 C  -0.1689000      -3.751800     -0.2556000    
 C    2.673700       2.287400       1.106000    
 C   -2.561800       2.621700      0.4419000    
 C    1.192700      -2.984500       1.586700    
 C    3.524500       1.401800     -0.9745000    
 C   -3.371800       1.917900       1.333200    
 C   0.6017000      -4.027700      0.8737000    
 C    3.692500       2.199500      0.1575000    
 C   -1.255000     -0.1447000      -2.205200    
 H   -1.774800      -1.049000       1.388500    
 H  -0.9582000      -2.330300      -1.550700    
 H   0.7281000       1.641200       1.692900    
 H  -0.8348000       2.572600     -0.8199000    
 H    1.462100     -0.8857000       1.768900    
 H    2.246000      5.9599999E-02  -2.032700    
 H   -3.698400      4.8999999E-02   2.351900    
 H  -0.6288000      -4.565700     -0.8090000    
 H    2.808000       2.902300       1.991200    
 H   -2.800200       3.650400      0.1879000    
 H    1.786600      -3.199500       2.470300    
 H    4.320900       1.328400      -1.709500    
 H   -4.240100       2.398900       1.773800    
 H   0.7401000      -5.054600       1.199100    
 H    4.617700       2.749500      0.3018000    


%chk=000137175-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000137175

0 1
S -1.377254 -0.675919 -4.371233
N -0.199745 0.014931 -1.879178
C 0.024834 0.022040 -0.432050
C -1.214330 0.680623 0.243598
C 0.207615 -1.458229 0.023371
C 1.299187 0.865613 -0.154767
C -1.740795 0.189024 1.461496
C -0.786079 -2.409967 -0.325849
C 1.465071 1.542749 1.077245
C -1.789828 1.838492 -0.337534
C 1.325111 -1.881504 0.779274
C 2.341766 0.915316 -1.111853
C -2.831923 0.839063 2.083860
C -0.661363 -3.757353 0.068613
C 2.651160 2.262806 1.344970
C -2.880676 2.484391 0.280558
C 1.449037 -3.233480 1.178680
C 3.526040 1.637517 -0.846893
C -3.407180 1.987004 1.496149
C 0.459526 -4.176008 0.825140
C 3.686723 2.313921 0.384396
C -0.729422 -0.307656 -2.919008
H -1.309268 -0.704751 1.923547
H -1.660708 -2.097167 -0.907499
H 0.664918 1.521125 1.824135
H -1.385700 2.230481 -1.277416
H 2.103134 -1.164343 1.056388
H 2.219564 0.395628 -2.067803
H -3.231574 0.444260 3.024635
H -1.435412 -4.479263 -0.213785
H 2.762002 2.786982 2.300753
H -3.319820 3.373722 -0.184790
H 2.322283 -3.546135 1.762012
H 4.320439 1.672187 -1.600680
H -4.255850 2.487267 1.975678
H 0.559000 -5.223465 1.130721
H 4.603816 2.877198 0.589721


