%chk=000039071.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039071

0 1
 S    2.076100       1.273500     -0.3152000    
 N   0.6662000     -0.8070000      0.2899000    
 C   -1.591300      7.8400001E-02  0.6719000    
 C   -2.441700     -0.1917000     -0.5699000    
 C  -0.1421000      0.2949000      0.3188000    
 C   -3.896400     -0.4388000     -0.2035000    
 C   0.4113000       1.503800      2.6000001E-02
 C    1.875100     -0.4080000     -3.7300002E-02
 C    3.042700      -1.305000     -0.1807000    
 H   -1.665800     -0.7672000       1.367000    
 H   -1.973200      0.9586000       1.204000    
 H   -2.382500      0.6592000      -1.259500    
 H   -2.052800      -1.064000      -1.109300    
 H   -3.992900      -1.307600      0.4555000    
 H   -4.325200      0.4296000      0.3066000    
 H   -4.487100     -0.6291000      -1.105000    
 H  -4.6999998E-02   2.482000     -8.2999999E-03
 H    3.838300      -1.029900      0.5192000    
 H    2.758600      -2.341500      2.8800000E-02
 H    3.443300      -1.268900      -1.199000    


%chk=000039071-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000039071

0 1
S 2.262676 1.411572 -0.036164
N 0.621531 -0.682155 0.154666
C -1.648430 0.296046 0.640536
C -2.409110 -0.337978 -0.555107
C -0.172517 0.466119 0.373523
C -3.897937 -0.584267 -0.233233
C 0.520079 1.664607 0.312552
C 1.891302 -0.405390 -0.072152
C 2.982318 -1.400126 -0.335613
H -1.778814 -0.356639 1.526987
H -2.095509 1.276718 0.890214
H -2.316800 0.325653 -1.437221
H -1.912249 -1.290011 -0.820145
H -4.009093 -1.275527 0.623585
H -4.413387 0.359679 0.027662
H -4.425667 -1.029366 -1.096371
H 0.132476 2.672436 0.446631
H 3.780915 -1.338548 0.425880
H 2.551304 -2.413867 -0.312729
H 3.450513 -1.237656 -1.323501


