%chk=000088321.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088321

0 1
 S    3.428700      -1.029300     -0.1102000    
 S    3.438100       1.021500     -7.8900002E-02
 N  -0.4374000      9.3000000E-03  0.1921000    
 C   0.9560000      9.8000001E-03 -0.2528000    
 C   -1.130900       1.212600     -0.2888000    
 C   -1.120000      -1.212300     -0.2566000    
 C   -2.576500       1.252100      0.2090000    
 C   -2.565300      -1.252000      0.2424000    
 C   -3.335000     -8.9999996E-03 -0.1890000    
 C    1.665500      -1.248800      0.2473000    
 C    1.676900       1.246100      0.2856000    
 H   0.9869000      2.4400000E-02  -1.353900    
 H   -1.116400       1.264500      -1.385500    
 H  -0.6692000       2.127900      9.2600003E-02
 H  -0.6558000      -2.113900      0.1535000    
 H   -1.103600      -1.295100      -1.351300    
 H   -3.085500       2.132600     -0.1994000    
 H   -2.587000       1.354700       1.301700    
 H   -2.575100      -1.325500       1.337500    
 H   -3.066400      -2.147600     -0.1424000    
 H   -4.332300     -7.3000002E-03  0.2643000    
 H   -3.474600     -2.4100000E-02  -1.277000    
 H    1.540800      -1.395800       1.326000    
 H    1.354200      -2.158300     -0.2728000    
 H    1.369700       2.174300     -0.2026000    
 H    1.552900       1.359200       1.368400    


%chk=000088321-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000088321

0 1
S 3.564291 -1.152344 -0.147521
S 3.558461 1.178633 -0.105528
N -0.446571 0.009634 0.171147
C 0.988755 0.014038 -0.257465
C -1.176286 1.219671 -0.315856
C -1.167560 -1.228203 -0.254310
C -2.628254 1.262047 0.201530
C -2.620427 -1.251367 0.262852
C -3.401698 -0.007820 -0.209745
C 1.722601 -1.253128 0.251761
C 1.727813 1.240023 0.340057
H 1.089266 0.051793 -1.372671
H -1.182767 1.250492 -1.437864
H -0.650120 2.122166 0.036706
H -0.638799 -2.107676 0.148663
H -1.172094 -1.318964 -1.373150
H -3.122369 2.170905 -0.192324
H -2.610202 1.342750 1.305615
H -2.602671 -1.277218 1.369641
H -3.109143 -2.181486 -0.085522
H -4.421400 -0.000851 0.218615
H -3.512888 -0.034864 -1.313524
H 1.584736 -1.355257 1.340613
H 1.382722 -2.164237 -0.265921
H 1.375059 2.190082 -0.092095
H 1.608242 1.251180 1.435497


