%chk=000117052.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117052

1 1
 S    1.391300       2.062100      0.4371000    
 O   -3.330400      -2.356100      0.4639000    
 N   -2.753300      0.3581000     -8.6800002E-02
 C   -4.094400     -0.1937000     -0.2564000    
 C   -2.198900      0.3446000       1.133100    
 C   -2.121100      0.8594000      -1.156600    
 C  -0.2502000       1.387300      0.2296000    
 C   -4.002300      -1.673700     -0.5862000    
 C  -0.9255000      0.8618000       1.323900    
 C  -0.8458000       1.390100      -1.025100    
 C    2.399200      0.6210000      0.1472000    
 C    2.833800      0.3218000      -1.144100    
 C    2.753900     -0.2075000       1.211800    
 C    3.623000     -0.8059000      -1.370700    
 C    3.543200      -1.335100      0.9853000    
 C    3.977600      -1.634300     -0.3061000    
 H   -4.647300     -2.7500000E-02  0.6757000    
 H   -4.608200      0.3599000      -1.049900    
 H   -2.777400     -7.3799998E-02   1.948000    
 H   -2.639400      0.8273000      -2.107400    
 H   -4.998200      -2.110200     -0.7088000    
 H   -3.437500      -1.838900      -1.508700    
 H  -0.4843000      0.8482000       2.315800    
 H  -0.3405000       1.793600      -1.897300    
 H    2.568100      0.9556000      -1.986600    
 H    2.425300      9.3000000E-03   2.225400    
 H    3.961300      -1.039000      -2.376000    
 H    3.819500      -1.980200       1.814100    
 H    4.592000      -2.512300     -0.4825000    
 H   -3.865700      -2.252700       1.269100    


%chk=000117052-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117052

1 1
S 1.394414 1.222850 1.424886
O -5.017619 -0.671494 1.464676
N -2.744868 0.023584 -0.231348
C -4.106509 -0.358204 -0.726221
C -2.627969 0.843575 0.876508
C -1.611433 -0.456205 -0.856181
C -0.189467 0.718086 0.737200
C -4.807711 -1.366297 0.194120
C -1.374619 1.200613 1.368849
C -0.337030 -0.129126 -0.398511
C 2.611963 0.352876 0.329562
C 3.144495 1.037224 -0.786363
C 3.051611 -0.942225 0.686021
C 4.129649 0.395756 -1.573472
C 4.036333 -1.571936 -0.110606
C 4.572640 -0.905227 -1.237518
H -4.718588 0.557279 -0.790888
H -4.000472 -0.780510 -1.738622
H -3.562705 1.162202 1.338677
H -1.765047 -1.096869 -1.727382
H -5.768207 -1.645515 -0.284174
H -4.191911 -2.279702 0.324269
H -1.322611 1.852545 2.244809
H 0.536363 -0.524777 -0.922581
H 2.811769 2.051276 -1.029635
H 2.649012 -1.443401 1.572019
H 4.554836 0.917365 -2.436695
H 4.390115 -2.572307 0.158007
H 5.342277 -1.392777 -1.844593
H -5.510912 -1.239461 2.105987


