%chk=000165841.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165841

0 1
 I   -4.887000      -2.233100      0.6008000    
 S   0.3636000     -0.3174000      -1.279200    
 O   -3.495800       1.022300      0.9675000    
 N   0.8290000       1.377000      0.5858000    
 N   -2.173900     -0.1376000     -0.6073000    
 N  -0.5396000       1.171100      0.6011000    
 C    3.591100     -0.4208000      0.1995000    
 C    2.870300      0.6513000     -0.6226000    
 C    5.096800     -0.4024000     -6.3600004E-02
 C    1.389000      0.6613000     -0.3409000    
 C    5.822800      -1.438100      0.7800000    
 C  -0.9135000      0.3103000     -0.3213000    
 C   -3.369900      0.2322000      3.5599999E-02
 C   -4.582800     -0.4759000     -0.5356000    
 H    3.189100      -1.412900     -4.1600000E-02
 H    3.401900     -0.2556000       1.268000    
 H    3.057200      0.4980000      -1.692600    
 H    3.275600       1.640200     -0.3737000    
 H    5.291500     -0.5996000      -1.124200    
 H    5.502400      0.5908000      0.1619000    
 H    6.897500      -1.408300      0.5748000    
 H    5.462300      -2.447500      0.5577000    
 H    5.675500      -1.247700       1.847900    
 H   -2.226200     -0.8125000      -1.366000    
 H   -4.427400     -0.7046000      -1.594900    
 H   -5.441600      0.2003000     -0.4717000    


%chk=000165841-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165841

0 1
I -4.907770 -2.138040 -1.469962
S 0.435261 -0.878868 -0.985877
O -3.194148 0.947604 1.168307
N 0.770547 1.698721 -0.351493
N -2.288990 -0.215991 -0.674755
N -0.621289 1.509216 -0.341332
C 3.642475 -0.419075 0.204186
C 2.968594 0.571539 -0.784671
C 5.182818 -0.393003 0.085718
C 1.473989 0.616551 -0.673893
C 5.866655 -1.381199 1.054310
C -0.974787 0.262241 -0.634490
C -3.316383 0.162228 0.195109
C -4.714691 -0.400870 -0.084941
H 3.275311 -1.447551 0.011537
H 3.341359 -0.162711 1.238390
H 3.260781 0.305693 -1.820229
H 3.333145 1.597538 -0.594526
H 5.474440 -0.631497 -0.957606
H 5.546546 0.635173 0.285151
H 6.966813 -1.342810 0.957176
H 5.545805 -2.420856 0.854179
H 5.611870 -1.147585 2.104914
H -2.520052 -0.937279 -1.368380
H -5.341693 0.385351 -0.534952
H -5.158708 -0.733719 0.863531


