%chk=000087862.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087862

0 1
 S  -0.9809000     -0.7216000      0.7202000    
 N   -3.212800     -0.8195000     -0.6777000    
 N   -2.630600       1.301200      0.1839000    
 C    1.748600     -0.2955000      0.2997000    
 C    2.887300      0.4498000     -0.4017000    
 C   0.3574000      0.2114000     -7.9800002E-02
 C    4.238700     -0.1622000     -6.4700000E-02
 C   -2.407700      3.6400001E-02  2.0099999E-02
 H    1.885700     -0.2120000       1.385500    
 H    1.821900      -1.362300      5.1100001E-02
 H    2.739200      0.4164000      -1.487200    
 H    2.878200       1.504600     -0.1040000    
 H   0.2695000       1.267200      0.1964000    
 H   0.2230000      0.1400000      -1.164700    
 H    5.039100      0.3859000     -0.5714000    
 H    4.287600      -1.207800     -0.3853000    
 H    4.429100     -0.1232000       1.012500    
 H   -4.063500     -0.4958000      -1.124800    
 H   -2.982000      -1.802700     -0.7698000    
 H   -1.879900       1.702900      0.7551000    


%chk=000087862-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000087862

0 1
S -0.942992 -0.962005 0.470242
N -3.544392 -0.862163 -0.234786
N -2.530581 1.229178 -0.538662
C 1.797510 -0.410329 0.169948
C 2.954308 0.540275 -0.225102
C 0.421623 0.239590 -0.057691
C 4.340730 -0.106555 -0.015560
C -2.447081 -0.020655 -0.183513
H 1.905707 -0.695708 1.235142
H 1.868924 -1.344098 -0.421265
H 2.839956 0.837208 -1.287319
H 2.885245 1.472311 0.371653
H 0.323044 1.160482 0.544981
H 0.263155 0.478760 -1.123887
H 5.153939 0.585185 -0.301202
H 4.446112 -1.023479 -0.625104
H 4.491686 -0.387506 1.043602
H -4.439504 -0.455467 -0.500449
H -3.447937 -1.869840 -0.145795
H -1.691553 1.808017 -0.381833


