%chk=000108720.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108720

0 1
 Cl   2.369000      -3.537300     -0.3017000    
 S  -0.8433000      -2.787500     -0.3040000    
 N   -1.171900      0.2310000     -0.1061000    
 N   -3.791500       1.369900     -9.6199997E-02
 N    1.144500      0.7308000     -3.4600001E-02
 N    2.799100      -1.019000     -0.1232000    
 N    3.435100       1.233800      3.9999999E-02
 C   -1.641500      0.9870000       1.061800    
 C   -1.844100      0.5376000      -1.372400    
 C   -3.167900      0.9317000       1.158600    
 C   -3.364300      0.4979000      -1.197000    
 C   0.1568000     -0.2082000     -0.1142000    
 C   -5.248800       1.365000      2.6400000E-02
 C   0.4573000      -1.569900     -0.1998000    
 C    2.408900      0.2675000     -4.3699998E-02
 C    1.793400      -1.915100     -0.2003000    
 C    3.173700       2.636100      0.1307000    
 C   -1.141700      -3.156200       1.447500    
 C    4.477300       3.405000      0.2282000    
 H   -1.303500       2.028300      0.9846000    
 H   -1.216500      0.5684000       1.982400    
 H   -1.558800     -0.1836000      -2.147600    
 H   -1.528200       1.529700      -1.719100    
 H   -3.482200     -9.0099998E-02   1.411600    
 H   -3.482800       1.583400       1.982700    
 H   -3.825600      0.8260000      -2.136300    
 H   -3.686300     -0.5371000      -1.019300    
 H   -5.644300      0.3661000      0.2435000    
 H   -5.713200       1.726400     -0.8978000    
 H   -5.569400       2.043800      0.8245000    
 H    4.386500      0.8845000      3.1599998E-02
 H    2.622100       2.980000     -0.7520000    
 H    2.565300       2.855900       1.015700    
 H   -1.930200      -3.908800       1.528100    
 H   -1.461900      -2.254800       1.976700    
 H  -0.2340000      -3.546700       1.915000    
 H    5.047700       3.102500       1.113000    
 H    5.105700       3.228100     -0.6513000    
 H    4.282700       4.479700      0.2984000    


%chk=000108720-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108720

0 1
Cl 2.558809 -3.530314 -1.145807
S -0.640383 -3.045540 -0.653428
N -1.145561 0.198790 -0.308808
N -3.848090 1.226084 -0.176219
N 1.132388 0.676105 -0.062002
N 2.893928 -0.951029 -0.501492
N 3.405587 1.210879 0.214327
C -1.413687 1.556676 0.229061
C -2.169871 -0.210526 -1.306669
C -2.829579 1.607170 0.828504
C -3.577766 -0.133345 -0.696982
C 0.169893 -0.263380 -0.349536
C -5.226295 1.375955 0.327447
C 0.541921 -1.641770 -0.611088
C 2.438822 0.295630 -0.114326
C 1.939680 -1.864876 -0.707545
C 3.118402 2.594909 0.617259
C -1.235600 -2.975755 1.145671
C 4.425693 3.345857 0.919178
H -1.324706 2.310564 -0.580792
H -0.655602 1.792557 0.990309
H -1.969200 -1.234748 -1.651073
H -2.114251 0.484350 -2.171917
H -2.867149 0.936223 1.727329
H -3.035688 2.639178 1.169388
H -4.321186 -0.369380 -1.480851
H -3.671158 -0.909920 0.107142
H -5.454398 0.712218 1.200131
H -5.943998 1.138816 -0.478243
H -5.397093 2.421859 0.639646
H 4.370845 0.887832 0.137711
H 2.551895 3.103362 -0.187348
H 2.459460 2.590105 1.507287
H -2.025780 -3.737816 1.236798
H -1.640531 -1.975075 1.361563
H -0.396198 -3.212934 1.815643
H 4.983835 2.863376 1.742600
H 5.080352 3.385978 0.029004
H 4.205459 4.383738 1.222531


