%chk=000115875.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115875

0 1
 Cl   1.290500      -4.532300     -0.9237000    
 S   -3.457000      -1.018100       1.245400    
 N   -1.179800      6.3000000E-03 -0.7027000    
 N  -0.1958000      0.4500000      -1.544300    
 N    1.249800       1.132000      0.1887000    
 N    1.785500       1.352900      -2.140200    
 N    3.425800      0.8300000      0.6760000    
 N    2.548700       3.057900      0.6540000    
 C   -1.126000      -1.363500     -0.2810000    
 C   -2.188500      0.9465000     -0.3083000    
 C   -2.082900      -1.924000      0.5813000    
 C   -3.244500      0.6014000      0.5515000    
 C  -8.3499998E-02  -2.208600     -0.7321000    
 C   -2.147700       2.278900     -0.7855000    
 C   -1.986700      -3.274800      0.9667000    
 C   -4.211300       1.560700      0.9088000    
 C   3.8000001E-03  -3.547200     -0.3445000    
 C   -3.110900       3.223400     -0.4250000    
 C  -0.9497000      -4.081400      0.5071000    
 C   -4.144900       2.863500      0.4241000    
 C   0.9742000      0.9905000      -1.084300    
 C    5.734000      0.2015000       1.153100    
 C    4.740700       1.349800       1.027100    
 C    2.466600       1.687800      0.5297000    
 C    5.889400     -0.5831000     -0.1418000    
 H   0.6819000      -1.831100      -1.407600    
 H   -1.363500       2.615600      -1.459600    
 H  -0.3721000      0.3583000      -2.540300    
 H   -2.724200      -3.716900       1.634600    
 H   -5.033100       1.301600       1.574200    
 H   -3.049200       4.236500     -0.8112000    
 H  -0.9025000      -5.120200      0.8221000    
 H   -4.898400       3.591300      0.7091000    
 H    6.710200      0.6021000       1.449600    
 H    5.410700     -0.4834000       1.946100    
 H    4.699300       1.879000       1.986700    
 H    5.097700       2.048700      0.2607000    
 H    2.697300       1.772500      -1.996000    
 H    1.493800       1.208000      -3.100700    
 H    6.650100      -1.361000     -2.0700000E-02
 H    4.954300      -1.073500     -0.4299000    
 H    6.202400      7.1500003E-02 -0.9615000    
 H    1.731400       3.640600      0.5068000    
 H    3.412800       3.531100      0.8925000    


%chk=000115875-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000115875

0 1
Cl 0.447209 -4.921822 0.989739
S -4.254778 -0.685493 -0.209730
N -1.246410 -0.297157 -0.844671
N -0.059894 -0.225748 -1.575775
N 1.274891 0.284405 0.295026
N 2.259407 0.152217 -1.882158
N 3.649418 0.700700 0.187928
N 2.405375 0.750025 2.255719
C -1.549668 -1.526422 -0.176218
C -1.953921 0.927150 -0.583476
C -2.879588 -1.811512 0.238017
C -3.325538 0.898508 -0.216860
C -0.535896 -2.485715 0.072469
C -1.310313 2.184009 -0.702387
C -3.179960 -3.013342 0.910017
C -4.025860 2.091224 0.055485
C -0.874577 -3.693411 0.704686
C -2.023344 3.379213 -0.468634
C -2.179086 -3.984160 1.141212
C -3.380947 3.341057 -0.081216
C 1.196885 0.084371 -1.021188
C 6.063578 1.191806 -0.109585
C 4.905285 1.013950 0.894260
C 2.513266 0.586535 0.880632
C 5.871475 2.410128 -1.036764
H 0.496878 -2.277353 -0.206068
H -0.250657 2.222133 -0.960633
H -0.146425 -0.368472 -2.584497
H -4.207557 -3.206070 1.234899
H -5.078340 2.039003 0.354191
H -1.507320 4.339426 -0.574524
H -2.412494 -4.928360 1.638977
H -3.933420 4.266009 0.112510
H 7.011790 1.295716 0.454794
H 6.146178 0.267364 -0.713684
H 5.170065 0.198993 1.608270
H 4.808383 1.951242 1.494389
H 3.164123 0.387319 -1.331967
H 2.180968 -0.024276 -2.882981
H 6.688183 2.484668 -1.778014
H 4.913178 2.335252 -1.580914
H 5.853734 3.351483 -0.455048
H 1.483659 0.633823 2.669593
H 3.210765 0.952383 2.839179


