%chk=000041455.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041455

0 1
 Cl  -1.462900      -4.501600     -0.2421000    
 S   -3.829200      -2.203900     -0.2208000    
 O    1.643000       1.394100     -3.5000001E-03
 N   -2.551000      0.5553000     -0.1133000    
 N   -4.208800       2.881400     -0.1015000    
 N  -0.3070000     -0.2090000     -9.0700001E-02
 N    1.908300     -0.9592000     -6.8200000E-02
 N   0.2072000      -2.562500     -0.1506000    
 C   -2.531800       1.467200       1.037500    
 C   -3.004200       1.140400      -1.378800    
 C   -3.865400       2.208300       1.157300    
 C   -4.322200       1.893300      -1.181100    
 C   -1.638900     -0.5060000     -0.1265000    
 C   -5.456500       3.630700      4.1499998E-02
 C   -2.085100      -1.829000     -0.1747000    
 C   0.5375000      -1.257800     -0.1048000    
 C   -1.117900      -2.813300     -0.1848000    
 C    2.368600      0.4006000     -1.8400000E-02
 C    2.933400      -2.045900     -7.9700001E-02
 C   -4.223400      -2.333700       1.545700    
 C    3.816300      0.6807000      3.0500000E-02
 C    4.514500      0.8416000      -1.154100    
 C    4.445300      0.7762000       1.260000    
 C    5.883300       1.106000      -1.107700    
 C    5.814100       1.040600       1.306400    
 C    6.533100       1.205600      0.1226000    
 H   -1.708200       2.183500      0.9238000    
 H   -2.357500      0.9069000       1.964500    
 H   -3.152500      0.3607000      -2.135500    
 H   -2.232100       1.821000      -1.760100    
 H   -4.653700       1.499700       1.445700    
 H   -3.776800       2.944500       1.965300    
 H   -4.574500       2.394400      -2.123500    
 H   -5.126200       1.176000     -0.9674000    
 H   -6.303800       2.983000      0.2945000    
 H   -5.693900       4.162100     -0.8868000    
 H   -5.359600       4.392600      0.8229000    
 H    3.965000      -1.700900     -5.4400001E-02
 H    2.793100      -2.635100     -0.9918000    
 H    2.763800      -2.681200      0.7956000    
 H   -5.284000      -2.570700       1.661700    
 H   -4.018200      -1.386700       2.051600    
 H   -3.633000      -3.127500       2.010900    
 H    4.015000      0.7649000      -2.115600    
 H    3.891700      0.6482000       2.185900    
 H    6.443200       1.234100      -2.029500    
 H    6.320100       1.117900       2.264300    
 H    7.598900       1.411300      0.1587000    


%chk=000041455-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000041455

0 1
Cl -1.476934 -4.694289 -1.262563
S -3.866119 -2.542548 -0.667413
O 1.540392 0.410308 1.752192
N -2.456172 0.461921 -0.352373
N -4.083924 2.841633 -0.097994
N -0.310064 -0.426274 -0.197997
N 1.911959 -1.213966 0.073677
N 0.236564 -2.744248 -0.590233
C -1.869173 1.730666 0.160392
C -3.605515 0.701696 -1.263574
C -2.964460 2.571948 0.834845
C -4.671784 1.571556 -0.577063
C -1.642703 -0.662436 -0.422012
C -5.093970 3.751185 0.475176
C -2.106113 -2.021863 -0.658785
C 0.553030 -1.462667 -0.219016
C -1.071257 -2.975502 -0.793908
C 2.299278 -0.091411 0.878488
C 2.879829 -2.295047 -0.249280
C -4.315824 -2.058196 1.109902
C 3.667449 0.480019 0.621178
C 4.235996 0.520418 -0.679105
C 4.348627 1.098745 1.700986
C 5.475895 1.160460 -0.891321
C 5.594999 1.723604 1.490437
C 6.162240 1.754933 0.193749
H -1.423631 2.302244 -0.679452
H -1.060615 1.489059 0.866410
H -4.046820 -0.256536 -1.575346
H -3.232314 1.237387 -2.162196
H -3.317246 2.039869 1.757092
H -2.523909 3.535637 1.150937
H -5.469342 1.799408 -1.308467
H -5.136900 0.989030 0.261737
H -5.597401 3.337153 1.385718
H -5.872712 3.964661 -0.278856
H -4.616890 4.707678 0.753808
H 3.877772 -2.001775 0.104066
H 2.909549 -2.486226 -1.335186
H 2.570150 -3.228876 0.248002
H -5.397853 -2.238135 1.208402
H -4.086485 -0.994882 1.277422
H -3.755882 -2.693838 1.810938
H 3.694616 0.077569 -1.522473
H 3.879503 1.089725 2.690398
H 5.902716 1.201726 -1.899304
H 6.121026 2.190676 2.330086
H 7.127522 2.246598 0.028880


