%chk=000113970.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113970

0 1
 Cl   2.459200      -2.703100      -1.207800    
 S   -1.461300      0.5385000      0.8413000    
 N   0.1739000       1.858800     -0.7712000    
 N   -4.242800      -2.300700      5.4900002E-02
 N   -2.130100       2.578200     -0.6782000    
 C   -2.734800     -0.3828000     -4.9600001E-02
 C   -3.215100      -1.564000      0.7845000    
 C    1.104900      0.9426000     -0.2711000    
 C    1.294500     -0.2809000     -0.9137000    
 C    1.844300       1.253000      0.8703000    
 C   -1.052400       1.798100     -0.3404000    
 C    2.223500      -1.194100     -0.4147000    
 C    2.773200      0.3399000       1.369100    
 C    2.963000     -0.8835000      0.7266000    
 H   -3.578700      0.2778000     -0.2744000    
 H   -2.315400     -0.7301000      -1.000500    
 H   -2.385400      -2.243400       1.011100    
 H   -3.640200      -1.220100       1.734100    
 H   0.7174000     -0.5185000      -1.804800    
 H    1.706000       2.204500       1.377200    
 H    3.349100      0.5819000       2.257600    
 H    3.690600      -1.585000       1.126600    
 H   -4.522400      -3.116700      0.5976000    
 H   -3.855200      -2.657300     -0.8178000    
 H   -2.039800       3.332000      -1.350600    
 H   -3.036100       2.451900     -0.2411000    


%chk=000113970-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000113970

0 1
Cl 4.845775 -1.038625 -1.817378
S -1.626300 0.123726 0.828029
N 0.271092 1.276834 -0.946207
N -5.245345 -1.881727 0.540374
N -1.947406 1.895491 -1.270633
C -3.396107 -0.289337 0.236425
C -3.877138 -1.560624 0.971473
C 1.394476 0.672457 -0.355238
C 2.406919 0.179367 -1.228969
C 1.602323 0.598273 1.053874
C -0.973505 1.191795 -0.583257
C 3.562073 -0.395526 -0.680062
C 2.781284 0.019359 1.567868
C 3.780860 -0.493913 0.708614
H -4.080642 0.543980 0.468011
H -3.358448 -0.459104 -0.852795
H -3.145008 -2.378325 0.793337
H -3.886342 -1.370033 2.060379
H 2.262439 0.255964 -2.309430
H 0.855201 1.016816 1.736451
H 2.931624 -0.031028 2.651797
H 4.696647 -0.942266 1.102462
H -5.889052 -2.199858 1.264410
H -5.330828 -2.392034 -0.339803
H -1.645744 2.464681 -2.060666
H -2.898949 1.970657 -0.924066


