%chk=000045211.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045211

0 1
 Cl   1.892800       4.659600     -0.4382000    
 N  -4.3000001E-03   1.138200      3.4800000E-02
 C   -1.327700       1.637300      0.4067000    
 C   0.3364000     -4.4500001E-02  0.8246000    
 C    1.004700       2.181300      0.2153000    
 C   -2.401000      0.6071000      0.1759000    
 C    1.695100     -0.5857000      0.4668000    
 C   0.6590000       3.392400     -0.6372000    
 C   -2.412200     -0.1150000      -1.009300    
 C    2.051600     -0.7099000     -0.8687000    
 C   -3.364400      0.3941000       1.152100    
 C    2.572000     -0.9527000       1.478100    
 C   -4.380200      -1.291900     -0.2490000    
 C    4.199900      -1.583500     -0.1920000    
 C   -3.406900      -1.069300      -1.222800    
 C    3.310300      -1.211400      -1.199800    
 C   -4.359000     -0.5604000      0.9385000    
 C    3.830800      -1.454100       1.147000    
 C   -5.443000      -2.313000     -0.4769000    
 C    5.546100      -2.118600     -0.5461000    
 H   -1.645200       2.481000     -0.2136000    
 H   -1.336700       1.977400       1.451000    
 H  -0.3621000     -0.8736000      0.6634000    
 H   0.2998000      0.1934000       1.896900    
 H    2.003100       1.852200     -9.0499997E-02
 H    1.075700       2.477600       1.271000    
 H   0.6111000       3.138900      -1.701000    
 H  -0.2693000       3.884800     -0.3459000    
 H   -1.672300      5.2900001E-02  -1.786800    
 H    1.368300     -0.4406000      -1.669200    
 H   -3.359400      0.9583000       2.080300    
 H    2.295900     -0.8584000       2.524400    
 H   -3.415500      -1.629800      -2.153900    
 H    3.584600      -1.312000      -2.246600    
 H   -5.113000     -0.7236000       1.704000    
 H    4.514400      -1.742300       1.941100    
 H   -5.076300      -3.131500      -1.105700    
 H   -5.772500      -2.758300      0.4680000    
 H   -6.306400      -1.853200     -0.9678000    
 H    5.501700      -3.207100     -0.6518000    
 H    5.907200      -1.689000      -1.486700    
 H    6.285000      -1.870600      0.2235000    


%chk=000045211-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000045211

0 1
Cl 1.862104 4.642984 -1.114356
N -0.024373 1.330226 0.517167
C -1.432463 1.671165 0.836522
C 0.503192 0.205712 1.332635
C 0.868324 2.510279 0.436349
C -2.429146 0.597531 0.409793
C 1.770166 -0.411138 0.753912
C 0.848319 3.042088 -1.002798
C -2.328499 -0.020963 -0.862613
C 1.834702 -0.783249 -0.613942
C -3.504884 0.229715 1.251273
C 2.896247 -0.664894 1.571371
C -4.363611 -1.346522 -0.437932
C 4.124239 -1.651679 -0.323864
C -3.278715 -0.975226 -1.277735
C 2.990790 -1.391941 -1.141668
C -4.459571 -0.726283 0.832090
C 4.055189 -1.278949 1.040715
C -5.374932 -2.387114 -0.888069
C 5.370685 -2.297474 -0.904934
H -1.668581 2.615064 0.306795
H -1.568002 1.883568 1.926592
H -0.296772 -0.559390 1.366343
H 0.692775 0.516354 2.390172
H 1.898612 2.207090 0.688688
H 0.577589 3.318162 1.144882
H 1.318752 2.335691 -1.700819
H -0.161875 3.314663 -1.343922
H -1.489248 0.250989 -1.513051
H 0.968096 -0.584332 -1.254755
H -3.599629 0.692017 2.242303
H 2.869302 -0.382499 2.631598
H -3.183155 -1.441019 -2.266931
H 3.019268 -1.675002 -2.201729
H -5.285659 -0.995785 1.501461
H 4.916524 -1.465802 1.693639
H -4.913140 -3.390687 -0.957700
H -6.222913 -2.458563 -0.185214
H -5.782253 -2.147709 -1.887839
H 5.127443 -3.233866 -1.440700
H 5.867770 -1.627247 -1.632086
H 6.105430 -2.539463 -0.117739


