%chk=000049530.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049530

0 1
 Cl   1.138200       4.754300     -0.5830000    
 N   -3.504400     -0.5193000     -0.6562000    
 N   0.2816000     -0.3859000     -0.6386000    
 C   -2.133000     -0.3916000     -0.1112000    
 C   -1.980600      0.9428000      0.6468000    
 C   -1.054600     -0.4469000      -1.202600    
 C   -3.026000       1.096500       1.743900    
 C   -4.513100     -0.4292000      0.4142000    
 C   -4.420200      0.8934000       1.171500    
 C   0.9785000      0.7759000     -0.4107000    
 C    1.017100      -1.482700     -0.2599000    
 C   -3.700300      -1.768900      -1.396900    
 C    2.210200      0.4161000      0.1365000    
 C    2.234500      -1.011700      0.2320000    
 C   0.6144000       2.106600     -0.6460000    
 C   0.6988000      -2.844500     -0.3151000    
 C    3.126000       1.437300      0.4660000    
 C    3.183400      -1.948400      0.6932000    
 C    1.538600       3.100100     -0.3120000    
 C    1.654900      -3.752800      0.1474000    
 C    2.776500       2.772700      0.2360000    
 C    2.879500      -3.313600      0.6445000    
 H   -1.956800      -1.209800      0.6023000    
 H   -2.092300       1.787800     -4.1000001E-02
 H   -1.018900       1.012000       1.158700    
 H   -1.165600      0.3728000      -1.922100    
 H   -1.102500      -1.368700      -1.789900    
 H   -2.948700       2.088500       2.202800    
 H   -2.841900      0.3594000       2.535200    
 H   -4.406500      -1.265300       1.118200    
 H   -5.519400     -0.4956000     -1.7800000E-02
 H   -5.158700      0.9097000       1.981100    
 H   -4.666200       1.723200      0.4970000    
 H   -3.122100      -1.778500      -2.325500    
 H   -4.746500      -1.875400      -1.707500    
 H   -3.431700      -2.648300     -0.8008000    
 H  -0.3264000       2.370300      -1.114800    
 H  -0.2534000      -3.199600     -0.6943000    
 H    4.095300       1.197600      0.8941000    
 H    4.143000      -1.621400       1.083700    
 H    1.437700      -4.817500      0.1196000    
 H    3.490800       3.551300      0.4938000    
 H    3.608200      -4.037700      0.9993000    


%chk=000049530-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000049530

0 1
Cl 1.435999 4.878095 -1.042328
N -3.541944 -0.444332 -0.695484
N 0.275100 -0.302681 -0.600320
C -2.195589 -0.447491 -0.048151
C -2.064098 0.741434 0.932141
C -1.087643 -0.374806 -1.140953
C -3.188228 0.749563 1.987798
C -4.639506 -0.460512 0.314857
C -4.558625 0.734325 1.280249
C 1.075730 0.848833 -0.489191
C 1.018149 -1.409485 -0.137906
C -3.735951 -1.546369 -1.667334
C 2.357175 0.478546 0.054560
C 2.319501 -0.960475 0.278124
C 0.769888 2.184636 -0.831881
C 0.644100 -2.769064 -0.068994
C 3.340730 1.473522 0.255687
C 3.253997 -1.897893 0.775984
C 1.783656 3.133317 -0.615965
C 1.596366 -3.686308 0.425912
C 3.056356 2.814132 -0.081285
C 2.886889 -3.258450 0.847129
H -2.051236 -1.398940 0.533983
H -2.109304 1.682881 0.348920
H -1.073755 0.697481 1.419863
H -1.277595 0.514147 -1.768589
H -1.134978 -1.259306 -1.800753
H -3.091463 1.636293 2.641760
H -3.097520 -0.144379 2.639127
H -4.618143 -1.411554 0.911569
H -5.600027 -0.440367 -0.233408
H -5.384118 0.666846 2.014491
H -4.693667 1.671846 0.707088
H -3.092981 -1.418598 -2.554104
H -4.782037 -1.530370 -2.020075
H -3.538139 -2.558748 -1.230019
H -0.198844 2.482580 -1.239696
H -0.347348 -3.110568 -0.383549
H 4.321757 1.216198 0.668816
H 4.249974 -1.575710 1.099552
H 1.334899 -4.748574 0.489637
H 3.799976 3.601912 0.064980
H 3.599893 -3.996610 1.229659


