%chk=000049427.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049427

0 1
 Cl   1.885600       4.894100     -0.2752000    
 O   -5.344000      -1.994800     -0.6019000    
 O    5.433700      -1.822000     -0.6515000    
 N  -4.3000001E-03   1.351300      4.0899999E-02
 C   -1.328700       1.830700      0.4344000    
 C   0.3388000      0.1354000      0.7775000    
 C    1.002500       2.387500      0.2676000    
 C   -2.399900      0.8096000      0.1580000    
 C    1.698600     -0.3866000      0.3962000    
 C   0.6543000       3.634400     -0.5304000    
 C   -3.363300      0.5523000       1.123300    
 C    2.575600     -0.7972000       1.390200    
 C   -2.409200      0.1412000      -1.057900    
 C    2.054800     -0.4505000     -0.9434000    
 C   -4.356300     -0.3932000      0.8672000    
 C    3.835200      -1.281500       1.037200    
 C   -3.402400     -0.8042000      -1.314100    
 C    3.314400     -0.9349000      -1.296400    
 C   -4.375900      -1.071500     -0.3515000    
 C    4.204600      -1.350500     -0.3061000    
 C   -6.308500      -2.219300      0.4252000    
 C    6.294500      -2.230100      0.4107000    
 H   -1.338400       2.124000       1.492900    
 H   -1.647900       2.700400     -0.1478000    
 H   0.3017000      0.3256000       1.859400    
 H  -0.3580000     -0.6872000      0.5796000    
 H    1.072900       2.636700       1.335400    
 H    2.001600       2.074300     -5.2400000E-02
 H   0.6070000       3.428300      -1.604300    
 H  -0.2750000       4.111500     -0.2176000    
 H   -3.358400       1.075200       2.075400    
 H    2.298400     -0.7494000       2.439400    
 H   -1.669100      0.3442000      -1.826800    
 H    1.371300     -0.1465000      -1.731200    
 H   -5.081400     -0.5518000       1.658200    
 H    4.476900      -1.587500       1.856300    
 H   -3.414200      -1.327500      -2.266400    
 H    3.595400     -0.9892000      -2.344600    
 H   -6.900600      -1.319700      0.6249000    
 H   -5.844100      -2.620400       1.332500    
 H   -7.001400      -2.982800      5.6699999E-02
 H    5.875500      -3.076400      0.9656000    
 H    6.551200      -1.390500       1.065700    
 H    7.227800      -2.577100     -4.4799998E-02


%chk=000049427-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000049427

0 1
Cl 1.972754 4.849541 -1.023258
O -5.238800 -1.996312 -0.977995
O 5.112717 -2.136524 -0.900289
N -0.020476 1.568624 0.546380
C -1.428460 1.936923 0.841293
C 0.471337 0.430543 1.366744
C 0.897065 2.730553 0.488662
C -2.431531 0.874759 0.406121
C 1.725272 -0.215882 0.795529
C 0.917066 3.273673 -0.946270
C -3.484594 0.471437 1.256507
C 2.866397 -0.440249 1.597085
C -2.353952 0.294859 -0.889292
C 1.761002 -0.643276 -0.560188
C -4.447909 -0.479941 0.843344
C 4.020951 -1.077378 1.081610
C -3.297891 -0.652428 -1.318862
C 2.896734 -1.275311 -1.092329
C -4.351691 -1.043181 -0.452093
C 4.032750 -1.496415 -0.270418
C -6.338919 -2.439625 -0.119653
C 6.309893 -2.387583 -0.095867
H -1.577223 2.158861 1.927987
H -1.636837 2.881863 0.301996
H 0.661037 0.737527 2.425531
H -0.350412 -0.311107 1.394556
H 0.609941 3.539693 1.197513
H 1.915991 2.403999 0.757838
H 1.383251 2.561757 -1.641466
H -0.078898 3.575314 -1.304232
H -3.559852 0.901941 2.263226
H 2.861476 -0.114556 2.645048
H -1.531085 0.590266 -1.549951
H 0.883719 -0.466277 -1.192250
H -5.248856 -0.769988 1.530043
H 4.887916 -1.233065 1.730718
H -3.245137 -1.104724 -2.314069
H 2.932577 -1.610179 -2.133681
H -7.004929 -1.596903 0.151102
H -5.961064 -2.923565 0.802321
H -6.895623 -3.172883 -0.721364
H 6.086599 -3.049213 0.764084
H 6.755385 -1.441955 0.270599
H 7.013608 -2.889210 -0.776210


