%chk=000044193.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044193

0 1
 Cl   3.570400      -3.796700      3.2499999E-02
 F   -2.197200      0.5190000      -2.099000    
 O  -0.8683000      -1.146800     -0.3570000    
 O   0.4005000       3.668600      0.4645000    
 N    1.852400       1.944200     -0.1263000    
 N  -0.7235000      0.7115000      0.9647000    
 C    2.222300      0.5520000     -8.5600004E-02
 C    1.301800     -0.4878000      0.1630000    
 C  -0.1395000     -0.2351000      0.3242000    
 C   0.7951000       2.507000      0.5997000    
 C   0.1590000       1.634600       1.651600    
 C    3.559900      0.1848000     -0.3379000    
 C    1.726800      -1.828000      0.2049000    
 C    2.657200       2.840100     -0.9590000    
 C    3.974500      -1.149500     -0.3023000    
 C    3.059700      -2.155000     -2.3300000E-02
 C   -2.222100     -0.8843000     -0.1872000    
 C   -2.859200     -4.4399999E-02  -1.079200    
 C   -2.889100      -1.473200      0.8689000    
 C   -4.218700      0.2170000     -0.9083000    
 C   -4.248700      -1.211600       1.039800    
 C   -4.913300     -0.3664000      0.1513000    
 H   0.9085000       1.142600       2.282000    
 H  -0.4367000       2.268200       2.317800    
 H    4.323400      0.9321000     -0.5394000    
 H    1.013700      -2.623100      0.4154000    
 H    2.123800       3.772600      -1.165900    
 H    2.883000       2.364500      -1.918800    
 H    3.578400       3.092600     -0.4249000    
 H    5.019800      -1.382800     -0.4884000    
 H   -2.373800      -2.132800       1.560500    
 H   -4.735900      0.8751000      -1.600100    
 H   -4.789600      -1.666100       1.864600    
 H   -5.971800     -0.1627000      0.2845000    


%chk=000044193-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000044193

0 1
Cl 3.553954 -3.888538 0.047319
F -2.205635 0.968191 -1.551169
O -0.948646 -1.090120 -0.076197
O 0.952687 3.951022 0.512727
N 1.980067 1.980467 -0.194669
N -0.590998 0.920360 1.083216
C 2.310422 0.596012 -0.042954
C 1.332968 -0.423622 0.204434
C -0.091340 -0.088978 0.441898
C 1.097977 2.704635 0.639587
C 0.340956 1.887775 1.694826
C 3.661524 0.199396 -0.253009
C 1.724713 -1.788807 0.215710
C 2.727131 2.776985 -1.200810
C 4.048448 -1.151848 -0.221388
C 3.066274 -2.135316 0.013315
C -2.352825 -0.885124 0.004318
C -2.989800 0.115589 -0.759874
C -3.135513 -1.768891 0.770005
C -4.383791 0.267076 -0.760521
C -4.543365 -1.638362 0.774230
C -5.165459 -0.620197 0.015522
H 1.077462 1.379706 2.355406
H -0.238252 2.605120 2.293212
H 4.423481 0.961381 -0.438298
H 0.961457 -2.554851 0.370283
H 2.105496 3.644710 -1.468519
H 2.919303 2.157273 -2.090704
H 3.683278 3.161193 -0.798607
H 5.093550 -1.434050 -0.376323
H -2.632793 -2.545853 1.354035
H -4.836377 1.060546 -1.362398
H -5.148649 -2.327981 1.370878
H -6.254906 -0.514702 0.021817


