%chk=000096549.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096549

0 1
 Cl   5.818300       3.632000     -0.4643000    
 Cl   6.242100      -2.945800     -0.9834000    
 F   -7.672500     -0.2994000     -5.7500001E-02
 N    4.168400      0.1209000      0.5724000    
 N   -2.241200      0.6823000      0.2759000    
 C    2.766400     -6.0000001E-03  0.4855000    
 C    4.779100       1.426500      0.7245000    
 C    5.015900      -1.054000      0.5250000    
 C    2.187600      -1.266500      0.3378000    
 C   0.8011000      -1.391400      0.2502000    
 C    1.958600       1.129500      0.5457000    
 C  -6.6000000E-03 -0.2558000      0.3104000    
 C   0.5721000       1.004700      0.4583000    
 C    5.050300       2.036200     -0.6420000    
 C    5.217800      -1.491800     -0.9174000    
 C   0.2075000      -2.753300      9.3199998E-02
 C   -1.456900     -0.3576000      0.2216000    
 C   -3.620800      0.4343000      0.1769000    
 C   -4.251300      0.4207000      -1.064400    
 C   -4.350700      0.2016000       1.339600    
 C   -5.621600      0.1726000      -1.143700    
 C   -3.485900      0.6679000      -2.323000    
 C   -5.721100     -4.6500001E-02   1.260200    
 C   -6.356500     -6.1000001E-02  1.8500000E-02
 H    5.740900       1.314200       1.244000    
 H    4.215700       2.096400       1.383200    
 H    4.638800      -1.863100       1.162100    
 H    5.999900     -0.8178000      0.9523000    
 H    2.774100      -2.177300      0.2890000    
 H    2.343100       2.138600      0.6398000    
 H  -2.9500000E-02   1.908700      0.5040000    
 H    5.735700       1.425100      -1.232400    
 H    4.132200       2.173900      -1.220300    
 H    4.282300      -1.731900      -1.428400    
 H    5.726300     -0.7254000      -1.506000    
 H   0.9778000      -3.532100      6.3000001E-02
 H  -0.4494000      -2.988900      0.9371000    
 H  -0.3531000      -2.825300     -0.8448000    
 H   -1.904800      -1.359700      0.1030000    
 H   -3.864900      0.2114000       2.311600    
 H   -6.132300      0.1565000      -2.102800    
 H   -2.911000       1.597200      -2.250300    
 H   -2.803300     -0.1643000      -2.523300    
 H   -4.149300      0.7690000      -3.188900    
 H   -6.293600     -0.2284000       2.164800    


%chk=000096549-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096549

0 1
Cl 5.596628 3.727285 -1.199559
Cl 6.599960 -3.169407 -0.016790
F -7.885599 -0.137377 -0.001801
N 4.225476 0.200580 0.522817
N -2.276974 0.338692 -0.126012
C 2.835757 -0.016382 0.403453
C 4.795833 1.552943 0.377198
C 5.148127 -0.914656 0.801061
C 2.275884 -1.325691 0.525004
C 0.888672 -1.566918 0.441924
C 1.932260 1.069059 0.166619
C -0.002177 -0.467065 0.219254
C 0.555624 0.836008 0.085635
C 4.963136 1.949987 -1.103296
C 5.527481 -1.683713 -0.480697
C 0.384642 -2.995737 0.586975
C -1.453014 -0.656068 0.126177
C -3.682698 0.160519 -0.098325
C -4.471868 0.916288 -1.029414
C -4.329649 -0.668374 0.865025
C -5.879115 0.795180 -0.985483
C -3.796092 1.805117 -2.051630
C -5.734217 -0.778131 0.909875
C -6.475871 -0.045149 -0.029643
H 5.781597 1.580297 0.872665
H 4.162606 2.298748 0.890269
H 4.699669 -1.612319 1.530987
H 6.065118 -0.514753 1.267478
H 2.927769 -2.188847 0.691525
H 2.297757 2.093651 0.054538
H -0.138104 1.665423 -0.086423
H 5.714400 1.337096 -1.622781
H 4.009862 1.938919 -1.650788
H 4.649631 -2.095294 -0.999163
H 6.136857 -1.081854 -1.170840
H 1.225101 -3.694680 0.733585
H -0.293852 -3.106353 1.453657
H -0.172710 -3.327766 -0.308536
H -1.831167 -1.689566 0.260206
H -3.725588 -1.193674 1.613077
H -6.511081 1.351173 -1.684996
H -3.007077 2.409548 -1.570658
H -3.292673 1.204148 -2.832446
H -4.521122 2.472919 -2.547092
H -6.243500 -1.396906 1.654068


