%chk=000015646.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015646

0 1
 Cl  -5.172700      -2.763100      -1.304300    
 F   -2.550200       2.965000       1.957100    
 O    1.687800     -0.6049000       2.415600    
 N    3.158200     -0.1435000     -0.6732000    
 N    5.823800      0.9695000     -0.5569000    
 N   0.2905000      -1.684900      0.8953000    
 N   -1.152400      0.7789000       1.929700    
 C    4.327100     -0.9187000      -1.106000    
 C    3.394100       1.291900     -0.8703000    
 C    1.956700     -0.5746000      -1.385000    
 C    5.588100     -0.4662000     -0.3618000    
 C    4.654300       1.744700     -0.1249000    
 C    1.654200      -2.057500      -1.151100    
 C    1.406100      -2.428100      0.3098000    
 C    7.024400       1.400200      0.1567000    
 C   -1.022000      -1.891900      0.3460000    
 C   0.5563000     -0.8622000       1.996200    
 C   -2.030600     -0.9063000      0.3677000    
 C  -0.6446000     -0.3172000       2.727400    
 C   -1.782000      0.4878000      0.8418000    
 C   -1.330600      -3.126400     -0.2594000    
 C   -3.316100      -1.190100     -0.1286000    
 C   -2.268600       1.628700      1.3300000E-02
 C   -2.603800      -3.393500     -0.7688000    
 C   -3.599900      -2.430200     -0.6922000    
 C   -2.630800       2.822100      0.6263000    
 C   -2.353200       1.484100      -1.366200    
 C   -3.084400       3.887000     -0.1521000    
 C   -2.807100       2.549000      -2.144500    
 C   -3.172800       3.750400      -1.537500    
 H    4.482700     -0.8280000      -2.189500    
 H    4.216900      -1.982000     -0.8740000    
 H    2.541800       1.863800     -0.4835000    
 H    3.490800       1.530900      -1.938100    
 H    1.097300      2.4100000E-02  -1.059900    
 H    2.062900     -0.4044000      -2.464700    
 H    5.492300     -0.7054000      0.7063000    
 H    6.441300      -1.036800     -0.7488000    
 H    4.816200       2.808600     -0.3361000    
 H    4.497400       1.646500      0.9579000    
 H   0.7708000      -2.299200      -1.754100    
 H    2.436300      -2.703100      -1.564400    
 H    1.235200      -3.503400      0.4242000    
 H    2.321200      -2.243300      0.8838000    
 H    7.902100      0.8506000     -0.2013000    
 H    6.940700       1.248900       1.239000    
 H    7.221500       2.461900     -2.8700000E-02
 H   -1.386600      -1.094500       2.940700    
 H  -0.3157000      6.9499999E-02   3.698200    
 H  -0.6124000      -3.938200     -0.3203000    
 H   -4.104700     -0.4418000     -7.4699998E-02
 H   -2.802600      -4.366600      -1.210900    
 H   -2.043200      0.5771000      -1.876700    
 H   -3.368500       4.822400      0.3207000    
 H   -2.867900       2.445900      -3.224000    
 H   -3.524300       4.580200      -2.143700    


%chk=000015646-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000015646

0 1
Cl -5.276190 -2.706268 -1.165196
F -2.716465 3.047292 1.742139
O 1.835898 -1.047670 2.633848
N 3.039767 -0.259360 -0.865194
N 5.498801 1.179667 -0.388774
N 0.338663 -1.789810 0.988239
N -0.880584 0.843472 1.856010
C 4.255192 -0.548146 -1.659329
C 3.019657 1.155804 -0.422564
C 1.786433 -0.729560 -1.489040
C 5.516413 -0.232574 -0.836398
C 4.277055 1.458456 0.407654
C 1.521077 -2.228071 -1.204876
C 1.444340 -2.529883 0.305728
C 6.732939 1.556480 0.325661
C -1.007171 -1.962934 0.528865
C 0.671482 -1.058096 2.153523
C -1.923652 -0.868085 0.382442
C -0.484609 -0.255202 2.766767
C -1.561024 0.529861 0.773260
C -1.426080 -3.263408 0.129989
C -3.222337 -1.115662 -0.144760
C -1.991005 1.647311 -0.125059
C -2.713477 -3.500793 -0.381408
C -3.602108 -2.413027 -0.509415
C -2.493334 2.878102 0.367083
C -1.866273 1.529643 -1.537423
C -2.836109 3.953940 -0.469597
C -2.198013 2.594172 -2.400459
C -2.678818 3.812286 -1.865599
H 4.278637 0.056760 -2.601573
H 4.263828 -1.617944 -1.940870
H 2.122911 1.321638 0.202305
H 2.981038 1.862038 -1.289552
H 0.953276 -0.135345 -1.068164
H 1.774016 -0.559713 -2.594943
H 5.562826 -0.939189 0.032326
H 6.415706 -0.395820 -1.460697
H 4.280840 2.525933 0.697432
H 4.241298 0.841701 1.340466
H 0.596508 -2.542333 -1.728044
H 2.343195 -2.842663 -1.621084
H 1.352765 -3.617608 0.489671
H 2.371311 -2.178569 0.788272
H 7.608267 1.390470 -0.328556
H 6.892818 0.978594 1.271647
H 6.698729 2.630131 0.584730
H -1.331316 -0.942003 2.985213
H -0.115446 0.181927 3.705073
H -0.736364 -4.105438 0.235323
H -3.920607 -0.281877 -0.260574
H -3.021843 -4.509869 -0.669181
H -1.491215 0.588550 -1.954142
H -3.223430 4.874760 -0.023916
H -2.079403 2.476554 -3.482207
H -2.937512 4.645082 -2.527573


