%chk=000063950.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063950

0 1
 Cl  0.4587000       5.672400     -7.5999998E-02
 O   -4.112300       1.347800       1.223700    
 O    5.348600      0.8196000      0.9762000    
 O    6.332100      -1.778200       1.062800    
 N   -2.443700      0.5263000     -0.2235000    
 N   0.4029000     -0.7433000      -1.060200    
 N   -2.505200      -1.740300     -0.9106000    
 C   -1.955200     -0.5648000     -0.9391000    
 C  -0.7586000     -0.4141000      -1.856100    
 C   -4.268600     -0.8797000      0.5553000    
 C    1.632300     -0.6237000      -1.839600    
 C   -3.621000      0.4501000      0.5443000    
 C   -3.669300      -1.923000     -0.1541000    
 C   -1.749900       1.755700     -0.1885000    
 C    2.886000     -0.9285000      -1.064600    
 C   -5.445100      -1.092800       1.283000    
 C   -4.265600      -3.189200     -0.1268000    
 C    3.542900      9.6000001E-02 -0.3971000    
 C  -0.7713000       1.962400      0.7745000    
 C   -2.056100       2.741300      -1.117600    
 C    3.368200      -2.229500      -1.028500    
 C   -6.028000      -2.359100       1.300500    
 C   -5.438600      -3.407000      0.5972000    
 C    4.705100     -0.1862000      0.3208000    
 C    5.198800      -1.490200      0.3640000    
 C    4.530300      -2.511800     -0.3108000    
 C  -8.6400002E-02   3.177000      0.8094000    
 C   -1.371100       3.955900      -1.082800    
 C  -0.3861000       4.173800     -0.1194000    
 C    4.957500       1.068700       2.325100    
 C    7.568800      -1.685600      0.3586000    
 H  -0.6963000      0.5961000      -2.267200    
 H  -0.8678000      -1.111500      -2.695500    
 H    1.715700      0.3936000      -2.245500    
 H    1.588500      -1.288100      -2.713300    
 H   0.3203000      -1.699200     -0.7131000    
 H   -5.918500     -0.2900000       1.841200    
 H   -3.819400      -4.015900     -0.6747000    
 H    3.159800       1.112900     -0.4270000    
 H  -0.5308000       1.192200       1.502500    
 H   -2.821700       2.580400      -1.871800    
 H    2.854000      -3.032800      -1.548700    
 H   -6.940900      -2.528800       1.863800    
 H   -5.892600      -4.393500      0.6106000    
 H    4.908500      -3.530100     -0.2802000    
 H   0.6790000       3.332300       1.565300    
 H   -1.615300       4.723400      -1.812800    
 H    5.565300       1.891300       2.711600    
 H    5.129900      0.1841000       2.946200    
 H    3.903400       1.360600       2.370600    
 H    7.727700     -0.6669000     -9.2000002E-03
 H    7.589000      -2.394000     -0.4756000    
 H    8.376900      -1.937200       1.050900    


%chk=000063950-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000063950

0 1
Cl 0.222246 6.068729 -1.238603
O -4.047327 1.747862 0.981243
O 4.560055 -0.005911 1.910701
O 6.540490 -1.873140 0.829783
N -2.451542 0.679940 -0.394794
N 0.456665 -0.776349 -1.211447
N -2.491797 -1.706783 -0.759538
C -1.973725 -0.509468 -0.990508
C -0.794349 -0.455105 -1.945098
C -4.153059 -0.667113 0.755073
C 1.667860 -0.731642 -2.070714
C -3.599679 0.673116 0.492031
C -3.575248 -1.816092 0.128943
C -1.799576 1.964328 -0.615463
C 2.930906 -1.049228 -1.282546
C -5.256729 -0.813500 1.636039
C -4.116792 -3.103176 0.398772
C 3.181324 -0.417923 -0.039160
C -0.466994 2.159767 -0.187131
C -2.524089 3.018737 -1.216210
C 3.883539 -1.969683 -1.783983
C -5.780465 -2.090264 1.896338
C -5.206622 -3.236202 1.274663
C 4.360636 -0.683405 0.683777
C 5.338389 -1.573096 0.146798
C 5.080452 -2.223645 -1.077490
C 0.157462 3.411377 -0.382190
C -1.909474 4.274033 -1.408824
C -0.575685 4.448791 -0.989674
C 4.638999 -0.889429 3.098163
C 7.455207 -0.719844 1.006399
H -0.688746 0.547457 -2.394631
H -1.012644 -1.180259 -2.761023
H 1.730005 0.295122 -2.487449
H 1.597976 -1.422881 -2.945581
H 0.366449 -1.686959 -0.735987
H -5.674638 0.087095 2.097409
H -3.662055 -3.968067 -0.093460
H 2.447157 0.270792 0.390141
H 0.085609 1.326213 0.257024
H -3.564670 2.868115 -1.515586
H 3.696425 -2.483394 -2.734184
H -6.630573 -2.207124 2.576529
H -5.620599 -4.229383 1.480699
H 5.833376 -2.919664 -1.460987
H 1.190051 3.572953 -0.060432
H -2.459442 5.098627 -1.870222
H 4.836357 -0.219267 3.948582
H 5.452366 -1.629288 2.989001
H 3.674592 -1.411327 3.246096
H 6.954610 0.104230 1.545649
H 7.808427 -0.362939 0.020365
H 8.303688 -1.106833 1.590894


