%chk=000133754.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133754

0 1
 Br   3.003600      -6.181500      0.6826000    
 Cl   5.042600       5.147300      0.3991000    
 O   -2.597500      -1.701900      0.2977000    
 O   -1.722200      0.7664000      -2.146800    
 O   -2.218000      0.9529000       1.465900    
 O   -4.638400      0.3415000     -1.3800000E-02
 O  -0.4474000      -1.404800     -0.6540000    
 O  -0.1784000       2.303300      -1.377800    
 O  -0.3107000      0.6259000       2.727800    
 O   -4.807300       2.493000     -0.8381000    
 O    2.648500     -0.8306000      -1.852800    
 N    2.617000     -0.2374000      0.4170000    
 C   -2.470400      0.9036000     -0.9409000    
 C   -1.591100      0.5251000      0.2583000    
 C   -3.708200      9.6000005E-03  -1.041700    
 C   -1.360400     -0.9867000      0.3555000    
 C   -3.345100      -1.464900     -0.8956000    
 C   0.3473000      -2.477200     -0.3546000    
 C  -0.5939000       1.529400      -2.229600    
 C   -1.527200      0.6910000       2.614000    
 C   -5.110000       1.624200     -3.1399999E-02
 C    1.734400      -2.355800     -0.3532000    
 C  -0.2527000      -3.696000     -4.9100000E-02
 C   8.5900001E-02   1.282700      -3.542400    
 C   -2.488100      0.4891000       3.746300    
 C   -6.072700       1.827700       1.099100    
 C    2.527200      -3.461200     -4.4300001E-02
 C   0.5402000      -4.801300      0.2598000    
 C    2.377300      -1.087900     -0.6700000    
 C    1.930000      -4.683900      0.2622000    
 C    3.198700       1.054300      0.4126000    
 C    3.346900       1.733000       1.610000    
 C    3.605900       1.608200     -0.7888000    
 C    3.919800       3.004800       1.605700    
 C    4.178800       2.880000     -0.7930000    
 C    4.335900       3.578300      0.4043000    
 H   -2.714600       1.961500     -0.8395000    
 H  -0.6068000      0.9907000      0.2355000    
 H   -4.201700      0.1391000      -2.013700    
 H  -0.9306000      -1.253200       1.325600    
 H   -2.774500      -1.824000      -1.759400    
 H   -4.254700      -2.070400     -0.8225000    
 H   -1.330300      -3.821100     -6.4999998E-02
 H    1.017600       1.854500      -3.580800    
 H   0.3281000      0.2213000      -3.640000    
 H  -0.5605000       1.607900      -4.361100    
 H   -1.930100      0.2745000       4.662000    
 H   -3.075600       1.397700       3.900000    
 H   -3.141500     -0.3598000       3.529400    
 H   -6.440800       2.857400       1.081400    
 H   -6.923500       1.150900      0.9875000    
 H   -5.565300       1.655600       2.051800    
 H    3.610800      -3.365000     -4.3499999E-02
 H   5.9300002E-02  -5.748100      0.4919000    
 H    2.336700     -0.5784000       1.334600    
 H    3.025300       1.295400       2.551000    
 H    3.517100       1.134200      -1.754700    
 H    4.035500       3.537300       2.546300    
 H    4.498100       3.316000      -1.736300    


%chk=000133754-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133754

0 1
Br 2.552649 -6.946903 -0.272309
Cl 5.285067 4.983382 -0.560985
O -2.458268 -1.876731 0.176609
O -1.318040 1.197226 -1.482541
O -2.429438 0.706867 2.017108
O -4.591573 0.064864 -0.159793
O -0.080028 -1.353690 0.107973
O -0.636104 3.165657 -0.438203
O -0.492896 0.741616 3.319491
O -5.192248 2.149461 -1.017545
O 3.891442 -1.832609 -1.309446
N 2.408842 -0.342918 -0.268389
C -2.295130 0.992871 -0.376666
C -1.579647 0.376676 0.844400
C -3.375277 0.093642 -1.012932
C -1.383338 -1.160424 0.799678
C -2.889326 -1.345014 -1.137757
C 0.499578 -2.652760 0.067775
C -0.551814 2.386807 -1.411372
C -1.728756 0.899680 3.231417
C -5.434775 1.188622 -0.255033
C 1.858253 -2.745807 -0.361120
C -0.231486 -3.816530 0.405135
C 0.342645 2.520185 -2.615977
C -2.679053 1.322914 4.322689
C -6.608818 1.039989 0.681495
C 2.440600 -4.036017 -0.465273
C 0.375221 -5.086656 0.319648
C 2.795660 -1.603588 -0.705877
C 1.708473 -5.182873 -0.126226
C 3.136688 0.872731 -0.358297
C 2.599218 2.003886 0.318079
C 4.351129 1.008261 -1.087702
C 3.244719 3.254275 0.258298
C 5.000513 2.260270 -1.142779
C 4.441164 3.366854 -0.476612
H -2.708640 1.971237 -0.078310
H -0.595652 0.854045 0.988706
H -3.632214 0.518296 -2.000545
H -1.309381 -1.582118 1.817626
H -2.050527 -1.392696 -1.856935
H -3.701160 -2.016234 -1.452564
H -1.282048 -3.744801 0.692890
H 0.487648 3.586385 -2.848690
H 1.334914 2.092343 -2.381434
H -0.071145 1.985884 -3.483907
H -2.191887 1.216151 5.302474
H -2.958062 2.382253 4.176853
H -3.604751 0.726159 4.285554
H -7.342542 1.835419 0.488314
H -7.078255 0.049665 0.560642
H -6.257372 1.110890 1.726479
H 3.475807 -4.085445 -0.815243
H -0.194953 -5.982050 0.582308
H 1.473217 -0.299669 0.156684
H 1.680560 1.912081 0.909715
H 4.773186 0.137316 -1.591204
H 2.821193 4.118691 0.776394
H 5.934512 2.366183 -1.702270


