%chk=000128803.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128803

0 1
 Br   8.675600      -2.921700     -7.6000001E-03
 Cl   3.758400       1.546200       2.670000    
 O    4.773500       1.549500     -0.1599000    
 O   -3.950100     -0.7315000      -2.115800    
 O   -1.259900     -6.2300000E-02  -1.894100    
 O   -6.649700       2.353800      9.8399997E-02
 O   -4.784500       1.729200     -0.8762000    
 N  -0.6058000      0.2856000      0.3349000    
 N   -2.781400     -0.2844000     -0.1515000    
 N   -5.814200       1.471800     -0.2096000    
 N    5.170300     -0.7218000      4.8599999E-02
 N    6.975600      0.8426000     -0.2687000    
 C   0.7662000      0.6087000      0.2169000    
 C   -5.143300     -0.8861000     -0.1050000    
 C   -6.042500      0.1322000      0.2122000    
 C    1.499200      0.8849000       1.359700    
 C    1.349000      0.6422000      -1.039600    
 C    3.453400       1.241300     -1.5600000E-02
 C    2.852300       1.203500       1.242600    
 C    2.701800      0.9608000      -1.156600    
 C   -3.935700     -0.6245000     -0.8790000    
 C   -5.389600      -2.191600      0.3204000    
 C   -7.188000     -0.1553000      0.9545000    
 C   -1.505700     -2.1000000E-02 -0.6914000    
 C   -6.535100      -2.478800       1.062800    
 C   -7.434300      -1.460700       1.379900    
 C    5.683100      0.5072000     -0.1256000    
 C    6.084500      -1.713700      7.9000004E-02
 C    7.834400     -0.1972000     -0.2285000    
 C    7.442500      -1.508900     -5.5399999E-02
 H    1.025800      0.8540000       2.338200    
 H   0.8366000      0.4379000      -1.967800    
 H  -0.9737000      0.2774000       1.282800    
 H    3.163400      0.9898000      -2.140100    
 H   -4.697000      -2.994100      7.9800002E-02
 H   -7.913100      0.6091000       1.222300    
 H   -2.870200     -0.2276000      0.8598000    
 H   -6.727000      -3.495200       1.394000    
 H   -8.326000      -1.685000       1.958000    
 H    5.668500      -2.706400      0.2198000    
 H    8.878800      7.5199999E-02 -0.3445000    


%chk=000128803-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128803

0 1
Br 9.202825 -1.811883 1.991596
Cl 3.728965 2.204309 1.656009
O 4.856301 1.092468 -1.011288
O -4.301500 -0.809495 -2.269939
O -1.375545 -0.870746 -2.197174
O -5.379182 1.865007 2.375070
O -3.555976 0.589649 1.954279
N -0.702708 0.274345 -0.242878
N -2.900219 -0.447358 -0.417036
N -4.829491 0.843358 1.830905
N 5.434603 -0.594616 0.547124
N 7.097140 0.816987 -0.548485
C 0.691507 0.433501 -0.468813
C -5.348244 -0.808459 -0.098224
C -5.703025 -0.120150 1.104782
C 1.431501 1.116018 0.534766
C 1.354125 -0.043761 -1.631588
C 3.480539 0.817806 -0.766630
C 2.812097 1.306944 0.375384
C 2.741661 0.155501 -1.763920
C -4.129605 -0.670089 -1.031179
C -6.335739 -1.684564 -0.626786
C -6.969706 -0.288232 1.720862
C -1.626068 -0.384338 -1.070230
C -7.576923 -1.898761 0.002989
C -7.900928 -1.192636 1.183968
C 5.824527 0.402037 -0.292876
C 6.428773 -1.241871 1.217463
C 8.078245 0.158184 0.125321
C 7.782884 -0.888363 1.032016
H 0.937544 1.499462 1.434245
H 0.783495 -0.551313 -2.409842
H -1.068141 0.723969 0.601354
H 3.271203 -0.198521 -2.653402
H -6.102816 -2.171710 -1.578140
H -7.199642 0.292070 2.618450
H -2.941226 -0.276270 0.602904
H -8.292777 -2.600474 -0.436199
H -8.867547 -1.335852 1.676047
H 6.127625 -2.043607 1.898500
H 9.107550 0.476555 -0.067304


