%chk=000030053.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030053

0 1
 Br   3.529900      -2.997700      2.8500000E-02
 Br   2.589300       2.665400     -0.5671000    
 O  -0.3614000     -0.4171000     -0.3676000    
 O   0.7776000      0.7701000       1.220900    
 N   -4.021100     -0.3284000      6.3699998E-02
 N    1.880000     -0.3853000     -0.4909000    
 C   -5.050400      -1.296600     -0.3401000    
 C   -4.412000       1.042500     -0.2937000    
 C   -6.392300     -0.9848000      0.3245000    
 C   -5.733000       1.430700      0.3720000    
 C   -6.840200      0.4414000      2.6500000E-02
 C   -2.733800     -0.6677000     -0.5423000    
 C   -1.590100     -4.8300002E-02  0.2450000    
 C   0.7841000      6.1900001E-02  0.2215000    
 C    3.246800     -0.1315000     -0.2354000    
 C    4.118000      -1.191500      1.4800000E-02
 C    3.724300       1.179100     -0.2336000    
 C    5.466900     -0.9411000      0.2667000    
 C    5.073100       1.429500      1.8300001E-02
 C    5.944500      0.3694000      0.2685000    
 H   -4.752000      -2.307700     -3.7000000E-02
 H   -5.171300      -1.304800      -1.431400    
 H   -4.507900       1.150100      -1.382400    
 H   -3.659800       1.765900      3.7200000E-02
 H   -6.305400      -1.121400       1.409900    
 H   -7.152500      -1.691800     -2.6699999E-02
 H   -6.026100       2.437800      5.4200001E-02
 H   -5.599900       1.464900       1.460900    
 H   -7.092700      0.5313000      -1.037200    
 H   -7.746800      0.6777000      0.5942000    
 H   -2.682400     -0.3814000      -1.601100    
 H   -2.576900      -1.755100     -0.5284000    
 H   -1.602400     -0.4136000       1.279400    
 H   -1.654600       1.044500      0.2535000    
 H    1.697100      -1.215700      -1.050100    
 H    6.161600      -1.753600      0.4641000    
 H    5.464500       2.443700      2.4100000E-02
 H    6.994800      0.5645000      0.4646000    


%chk=000030053-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000030053

0 1
Br 3.516636 -3.031356 -0.125597
Br 2.717301 2.743709 -0.699747
O -0.338132 -0.419318 -0.466725
O 0.860824 0.747009 1.195487
N -4.053876 -0.297568 -0.059586
N 1.917189 -0.371929 -0.605480
C -5.104109 -1.316326 -0.314590
C -4.511952 1.063075 -0.442700
C -6.385527 -0.992174 0.480285
C -5.775123 1.464804 0.345452
C -6.900477 0.425186 0.137977
C -2.738138 -0.647847 -0.642646
C -1.610596 -0.085017 0.232100
C 0.826280 0.061446 0.150652
C 3.267921 -0.112615 -0.262420
C 4.172190 -1.184376 -0.008920
C 3.804608 1.205377 -0.192558
C 5.521356 -0.974350 0.329513
C 5.143731 1.440718 0.180593
C 5.999587 0.349689 0.441776
H -4.711230 -2.304728 -0.011661
H -5.358052 -1.376301 -1.406678
H -4.733819 1.111268 -1.542645
H -3.698916 1.784781 -0.243244
H -6.154818 -1.050463 1.561586
H -7.158191 -1.753520 0.258661
H -6.107032 2.469823 0.020772
H -5.518966 1.525682 1.420568
H -7.232558 0.449859 -0.921041
H -7.781379 0.677779 0.757916
H -2.615822 -0.276722 -1.688782
H -2.640469 -1.748253 -0.676846
H -1.612940 -0.547811 1.233737
H -1.671417 1.011117 0.351377
H 1.714751 -1.075616 -1.319479
H 6.179818 -1.826259 0.517856
H 5.517052 2.466503 0.240805
H 7.041796 0.530022 0.722231


