%chk=000178449.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178449

0 1
 Br   2.065600      -1.537200      -2.435500    
 Br   3.210000       3.325000      0.2987000    
 O    1.689900      -2.588100      0.9339000    
 N    1.846800      0.7993000      0.8216000    
 N   -1.967900     -0.3189000       1.109600    
 N    2.728600      0.9686000      -1.209600    
 N   -2.768200      0.6946000      -1.380100    
 C  -0.4588000      -1.885300      3.4499999E-02
 C   0.8044000      -1.470700      0.8298000    
 C    1.580000     -0.3460000      0.1710000    
 C   -1.487300     -0.7684000     -5.0000001E-02
 C   -1.094500      -3.155900      0.6211000    
 C    2.112400     -0.2489000      -1.062800    
 C    2.549900       1.575400     -5.7399999E-02
 C   -1.858800     -0.2941000      -1.271100    
 C    1.473700       1.152400       2.172500    
 C   -2.877200      0.6700000       1.000700    
 C   -3.270300       1.167700     -0.2221000    
 C   -4.278200       2.260300     -0.3048000    
 H  -0.1810000      -2.177100     -0.9816000    
 H   0.5189000      -1.215800       1.855000    
 H  -0.4095000      -4.008000      0.5630000    
 H   -2.003700      -3.426700      7.2300002E-02
 H   -1.371700      -3.015800       1.672000    
 H    1.863200      -2.922100      3.6899999E-02
 H   -1.461500     -0.6683000      -2.206000    
 H   0.3828000       1.171700       2.234800    
 H    1.886900      0.4022000       2.852100    
 H    1.864500       2.131200       2.449900    
 H   -3.275700       1.045200       1.936100    
 H   -3.917400       3.151800      0.2179000    
 H   -4.474700       2.535800      -1.346100    
 H   -5.223900       1.941100      0.1442000    


%chk=000178449-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178449

0 1
Br 2.259091 -1.339386 -2.569046
Br 3.070286 3.417426 0.617280
O 1.776720 -2.745706 0.801749
N 1.793351 0.800637 0.917226
N -1.602090 -0.026217 0.982682
N 2.731886 1.133575 -1.129895
N -3.077060 0.462563 -1.399325
C -0.453074 -1.978523 -0.035551
C 0.853645 -1.591882 0.727925
C 1.545687 -0.374573 0.168987
C -1.413061 -0.805690 -0.133419
C -1.140765 -3.174546 0.674985
C 2.146194 -0.118034 -1.071205
C 2.501066 1.660692 0.080446
C -2.149323 -0.533804 -1.314689
C 1.376023 1.027251 2.310411
C -2.521030 0.975585 0.896576
C -3.279242 1.229016 -0.279699
C -4.309610 2.331231 -0.352465
H -0.178434 -2.284769 -1.063905
H 0.581656 -1.411789 1.780049
H -0.414753 -3.992717 0.816960
H -1.993800 -3.549265 0.081998
H -1.518749 -2.864696 1.666480
H 2.174127 -2.887858 -0.097847
H -1.990621 -1.127744 -2.221807
H 0.305070 0.784697 2.412245
H 1.970203 0.401122 2.998489
H 1.539392 2.085849 2.563011
H -2.657533 1.594139 1.791047
H -3.855830 3.320697 -0.158145
H -4.761130 2.342636 -1.356331
H -5.110993 2.185081 0.395288


