%chk=000132442.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132442

0 1
 Br   2.363400      -1.592800       1.271100    
 Br   3.361600       2.842600       1.305800    
 O   -9.062900     -0.3894000      -1.054400    
 O   -8.132200     -0.7690000      0.9826000    
 C    2.028000      0.3451000       1.067500    
 C   0.8320000      0.5539000      0.1266000    
 C    3.349500      0.9932000      0.6111000    
 C  -0.5116000      0.1971000      0.7780000    
 C    3.573900       1.018500     -0.9091000    
 C   -1.675400      0.4398000     -0.1875000    
 C    5.006700       1.333700      -1.368800    
 C   -3.010600      3.7500001E-02  0.4428000    
 C    6.104100      0.4102000     -0.8373000    
 C   -4.208700      0.2389000     -0.4901000    
 C    5.947700      -1.086000      -1.127800    
 C   -5.547300     -0.1405000      0.1508000    
 C    7.100900      -1.965400     -0.6352000    
 C   -6.719000      4.9000001E-03 -0.8157000    
 C    7.219700      -2.039900      0.8790000    
 C   -8.019700     -0.4326000     -0.1894000    
 H    1.771100      0.6579000       2.086300    
 H   0.9516000     -3.1599998E-02 -0.7932000    
 H   0.7864000       1.609300     -0.1689000    
 H    4.193600      0.5317000       1.131600    
 H  -0.6535000      0.8018000       1.682000    
 H  -0.5177000     -0.8536000       1.087700    
 H    2.903000       1.746600      -1.382600    
 H    3.305400      4.1600000E-02  -1.328800    
 H   -1.706700       1.498600     -0.4712000    
 H   -1.518700     -0.1378000      -1.106400    
 H    5.024700       1.297200      -2.465500    
 H    5.258500       2.365900      -1.098100    
 H   -2.966800      -1.016800      0.7435000    
 H   -3.167500      0.6214000       1.358300    
 H    6.206000      0.5651000      0.2420000    
 H    7.055800      0.7441000      -1.271200    
 H   -4.058800     -0.3609000      -1.396300    
 H   -4.247200       1.288300     -0.8073000    
 H    5.015000      -1.454500     -0.6883000    
 H    5.854600      -1.219200      -2.212800    
 H   -5.716900      0.4856000       1.035700    
 H   -5.493800      -1.176900      0.5081000    
 H    8.046500      -1.605200      -1.056900    
 H    6.949800      -2.981100      -1.020200    
 H   -6.821600       1.050700      -1.124900    
 H   -6.545500     -0.6142000      -1.702800    
 H    6.281700      -2.379900       1.329400    
 H    8.007300      -2.745900       1.161000    
 H    7.475900      -1.066800       1.307900    
 H   -9.902900     -0.6648000     -0.6293000    


%chk=000132442-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000132442

0 1
Br 2.248034 -1.968618 0.834411
Br 3.262252 2.677169 1.051602
O -9.330501 0.132941 -0.964800
O -8.459570 -0.840831 0.953780
C 1.965952 0.096890 0.865271
C 0.725703 0.454700 0.040902
C 3.307401 0.694681 0.413177
C -0.607082 0.001451 0.673143
C 3.618289 0.642068 -1.085658
C -1.832065 0.415631 -0.172485
C 5.022817 1.152822 -1.492656
C -3.171016 -0.067429 0.427966
C 6.215311 0.456315 -0.791081
C -4.398587 0.343983 -0.415267
C 6.293418 -1.070633 -1.031040
C -5.731466 -0.161870 0.178135
C 7.576048 -1.727899 -0.462856
C -6.942472 0.255433 -0.677416
C 7.677120 -1.670180 1.078906
C -8.267176 -0.219822 -0.113881
H 1.810203 0.271920 1.942189
H 0.820231 0.039157 -0.979939
H 0.723487 1.561009 -0.060227
H 4.127134 0.292982 1.027877
H -0.698025 0.436192 1.690360
H -0.599152 -1.099107 0.797423
H 2.849372 1.209354 -1.642176
H 3.509160 -0.420656 -1.385319
H -1.853429 1.520565 -0.278504
H -1.723678 0.005058 -1.198377
H 5.121747 1.016772 -2.588760
H 5.075831 2.242393 -1.302833
H -3.148743 -1.172430 0.528156
H -3.280735 0.335696 1.456166
H 6.186220 0.671479 0.295585
H 7.152226 0.921290 -1.161110
H -4.279243 -0.047755 -1.447468
H -4.426987 1.450546 -0.503268
H 5.410342 -1.573564 -0.585571
H 6.243290 -1.259525 -2.124043
H -5.858048 0.225254 1.207260
H -5.707818 -1.264957 0.268277
H 8.465613 -1.238013 -0.909864
H 7.607454 -2.787841 -0.785245
H -6.996627 1.357945 -0.777324
H -6.855110 -0.130977 -1.711746
H 6.789571 -2.136690 1.548082
H 8.572039 -2.209526 1.440030
H 7.745914 -0.629733 1.445291
H -10.185250 -0.187240 -0.566272


