%chk=000056783.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056783

0 1
 Br  0.4303000      -2.718700       3.534900    
 O  -0.5905000     -0.8721000       1.259300    
 O    1.589000     -0.2679000     -0.1609000    
 O   0.2847000      -1.182900      -1.819100    
 N    5.209500     -0.6423000     -0.7422000    
 C  -0.7830000     -6.6000000E-02  7.9000004E-02
 C  -0.6393000       1.414600      0.4383000    
 C   -2.155900     -0.3476000     -0.5363000    
 C   0.3910000     -0.5885000     -0.7528000    
 C  -0.1264000       2.313000     -0.4975000    
 C   -3.228600     -0.6999000      0.2829000    
 C   -1.021000       1.865900       1.701900    
 C   -2.334400     -0.2524000      -1.916600    
 C  -0.6651000      -2.248000      0.9436000    
 C    2.758900     -0.6688000     -0.8619000    
 C    3.978800     -0.2343000     -6.5499999E-02
 C   4.8000002E-03   3.662400     -0.1696000    
 C   -4.479600     -0.9568000     -0.2782000    
 C  -0.8900000       3.215400       2.029600    
 C   -3.585400     -0.5092000      -2.477500    
 C  -0.3770000       4.113600       1.094000    
 C   -4.657900     -0.8615000      -1.658400    
 C  -0.9543000      -3.043200       2.199000    
 C    5.521900      0.2786000      -1.834300    
 C    6.319300     -0.7033000      0.2084000    
 H   0.1674000       1.988100      -1.491800    
 H   -3.124500     -0.7600000       1.362600    
 H   -1.430700       1.187200       2.445000    
 H   -1.542400      7.4400000E-02  -2.582700    
 H   -1.416600      -2.526100      0.1997000    
 H   0.3056000      -2.594000      0.5654000    
 H    2.753200      -1.759400     -0.9805000    
 H    2.744300     -0.2029000      -1.852800    
 H    3.950800      0.8444000      0.1391000    
 H    3.904000     -0.7173000      0.9188000    
 H   0.4017000       4.362600     -0.8990000    
 H   -5.316300      -1.225600      0.3600000    
 H   -1.189100       3.567200       3.012600    
 H   -3.728100     -0.4218000      -3.550600    
 H  -0.2760000       5.164500       1.348700    
 H   -5.632900      -1.057200      -2.094700    
 H  -0.9700000      -4.119300       2.009800    
 H   -1.891200      -2.732000       2.668900    
 H    4.744900      0.2732000      -2.604800    
 H    6.445900     -2.8999999E-02  -2.337700    
 H    5.655600       1.308800      -1.484000    
 H    6.115500      -1.439200      0.9943000    
 H    6.510700      0.2662000      0.6827000    
 H    7.237800      -1.029800     -0.2919000    


%chk=000056783-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056783

0 1
Br 0.596316 -3.438067 3.185684
O -0.954746 -1.144393 1.322478
O 1.580003 -0.148652 -0.302781
O 0.469764 -1.917374 -1.308830
N 5.304904 -0.240654 -0.670301
C -0.820726 -0.300267 0.088625
C -0.600977 1.133049 0.604148
C -2.100659 -0.392496 -0.759689
C 0.445659 -0.866461 -0.618901
C -0.817133 2.231214 -0.263729
C -3.325442 -0.106037 -0.098651
C -0.149964 1.370347 1.924299
C -2.124810 -0.706390 -2.139185
C -1.332268 -2.552591 1.118513
C 2.882103 -0.729068 -0.757604
C 3.966505 0.219846 -0.233600
C -0.584371 3.550676 0.181145
C -4.547485 -0.136755 -0.799001
C 0.070683 2.691710 2.371887
C -3.351582 -0.727189 -2.844943
C -0.141222 3.786825 1.503010
C -4.565139 -0.445783 -2.180810
C -1.297357 -3.226195 2.478353
C 5.619562 0.126763 -2.066415
C 6.383377 0.149751 0.260057
H -1.176584 2.058330 -1.284487
H -3.304932 0.146344 0.967726
H 0.020006 0.520008 2.589368
H -1.198610 -0.952532 -2.664577
H -2.370740 -2.610242 0.724711
H -0.658524 -3.049629 0.396274
H 2.992534 -1.742517 -0.336179
H 2.866180 -0.804421 -1.859354
H 3.738761 1.263345 -0.561608
H 3.927773 0.212819 0.870117
H -0.755443 4.392049 -0.499920
H -5.482731 0.086883 -0.273663
H 0.413301 2.865401 3.398398
H -3.355044 -0.970825 -3.913277
H 0.033052 4.811151 1.851759
H -5.513010 -0.465292 -2.730264
H -1.694165 -4.251462 2.424603
H -1.822567 -2.637501 3.245042
H 4.839514 -0.248739 -2.751046
H 6.576183 -0.338214 -2.363959
H 5.707889 1.232928 -2.217669
H 6.156205 -0.223701 1.273874
H 6.541015 1.256339 0.323097
H 7.334347 -0.309232 -0.065526


