%chk=000154094.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154094

0 1
 Br  -1.551800       3.142300     -1.2800000E-02
 O    4.280400      0.9353000     -0.7573000    
 N    7.332600     -0.6375000      0.5827000    
 C   -1.247100      0.2526000     -0.1285000    
 C   0.1871000      0.4304000     -0.2918000    
 C    6.432500     -4.8400000E-02 -0.4081000    
 C    5.115100      0.3536000      0.2354000    
 C   -1.850800      -1.118400     -9.5500000E-02
 C    2.928800      0.7689000     -0.6034000    
 C   0.7344000      0.5487000      -1.569300    
 C    1.015400      0.4818000      0.8294000    
 C   -2.088500       1.331000      6.9999998E-04
 C    2.110100      0.7184000      -1.725600    
 C    2.391000      0.6516000      0.6730000    
 C   -3.546000       1.156700      0.1678000    
 C   -1.973400      -1.749700       1.118300    
 C   -2.255400      -1.683300      -1.280200    
 C    7.581800      0.3061000       1.671800    
 C    8.591500      -1.038100     -4.4599999E-02
 C   -2.535900      -3.025800       1.149200    
 C   -2.818000      -2.959400      -1.249300    
 C   -4.070300       1.043800       1.443300    
 C   -4.353200       1.111200     -0.9551000    
 C   -2.958100      -3.630500     -3.4499999E-02
 C   -5.446600      0.8798000       1.601100    
 C   -5.729400      0.9473000     -0.7973000    
 C   -6.276100      0.8316000      0.4808000    
 H    6.223300     -0.7721000      -1.206600    
 H    6.884000      0.8239000     -0.9003000    
 H    5.249000       1.114000       1.010500    
 H    4.664100     -0.5467000      0.6742000    
 H   0.1032000      0.5118000      -2.454000    
 H   0.6038000      0.3987000       1.832600    
 H    2.532500      0.8102000      -2.722200    
 H    2.995400      0.7171000       1.572400    
 H   -1.647300      -1.287400       2.045300    
 H   -2.150000      -1.169300      -2.231000    
 H    6.712700      0.4114000       2.328500    
 H    7.888100       1.294700       1.310500    
 H    8.380200     -6.8300001E-02   2.324600    
 H    9.244800      -1.533100      0.6826000    
 H    9.132300     -0.1847000     -0.4699000    
 H    8.409200      -1.764400     -0.8446000    
 H   -2.645200      -3.548200       2.095000    
 H   -3.147100      -3.430200      -2.170900    
 H   -3.435200       1.081200       2.324300    
 H   -3.940200       1.201400      -1.956200    
 H   -3.396300      -4.623900     -1.0500000E-02
 H   -5.872100      0.7898000       2.596200    
 H   -6.375400      0.9097000      -1.669600    
 H   -7.347600      0.7038000      0.6036000    


%chk=000154094-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154094

0 1
Br -1.111956 2.906735 -0.261956
O 4.340871 -0.570274 -0.565389
N 7.636931 0.321703 0.946995
C -1.366621 -0.018585 -0.266149
C 0.123525 -0.116364 -0.324043
C 6.661420 -0.309189 0.027712
C 5.226025 0.040547 0.443877
C -2.113107 -1.313179 -0.444421
C 2.959825 -0.386633 -0.420620
C 0.756306 -0.849212 -1.368713
C 0.947049 0.455020 0.679364
C -2.063788 1.155704 -0.088193
C 2.153689 -0.976667 -1.427039
C 2.350991 0.324449 0.644587
C -3.495745 1.317775 0.268479
C -1.664793 -2.489624 0.217818
C -3.236582 -1.409519 -1.310713
C 7.894488 1.743126 0.635001
C 8.890167 -0.447592 1.082697
C -2.338699 -3.717453 0.043609
C -3.904476 -2.638617 -1.491424
C -4.042605 0.535514 1.325869
C -4.341649 2.247023 -0.397502
C -3.463621 -3.797791 -0.810489
C -5.399340 0.663844 1.687760
C -5.699317 2.370400 -0.036818
C -6.235863 1.578715 1.006348
H 6.778465 -1.406442 0.078444
H 6.816281 -0.013068 -1.038105
H 5.063513 1.136935 0.464890
H 5.011569 -0.372608 1.448408
H 0.140934 -1.314444 -2.146390
H 0.484498 1.004445 1.505670
H 2.642643 -1.525011 -2.237890
H 2.950493 0.771111 1.443153
H -0.786774 -2.435321 0.870769
H -3.576693 -0.518334 -1.848192
H 6.948029 2.310016 0.605472
H 8.412650 1.887816 -0.346979
H 8.525844 2.187321 1.425101
H 9.528316 0.021722 1.853189
H 9.485018 -0.506179 0.136038
H 8.664153 -1.477490 1.410461
H -1.984112 -4.610856 0.569890
H -4.765512 -2.693491 -2.166942
H -3.395710 -0.169392 1.857838
H -3.927761 2.872185 -1.195853
H -3.983579 -4.752117 -0.950876
H -5.801770 0.055669 2.505482
H -6.338128 3.086252 -0.565990
H -7.289193 1.680828 1.290466


