%chk=000001243.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001243

0 1
 Br   5.138900     -0.4189000       1.140500    
 O    3.942200      -1.473900      -1.538000    
 N   -1.493600       2.350300     -7.7200003E-02
 C  -0.6516000      0.1537000      -1.095700    
 C   -1.026700       1.650600      -1.286400    
 C   0.7589000      4.3900002E-02 -0.5226000    
 C  -0.4171000       2.618300      0.8868000    
 C   0.1229000       1.358300       1.565900    
 C    1.115100      0.6038000      0.7192000    
 C   -1.704900     -0.7376000     -0.4262000    
 C    1.735700     -0.6513000      -1.262300    
 C   -2.135900       3.614100     -0.4566000    
 C    2.430400      0.4479000       1.191000    
 C   -1.299200      -1.830900      0.3294000    
 C   -3.053600     -0.4427000     -0.5825000    
 C    3.036700     -0.7931000     -0.7821000    
 C    3.383800     -0.2439000      0.4457000    
 C   -2.257100      -2.641800      0.9381000    
 C   -4.011600      -1.253500      2.6300000E-02
 C   -3.613200      -2.353200      0.7866000    
 H  -0.5996000     -0.2448000      -2.121400    
 H  -0.1861000       2.194900      -1.741000    
 H   -1.826700       1.683500      -2.039000    
 H  -0.8293000       3.242900       1.690700    
 H   0.3961000       3.195600      0.4266000    
 H  -0.6902000      0.6939000       1.880400    
 H   0.6105000       1.670200       2.499200    
 H    1.478400      -1.091400      -2.223700    
 H   -1.440400       4.294600     -0.9610000    
 H   -2.541100       4.123300      0.4252000    
 H   -2.986800       3.431200      -1.122600    
 H    2.706500      0.8764000       2.152800    
 H  -0.2570000      -2.102500      0.4592000    
 H   -3.399900      0.3920000      -1.182300    
 H   -1.947700      -3.500500       1.526700    
 H   -5.067900      -1.031800     -9.5200002E-02
 H   -4.359100      -2.985600       1.258900    
 H    4.791900      -1.480900      -1.064200    


%chk=000001243-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001243

0 1
Br 5.175542 -0.441392 1.332590
O 4.000743 -1.515662 -1.439199
N -1.491179 2.445981 -0.204680
C -0.633160 0.162305 -1.100261
C -1.063038 1.634209 -1.368379
C 0.767069 0.047052 -0.486416
C -0.445207 2.705598 0.812018
C 0.037347 1.430099 1.549922
C 1.072124 0.627240 0.780954
C -1.673761 -0.718988 -0.373714
C 1.768466 -0.653006 -1.190759
C -2.137057 3.699519 -0.648853
C 2.377149 0.474988 1.304692
C -1.323981 -2.055343 -0.039768
C -2.994976 -0.283190 -0.098119
C 3.075596 -0.805873 -0.672059
C 3.360264 -0.233058 0.589196
C -2.263091 -2.931418 0.545894
C -3.938365 -1.160350 0.485947
C -3.579730 -2.488007 0.809935
H -0.544888 -0.266316 -2.121608
H -0.220430 2.125987 -1.920381
H -1.924217 1.607699 -2.064816
H -0.893793 3.387244 1.559787
H 0.440540 3.236016 0.374473
H -0.855741 0.814634 1.769362
H 0.468281 1.739539 2.519957
H 1.560304 -1.102488 -2.167677
H -1.446617 4.386119 -1.201277
H -2.530367 4.246090 0.226885
H -2.986225 3.467150 -1.317333
H 2.626805 0.913488 2.276008
H -0.305434 -2.411032 -0.235607
H -3.270671 0.754904 -0.300547
H -1.968465 -3.957542 0.794483
H -4.953206 -0.801584 0.694140
H -4.311650 -3.165181 1.264752
H 4.876719 -1.554331 -0.970343


