%chk=000042754.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042754

0 1
 Br   4.957700       1.808100      0.2700000    
 O   -2.815700       1.286000     -0.3266000    
 N   -3.527000     -0.8391000      0.2913000    
 C    1.263900     -4.0500000E-02 -0.1116000    
 C   -4.949000     -0.5776000      0.2806000    
 C  -0.1462000      0.3822000     -0.1787000    
 C    2.255000      0.9184000      2.2500001E-02
 C    1.571100      -1.389700     -0.1837000    
 C   -2.579700      0.1231000     -1.5600000E-02
 C   -1.193100     -0.4171000      7.4199997E-02
 C   -5.246600      0.8572000     -0.1030000    
 C    3.589500      0.5172000      8.6000003E-02
 C    2.905400      -1.790800     -0.1201000    
 C    3.914600     -0.8374000      1.4800000E-02
 H   -5.407700      -1.274500     -0.4276000    
 H   -5.333900     -0.8027000       1.280000    
 H   -3.232500      -1.779300      0.5382000    
 H  -0.3058000       1.424100     -0.4465000    
 H    2.000400       1.974300      7.9499997E-02
 H   0.8221000      -2.164700     -0.3113000    
 H   -1.085800      -1.453800      0.3713000    
 H   -4.862100       1.582400      0.6216000    
 H   -4.937700       1.099700      -1.125100    
 H   -6.335900      0.9913000     -9.3000002E-02
 H    3.159700      -2.845100     -0.1808000    
 H    4.949500      -1.166700      6.1799999E-02


%chk=000042754-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000042754

0 1
Br 5.067322 1.905416 -0.224465
O -2.715111 1.431201 -0.074678
N -3.593513 -0.755186 0.097925
C 1.323355 -0.120429 -0.017519
C -5.061016 -0.540628 0.100132
C -0.081034 0.318324 -0.027024
C 2.336596 0.878512 -0.103530
C 1.722151 -1.485751 0.070666
C -2.558533 0.172621 0.015125
C -1.197823 -0.462695 0.041836
C -5.542505 0.918942 0.011221
C 3.692672 0.505907 -0.100734
C 3.085218 -1.836163 0.072335
C 4.092167 -0.842734 -0.013650
H -5.488251 -1.111753 -0.750518
H -5.467745 -0.996601 1.026871
H -3.307838 -1.734968 0.165953
H -0.267113 1.400373 -0.098968
H 2.051007 1.933101 -0.172472
H 0.965453 -2.274365 0.137609
H -1.131326 -1.557400 0.115717
H -5.178275 1.522442 0.856178
H -5.199458 1.407777 -0.912844
H -6.648931 0.912999 0.025093
H 3.381744 -2.888317 0.140538
H 5.150986 -1.115624 -0.012597


