%chk=000122906.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122906

0 1
 Br   4.370200       2.845900      -1.076900    
 Cl -0.7808000      -4.444600     -0.4844000    
 O  -8.0799997E-02   1.661900     -0.9804000    
 O    4.257000     -2.8100001E-02  0.8010000    
 N    2.078600      0.6732000      0.2521000    
 C   5.6600001E-02 -0.5651000     -0.2788000    
 C    1.386300     -0.5281000      7.3899999E-02
 C  -0.6990000      0.7074000     -0.4857000    
 C   -2.102100      0.8475000     -0.1307000    
 C  -0.6325000      -1.744900     -0.4563000    
 C    2.064000      -1.732800      0.2593000    
 C   4.5299999E-02  -2.950000     -0.2707000    
 C    1.393600      -2.943900      8.6900003E-02
 C   -2.791600     -0.2298000      0.4260000    
 C   -2.758600       2.059300     -0.3461000    
 C   -4.137500     -9.5500000E-02  0.7667000    
 C   -4.104400       2.193600     -5.1000002E-03
 C    3.423300      0.8513000      0.5999000    
 C   -4.793800       1.116100      0.5513000    
 C    3.806100       2.306700      0.6978000    
 H   -1.615800      -1.802800     -0.9134000    
 H    3.103800      -1.819200      0.5387000    
 H    1.537100       1.521800      0.1122000    
 H    1.933100      -3.876000      0.2349000    
 H   -2.355600      -1.139000      0.8123000    
 H   -2.244300       2.914100     -0.7773000    
 H   -4.665600     -0.9194000       1.238500    
 H   -4.615300       3.137700     -0.1705000    
 H   -5.839100       1.223900      0.8259000    
 H    2.970500       2.941700      0.9992000    
 H    4.647800       2.440700       1.380700    


%chk=000122906-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122906

0 1
Br 4.020753 3.180403 -1.076652
Cl -0.836930 -4.467263 -0.858502
O -0.042139 1.900617 -0.194800
O 4.357300 -0.116002 0.880262
N 2.196905 0.642942 0.297498
C 0.073285 -0.511387 -0.132168
C 1.500135 -0.566477 0.102136
C -0.671438 0.780972 -0.103156
C -2.161849 0.826161 0.049810
C -0.615514 -1.720345 -0.437063
C 2.158004 -1.828725 0.118577
C 0.069600 -2.940210 -0.449157
C 1.447128 -3.010923 -0.155117
C -2.880085 -0.072285 0.886513
C -2.860294 1.884502 -0.593537
C -4.273298 0.077005 1.056942
C -4.253906 2.017517 -0.438287
C 3.534167 0.817021 0.637834
C -4.965006 1.112439 0.386700
C 3.965437 2.278014 0.743874
H -1.677054 -1.688780 -0.691514
H 3.227048 -1.861282 0.335189
H 1.603603 1.479910 0.094178
H 1.965674 -3.974211 -0.156618
H -2.349505 -0.858067 1.433966
H -2.291404 2.591062 -1.206345
H -4.816198 -0.609334 1.715428
H -4.785840 2.825516 -0.951628
H -6.047893 1.219816 0.513659
H 3.274225 2.890229 1.344259
H 4.991592 2.324764 1.128720


