%chk=000042459.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042459

0 1
 Br   5.868000      -1.034300      -1.272000    
 Cl  -5.305500      -2.140200      -1.287100    
 O   0.4574000     -0.5658000       1.394400    
 O  -0.5346000       3.334100      -1.091500    
 O   -1.486400       3.042400      0.8731000    
 N  -0.6951000       2.725200     -2.5100000E-02
 C  -0.4640000      0.5044000       1.077600    
 C   9.7499996E-02   1.562500      0.1861000    
 C   -1.671100     -0.1533000      0.4885000    
 C    2.121200      0.3881000     -0.1244000    
 C    1.669000     -0.6054000      0.7542000    
 C    1.294100       1.557400     -0.3947000    
 C   -2.662300     -0.6606000       1.325300    
 C   -1.798400     -0.2570000     -0.8947000    
 C    3.378100      0.2539000     -0.7262000    
 C    2.469400      -1.717800       1.026800    
 C    4.172600     -0.8609000     -0.4541000    
 C    3.719000      -1.845200      0.4217000    
 C   -3.787400      -1.275200      0.7755000    
 C   -2.923600     -0.8716000      -1.444200    
 C   -3.918000      -1.380700     -0.6091000    
 H  -0.7199000      0.9543000       2.045900    
 H    1.696800       2.347300      -1.017900    
 H   -2.571100     -0.5861000       2.405500    
 H   -1.038000      0.1000000      -1.582200    
 H    3.737400       1.022400      -1.408200    
 H    2.124100      -2.490500       1.708800    
 H    4.327100      -2.718300      0.6446000    
 H   -4.554100      -1.668000       1.438500    
 H   -3.009600     -0.9523000      -2.524900    


%chk=000042459-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000042459

0 1
Br 5.425971 -1.556466 -1.771863
Cl -4.867952 -2.698595 -1.484616
O 0.537391 -0.180593 1.718562
O -0.127245 4.042757 -0.506201
O -1.701037 3.218139 0.941206
N -0.606299 3.108548 0.250007
C -0.538641 0.759189 1.195656
C 0.106153 1.835672 0.346239
C -1.618507 -0.052838 0.493373
C 2.010541 0.402806 -0.168090
C 1.602968 -0.488345 0.875282
C 1.282734 1.647643 -0.326976
C -2.645230 -0.637410 1.276734
C -1.602814 -0.282612 -0.904650
C 3.155333 0.080784 -0.949320
C 2.335948 -1.663502 1.142534
C 3.860036 -1.102901 -0.686502
C 3.464086 -1.976498 0.356784
C -3.638710 -1.444490 0.685413
C -2.588608 -1.088682 -1.514238
C -3.590878 -1.659420 -0.706689
H -0.945232 1.193224 2.122374
H 1.675243 2.452353 -0.958063
H -2.671087 -0.460513 2.358037
H -0.828411 0.171857 -1.531468
H 3.475789 0.760592 -1.745060
H 2.016333 -2.322202 1.954377
H 4.028161 -2.892914 0.551848
H -4.433453 -1.891540 1.288890
H -2.579983 -1.265244 -2.593381


