%chk=000157545.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157545

0 1
 Br   6.197000      0.1582000      -2.312000    
 Cl  -3.197800       2.497400     -0.2121000    
 Cl   3.647300      5.1000002E-03   2.600700    
 F   -4.785000      -1.579900     -0.7497000    
 F   -5.209400      0.2718000      0.2966000    
 F   -4.599700      0.3205000      -1.790200    
 O   0.9065000       2.334200      0.9428000    
 O  -0.9536000       3.386200      0.4404000    
 O  -0.7598000      -3.637100      0.3370000    
 O    1.052300      -2.520000      0.8729000    
 N    1.131200     -6.0300000E-02  0.9491000    
 N  -0.2974000       2.333600      0.6024000    
 N  -0.1531000      -2.558200      0.5326000    
 N    2.223800      4.9999999E-03  -1.146200    
 C  -0.2323000     -0.1033000      0.5654000    
 C  -0.9485000       1.080800      0.3898000    
 C  -0.8577000      -1.333300      0.3616000    
 C   -2.915300     -0.1952000     -0.1933000    
 C   -2.289900       1.034800      1.0500000E-02
 C   -2.199200      -1.379400     -1.7600000E-02
 C   -4.350900     -0.2952000     -0.5994000    
 C    2.322600     -9.7000003E-03  0.2082000    
 C    3.540500      2.3700001E-02  0.8811000    
 C    4.709700      7.4600004E-02  0.1301000    
 C    3.381400      5.4800000E-02  -1.842600    
 C    4.637400      9.0800002E-02  -1.258300    
 H   -2.700800      -2.330000     -0.1802000    
 H    1.267500     -0.4728000       1.870000    
 H    5.677200      0.1015000      0.6264000    
 H    3.255600      6.4700000E-02  -2.921000    


%chk=000157545-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157545

0 1
Br 6.110426 1.741008 -2.056682
Cl -2.740532 2.404276 -0.961002
Cl 3.810491 -1.046177 2.354972
F -5.026927 -1.450087 -0.333303
F -5.114640 0.743857 0.208006
F -4.622102 0.114742 -1.916290
O 0.813401 2.227276 0.974787
O 0.154127 2.691969 -1.158594
O -1.494825 -3.810527 1.285233
O 0.535323 -2.938445 1.824454
N 1.222674 -0.684958 0.729697
N 0.155271 1.966302 -0.105347
N -0.657963 -2.834973 1.290651
N 2.213126 0.527787 -1.059361
C -0.113815 -0.486472 0.445764
C -0.682039 0.734623 -0.073560
C -1.057311 -1.552046 0.694469
C -2.928879 -0.262378 -0.205885
C -2.050821 0.844088 -0.394256
C -2.417038 -1.434578 0.358709
C -4.396513 -0.205651 -0.558276
C 2.351703 -0.085940 0.144032
C 3.629647 -0.208883 0.756045
C 4.761783 0.324102 0.118890
C 3.290232 1.062844 -1.684442
C 4.584539 0.973230 -1.123835
H -3.067497 -2.293291 0.541091
H 1.381318 -1.504536 1.355797
H 5.747915 0.241903 0.582364
H 3.108527 1.564234 -2.639126


