%chk=000157543.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157543

0 1
 Br   3.697200      8.3999997E-03   2.733800    
 Cl  -3.195200       2.496300     -0.2023000    
 Cl   6.040500      0.1524000      -2.276500    
 F   -4.784100      -1.582300     -0.7259000    
 F   -5.202300      0.2703000      0.3216000    
 F   -4.606400      0.3174000      -1.769200    
 O   0.9167000       2.335900      0.9257000    
 O  -0.9471000       3.386700      0.4346000    
 O  -0.7509000      -3.636700      0.3361000    
 O    1.064300      -2.518200      0.8591000    
 N    1.142600     -5.8499999E-02  0.9326000    
 N  -0.2893000       2.334500      0.5932000    
 N  -0.1433000      -2.557400      0.5268000    
 N    2.217200      4.6999999E-03  -1.169200    
 C  -0.2234000     -0.1024000      0.5579000    
 C  -0.9413000       1.081200      0.3861000    
 C  -0.8496000      -1.332900      0.3594000    
 C   -2.911300     -0.1962000     -0.1830000    
 C   -2.285200       1.034300      1.5600000E-02
 C   -2.193600      -1.379900     -1.0900000E-02
 C   -4.349500     -0.2972000     -0.5796000    
 C    2.329000     -8.0000004E-03  0.1839000    
 C    3.552700      2.6600000E-02  0.8460000    
 C    4.714700      7.6700002E-02  8.4100001E-02
 C    3.368300      5.3700000E-02  -1.876400    
 C    4.629400      9.0800002E-02  -1.303700    
 H   -2.695800      -2.330900     -0.1694000    
 H    1.285200     -0.4703000       1.852800    
 H    5.689000      0.1050000      0.5668000    
 H    3.234500      6.2199999E-02  -2.953900    


%chk=000157543-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157543

0 1
Br 3.881450 -1.055622 2.468730
Cl -2.738289 2.404035 -0.949345
Cl 5.960066 1.687744 -2.068148
F -5.014409 -1.458873 -0.335677
F -5.109848 0.733268 0.211434
F -4.611681 0.111478 -1.913734
O 0.819475 2.227970 0.984470
O 0.155653 2.699344 -1.145687
O -1.478063 -3.812222 1.286187
O 0.548739 -2.933707 1.828618
N 1.232952 -0.680303 0.729612
N 0.159397 1.969668 -0.095082
N -0.644410 -2.833965 1.293116
N 2.197002 0.520503 -1.073801
C -0.104623 -0.484572 0.449472
C -0.675878 0.736643 -0.066475
C -1.046113 -1.552019 0.697670
C -2.920224 -0.265299 -0.201656
C -2.044723 0.843971 -0.386771
C -2.406042 -1.437134 0.361354
C -4.387391 -0.211907 -0.556169
C 2.357613 -0.080064 0.134311
C 3.644149 -0.187043 0.738163
C 4.760640 0.349575 0.071431
C 3.259059 1.057559 -1.720999
C 4.557415 0.979529 -1.174901
H -3.054591 -2.297664 0.542023
H 1.393992 -1.500786 1.353447
H 5.758510 0.286559 0.512258
H 3.063172 1.549535 -2.677751


