%chk=000055938.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055938

0 1
 Cl  -4.570100     -0.6014000     -8.9999998E-04
 F   -2.063500      -2.187500      1.0000000E-03
 F    3.407800      -1.450900      1.0000000E-03
 F    3.602500      0.4216000      -1.086500    
 F    3.576100      0.4286000       1.093600    
 N   0.9466000       1.238800     -1.8000000E-03
 N   0.6423000     -0.9629000     -3.0000001E-04
 C  -0.4125000       1.057200     -1.3000000E-03
 C  -0.5770000     -0.3252000     -5.0000002E-04
 C    1.532700      3.5999999E-03 -1.5000000E-03
 C   -1.479600       1.956100     -1.5000000E-03
 C   -1.876300     -0.8603000      3.0000001E-04
 C    2.999800     -0.1474000     -8.9999998E-04
 C   -2.765800       1.406300     -8.9999998E-04
 C   -2.962900      2.3300000E-02  1.9999999E-04
 H    1.427100       2.128800     -2.3000001E-03
 H   -1.324000       3.028900     -2.3000001E-03
 H   -3.618600       2.082300     -1.5000000E-03


%chk=000055938-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000055938

0 1
Cl -4.667965 -0.630819 -0.001938
F -2.099965 -2.240251 -0.000172
F 3.445067 -1.508950 0.004456
F 3.629540 0.457182 -1.131384
F 3.629066 0.461262 1.132918
N 0.979876 1.265095 -0.000332
N 0.656949 -1.005799 0.000551
C -0.408035 1.086329 -0.000840
C -0.583595 -0.342535 -0.000229
C 1.554277 -0.011221 0.000765
C -1.491344 1.990605 -0.001793
C -1.897309 -0.867108 -0.000574
C 3.040229 -0.177185 0.001676
C -2.782533 1.431911 -0.002117
C -2.982241 0.023161 -0.001502
H 1.481958 2.152803 -0.000426
H -1.355869 3.075250 -0.002300
H -3.663504 2.080167 -0.002861


