%chk=000178054.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178054

0 1
 Cl  -5.494900      -1.694300      2.4000001E-03
 S    4.255900      -1.611900      1.9999999E-04
 O   0.7469000       1.406300       0.000000    
 N  -0.5007000     -0.5745000     -1.8000000E-03
 N    1.804100     -0.6854000     -1.1000000E-03
 N    3.623500      0.8946000      6.0000003E-04
 C   -1.818700     -0.1170000     -1.8000000E-03
 C   -2.874600      -1.028500     -8.9999998E-04
 C   -2.080200       1.253200     -1.2000001E-03
 C   0.6991000      0.1807000     -6.9999998E-04
 C   -4.192000     -0.5698000      5.0000002E-04
 C   -3.397300       1.711900      3.0000001E-04
 C   -4.453200      0.8004000      1.3000000E-03
 C    3.150700     -0.3143000     -6.0000003E-04
 C    5.529200     -0.4630000      8.9999998E-04
 C    5.002200      0.8116000      1.8000000E-03
 H  -0.3883000      -1.585400     -2.0000001E-03
 H   -2.670400      -2.097200     -1.0000000E-03
 H   -1.320900       2.022000     -1.9000000E-03
 H   -3.602300       2.778600      7.9999998E-04
 H    1.632400      -1.686700     -1.6000000E-03
 H   -5.474600       1.172500      2.7000001E-03
 H    6.567000     -0.7637000      1.2000001E-03
 H    5.585200       1.722700      2.9000000E-03


%chk=000178054-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178054

0 1
Cl -5.568612 -1.778743 -0.004546
S 4.426811 -1.739924 -0.000279
O 0.775175 1.400101 0.003099
N -0.513206 -0.580509 0.002301
N 1.813832 -0.730879 0.002422
N 3.677119 0.848525 0.000079
C -1.836310 -0.057289 0.001024
C -2.896994 -1.005281 -0.000871
C -2.130477 1.332807 0.001599
C 0.690098 0.151075 0.004136
C -4.222531 -0.544244 -0.002128
C -3.478049 1.749998 0.000279
C -4.547474 0.824690 -0.001603
C 3.157984 -0.356761 0.000848
C 5.670290 -0.436709 -0.002009
C 5.078845 0.812033 -0.001430
H -0.459679 -1.601406 0.001418
H -2.692337 -2.081860 -0.001344
H -1.315143 2.056933 0.003063
H -3.701988 2.821901 0.000732
H 1.641163 -1.737538 0.002207
H -5.589159 1.155191 -0.002620
H 6.725989 -0.696262 -0.003211
H 5.622751 1.756952 -0.002167


