%chk=000016987.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016987

0 1
 Cl  -1.984900      -2.587600     -1.1000000E-03
 O   0.5890000       3.494000     -1.2000001E-03
 O    2.489900       2.396000      3.0000001E-04
 O   -3.545900       1.357900      8.9999998E-04
 O   -3.739200     -0.8288000     -1.9999999E-04
 N    1.238400       2.423800     -3.9999999E-04
 N   -3.041900      0.2114000      3.0000001E-04
 C    1.182800     -5.1800001E-02  3.9999999E-04
 C   0.4162000      -1.241500      1.9999999E-04
 C   0.5250000       1.189000      5.0000002E-04
 C  -0.9856000      -1.155200       0.000000    
 C   -1.622400      8.6099997E-02 -9.9999997E-05
 C  -0.8686000       1.256000      9.9999997E-05
 C    2.584500     -0.1381000      3.9999999E-04
 C    1.073900      -2.482300       0.000000    
 C    3.221300      -1.379500      9.9999997E-05
 C    2.467400      -2.549400     -9.9999997E-05
 H   -1.367100       2.222300       0.000000    
 H    3.323600      0.6430000      6.0000003E-04
 H   0.5374000      -3.427000       0.000000    
 H    4.306400      -1.437200       0.000000    
 H    2.964400      -3.515200     -1.9999999E-04


%chk=000016987-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000016987

0 1
Cl -1.914567 -2.748772 0.000016
O 0.436525 3.582381 -0.001093
O 2.484504 2.610036 0.001226
O -3.518943 1.504372 0.001255
O -3.906748 -0.734859 -0.000617
N 1.195129 2.538642 0.000047
N -3.116018 0.276543 -0.000164
C 1.252455 -0.058285 0.000040
C 0.446761 -1.276129 -0.000018
C 0.531978 1.197012 -0.000011
C -0.995474 -1.196477 -0.000085
C -1.633177 0.057158 -0.000118
C -0.856545 1.244643 -0.000078
C 2.679819 -0.191844 0.000045
C 1.109378 -2.548867 -0.000008
C 3.286272 -1.451172 0.000024
C 2.499990 -2.638716 0.000015
H -1.372976 2.207497 -0.000104
H 3.287903 0.710895 0.000120
H 0.503933 -3.457880 -0.000042
H 4.378951 -1.520721 0.000036
H 2.985452 -3.619558 0.000015


