%chk=000018088.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018088

0 1
 Cl   5.324900      3.0800000E-02 -7.9999998E-04
 O   0.9692000       2.313200      1.1000000E-03
 O    1.001800      -2.313100     -6.9999998E-04
 N   0.9357000     -3.0000001E-04  1.9999999E-04
 N    3.022200      -1.185400     -6.9999998E-04
 N    3.005200       1.214200      8.9999998E-04
 C  -0.3902000       2.248900      5.0000002E-04
 C  -0.3751000      -2.254700     -3.0000001E-04
 C   -1.087700       2.215500       1.208100    
 C   -1.086200       2.215900      -1.207900    
 C   -1.055100      -2.225400      -1.208100    
 C   -1.054100      -2.225900       1.208000    
 C   -2.480900       2.148900       1.207300    
 C   -2.479500       2.149400      -1.208700    
 C   -2.448700      -2.165600      -1.207600    
 C   -2.447800      -2.166200       1.208300    
 C   -3.176800       2.115900     -8.9999998E-04
 C   -3.145000      -2.136100      6.0000003E-04
 C    1.670200       1.118800      1.0000000E-03
 C    1.681200      -1.117100     -3.9999999E-04
 C    3.616700      1.8600000E-02  1.9999999E-04
 H  -0.5524000       2.240800       2.153400    
 H  -0.5498000       2.241600      -2.152600    
 H  -0.5169000      -2.248400      -2.151200    
 H  -0.5152000      -2.249300       2.150700    
 H   -3.023800       2.121400       2.147500    
 H   -3.021400       2.122300      -2.149500    
 H   -2.991500      -2.140800      -2.147900    
 H   -2.990000      -2.141900       2.149000    
 H   -4.261500       2.062500     -1.6000000E-03
 H   -4.229900      -2.088100      1.0000000E-03


%chk=000018088-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000018088

0 1
Cl 5.426764 0.030505 -0.000579
O 1.022752 2.367358 0.000101
O 1.048589 -2.354429 -0.000067
N 0.927723 0.005914 0.000121
N 3.038690 -1.196970 0.000321
N 3.025460 1.231964 0.000385
C -0.420265 2.416632 -0.000001
C -0.394394 -2.418622 -0.000075
C -1.091103 2.498123 1.232979
C -1.090936 2.497797 -1.233094
C -1.064105 -2.507038 -1.233178
C -1.064153 -2.506897 1.233015
C -2.495653 2.654488 1.225048
C -2.495486 2.654164 -1.225389
C -2.466971 -2.677934 -1.225332
C -2.467018 -2.677790 1.225140
C -3.198528 2.729992 -0.000231
C -3.169078 -2.760884 -0.000105
C 1.659955 1.153684 0.000079
C 1.672414 -1.133716 0.000058
C 3.624993 0.020636 0.000948
H -0.526385 2.446546 2.168743
H -0.526093 2.445975 -2.168769
H -0.499772 -2.449414 -2.168819
H -0.499857 -2.449166 2.168671
H -3.036656 2.720753 2.174962
H -3.036362 2.720179 -2.175393
H -3.007188 -2.749708 -2.175289
H -3.007270 -2.749451 2.175084
H -4.286635 2.853676 -0.000314
H -4.255835 -2.895968 -0.000120


