%chk=000028294.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028294

0 1
 Cl  -3.578400       1.951500       2.071500    
 O   0.4218000      0.1990000     -3.5999998E-02
 O  -0.8815000      -1.026500      -1.460800    
 N    3.162100       1.100300     -0.3245000    
 N   -1.801800      0.3628000      0.1833000    
 C    2.769700     -7.0500001E-02  0.4655000    
 C    1.511900     -0.7160000     -0.1363000    
 C    3.932700      -1.068400      0.5313000    
 C    1.136300      -2.001800      0.6044000    
 C    3.539600      -2.342100       1.276000    
 C    2.298400      -2.985200      0.6663000    
 C    4.278100       1.793600      0.3154000    
 C    3.517500      0.6996000      -1.684000    
 C    3.892600       2.297100       1.695900    
 C    3.894600       1.903500      -2.530400    
 C  -0.7819000     -0.2346000     -0.5316000    
 C   -3.195600      0.2022000      1.0900000E-02
 C   -4.096000      0.8804000      0.8187000    
 C   -3.633800     -0.6533000     -0.9899000    
 C   -5.465100      0.6997000      0.6219000    
 C   -5.002800     -0.8339000      -1.186800    
 C   -5.918400     -0.1574000     -0.3808000    
 H    2.487100      0.2343000       1.479900    
 H    1.649200      -1.002300      -1.183000    
 H    4.271900      -1.405000     -0.4517000    
 H    4.801100     -0.6572000       1.055000    
 H   0.2852000      -2.508000      0.1366000    
 H   0.8066000      -1.755800       1.622800    
 H    4.371400      -3.055600       1.255700    
 H    3.348700      -2.105100       2.330100    
 H    2.009700      -3.860800       1.258700    
 H    2.529300      -3.344300     -0.3441000    
 H    5.214500       1.227100      0.3475000    
 H    4.507200       2.707600     -0.2441000    
 H    4.366000      1.4000000E-02  -1.751700    
 H    2.675000      0.2494000      -2.212600    
 H    4.627800       3.035800       2.035500    
 H    3.884800       1.500000       2.445400    
 H    2.915200       2.792100       1.691700    
 H    3.922800       1.615100      -3.587700    
 H    4.889100       2.292500      -2.290400    
 H    3.161800       2.712500      -2.435900    
 H   -1.520800      0.9974000      0.9268000    
 H   -2.998100      -1.214900      -1.657200    
 H   -6.191900       1.219300       1.241200    
 H   -5.357500      -1.501100      -1.967200    
 H   -6.984300     -0.2982000     -0.5341000    


%chk=000028294-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028294

0 1
Cl -3.014842 1.484352 2.567793
O 0.504207 -1.225467 0.895074
O -0.312677 -1.064617 -1.315318
N 2.478332 0.569442 -0.278100
N -1.373244 -0.041005 0.542528
C 2.862618 -0.617412 0.529341
C 1.815135 -1.756241 0.427330
C 4.285308 -1.189835 0.233705
C 2.155084 -2.944517 1.341097
C 4.632263 -2.372963 1.166483
C 3.571858 -3.492375 1.045134
C 2.909125 1.855042 0.332586
C 2.719706 0.460815 -1.741149
C 1.952951 2.334882 1.443606
C 1.792519 1.372065 -2.568936
C -0.384194 -0.783070 -0.092238
C -2.524735 0.530671 -0.036211
C -3.411498 1.282517 0.783154
C -2.859840 0.399475 -1.413576
C -4.579429 1.880743 0.287030
C -4.031182 0.996952 -1.921206
C -4.896353 1.737106 -1.083556
H 2.851600 -0.293757 1.590348
H 1.692424 -2.084632 -0.622721
H 4.337382 -1.534320 -0.818559
H 5.029412 -0.376817 0.342235
H 1.391000 -3.733157 1.212721
H 2.100067 -2.606332 2.395008
H 5.637354 -2.767694 0.922345
H 4.672502 -2.019121 2.217470
H 3.800456 -4.322647 1.739604
H 3.601637 -3.914898 0.019796
H 3.949583 1.789553 0.736155
H 2.937338 2.619835 -0.464068
H 3.785242 0.672077 -2.008441
H 2.516132 -0.583666 -2.040238
H 2.313747 3.281308 1.889671
H 1.866928 1.588874 2.254817
H 0.943041 2.498720 1.028733
H 1.998631 1.242704 -3.648239
H 1.934434 2.441832 -2.329208
H 0.740073 1.105611 -2.377729
H -1.231439 0.111253 1.545611
H -2.186886 -0.171140 -2.056928
H -5.227731 2.448596 0.960472
H -4.267270 0.880961 -2.984343
H -5.804971 2.199095 -1.481885


