%chk=000031879.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031879

0 1
 Cl  -1.866600      -2.367400       1.390900    
 O   5.8400001E-02 -0.9986000      -1.856900    
 N    3.706700      0.9886000      0.3806000    
 N  -0.4506000      2.7500000E-02  0.2007000    
 C    4.430700     -0.2748000      0.5736000    
 C    2.248500      0.7682000      0.4304000    
 C    4.106300      -1.261100     -0.5588000    
 C    1.798700     -0.3809000     -0.4258000    
 C    2.644400      -1.307000     -0.8973000    
 C    4.111700       1.981900       1.373500    
 C   0.3834000     -0.4904000     -0.7828000    
 C   -1.865500      8.8600002E-02  0.1937000    
 C   -2.484200       1.208500     -0.3424000    
 C   -2.607900     -0.9597000      0.7166000    
 C   -3.877100       1.281400     -0.3558000    
 C   -1.700800       2.347600     -0.9104000    
 C   -4.000800     -0.8864000      0.7033000    
 C   -4.635400      0.2340000      0.1670000    
 H    4.175900     -0.7238000       1.543400    
 H    5.513600     -9.9600002E-02  0.5740000    
 H    1.755400       1.688400      9.2900001E-02
 H    1.945800      0.5792000       1.468600    
 H    4.442200      -2.262300     -0.2657000    
 H    4.660300     -0.9839000      -1.464000    
 H    2.309500      -2.123400      -1.530100    
 H    3.590700       2.930500       1.203300    
 H    5.183600       2.192800       1.289900    
 H    3.904700       1.653000       2.398300    
 H  -5.3500000E-02  0.2441000       1.110900    
 H   -4.388100       2.146300     -0.7703000    
 H   -1.154600       2.027400      -1.803700    
 H   -2.347800       3.182300      -1.201900    
 H  -0.9912000       2.734500     -0.1713000    
 H   -4.606700      -1.693800       1.106600    
 H   -5.720000      0.2907000      0.1564000    


%chk=000031879-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000031879

0 1
Cl -1.648513 -1.150652 2.657099
O -0.065813 -0.497462 -1.895849
N 3.791832 0.814497 0.846145
N -0.468043 0.281724 0.279911
C 4.541232 -0.380096 0.397399
C 2.329783 0.609841 0.834687
C 4.209402 -0.680355 -1.077876
C 1.847175 -0.063406 -0.443480
C 2.722413 -0.627069 -1.322977
C 4.261603 1.357359 2.132644
C 0.380851 -0.116747 -0.771491
C -1.892285 0.278246 0.248533
C -2.642889 0.948180 -0.768682
C -2.603996 -0.349147 1.306121
C -4.058402 0.892413 -0.705623
C -1.963552 1.744808 -1.860652
C -4.004030 -0.383779 1.378056
C -4.737959 0.234625 0.341021
H 4.305042 -1.279901 1.022730
H 5.620946 -0.174587 0.511784
H 1.849758 1.604213 0.937245
H 1.998493 -0.001455 1.724378
H 4.604584 -1.675528 -1.363481
H 4.715686 0.058568 -1.731897
H 2.312697 -1.069409 -2.240520
H 3.722910 2.295233 2.360579
H 5.338426 1.592402 2.066052
H 4.110998 0.657041 2.993561
H -0.055991 0.295188 1.218333
H -4.633820 1.397483 -1.489394
H -1.532795 1.071256 -2.622987
H -2.678430 2.432583 -2.343173
H -1.122211 2.337995 -1.457016
H -4.503174 -0.885492 2.211360
H -5.832231 0.213831 0.364859


