%chk=000036639.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036639

0 1
 Cl  -1.539400      -1.291700      -2.266900    
 O    1.336300       1.331600     -0.2851000    
 O    1.942400      -2.253500       1.831800    
 N    1.783200      -2.017900     -0.7730000    
 N    1.314600      -1.087100       1.385300    
 C   0.6057000      0.1443000     -0.5817000    
 C  -0.8208000      0.2745000     -0.1555000    
 C    1.289700      -1.060800      8.4299996E-02
 C   -1.854600     -0.3423000     -0.8604000    
 C   -1.106900       1.035700      0.9779000    
 C    2.693500       1.218200     -0.6863000    
 C   -3.174200     -0.1981000     -0.4315000    
 C   -2.426400       1.179900       1.406600    
 C   -3.460000      0.5632000      0.7019000    
 C    3.416900       2.504000     -0.3474000    
 H   0.6574000      3.7000000E-02  -1.671000    
 H  -0.3221000       1.519400       1.553300    
 H    3.206900      0.4075000     -0.1606000    
 H    2.751500       1.039300      -1.765900    
 H   -3.991200     -0.6725000     -0.9693000    
 H   -2.649000       1.770400       2.290500    
 H   -4.487200      0.6751000       1.036200    
 H    4.467100       2.453900     -0.6482000    
 H    2.946200       3.355100     -0.8505000    
 H    3.366500       2.702900      0.7284000    
 H    1.713200      -1.927400      -1.780900    
 H    2.238000      -2.851000     -0.4154000    
 H    1.892200      -2.144900       2.796500    


%chk=000036639-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000036639

0 1
Cl -1.452148 -1.182194 -2.543629
O 1.411979 1.303774 -0.195586
O 2.377236 -2.396641 1.730762
N 1.083833 -2.396953 -0.489393
N 1.970380 -1.027882 1.268367
C 0.738302 0.068455 -0.568004
C -0.735174 0.248980 -0.205694
C 1.310692 -1.184326 0.127012
C -1.799402 -0.257290 -0.980377
C -1.074693 0.946087 0.982911
C 2.818503 1.381413 -0.643736
C -3.152578 -0.092838 -0.628446
C -2.420031 1.127476 1.362314
C -3.461798 0.608504 0.558141
C 3.324222 2.772892 -0.267574
H 0.832956 -0.103430 -1.663836
H -0.253614 1.347001 1.584138
H 3.407084 0.589417 -0.141947
H 2.861933 1.221519 -1.744206
H -3.942256 -0.501089 -1.265296
H -2.657420 1.671666 2.282403
H -4.509668 0.744636 0.845820
H 4.378165 2.893461 -0.578477
H 2.720172 3.555838 -0.757715
H 3.263480 2.918511 0.824624
H 0.496881 -2.468151 -1.318268
H 1.405502 -3.234570 -0.006820
H 2.846961 -2.189467 2.575610


