%chk=000031988.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031988

0 1
 Cl   7.568800      0.3295000     -0.4563000    
 O   6.0000003E-04 -0.3497000      -1.435500    
 N    2.430000     -0.1448000     -0.1438000    
 N   -1.072500     -0.3123000      0.6524000    
 C    3.673500     -0.4409000      0.5669000    
 C    1.284800     -0.6994000      0.5768000    
 C    4.874800      6.2700003E-02 -0.2319000    
 C   -2.423300     -6.3500002E-02  0.3114000    
 C   1.4200000E-02 -0.4327000     -0.2115000    
 C    2.273100       1.298500     -0.3197000    
 C   -2.875700       1.245100      0.2304000    
 C   -3.271500      -1.132400      6.3900001E-02
 C    6.179000     -0.2475000      0.4922000    
 C   -4.207000       1.490300     -0.1058000    
 C   -4.602900     -0.8871000     -0.2724000    
 C   -1.975100       2.408200      0.4940000    
 C   -2.800200      -2.548300      0.1461000    
 C   -5.070700      0.4242000     -0.3573000    
 H    3.674900      4.6999999E-03   1.570500    
 H    3.772100      -1.526400      0.6943000    
 H    1.377300      -1.788200      0.6700000    
 H    1.210800     -0.2733000       1.585400    
 H    4.880900     -0.3986000      -1.227700    
 H    4.840100       1.148200     -0.3711000    
 H    2.983100       1.690600      -1.054400    
 H    2.403700       1.844400      0.6227000    
 H    1.300000       1.593100     -0.7240000    
 H  -0.9357000     -0.5875000       1.622600    
 H    6.302900      -1.324700      0.6385000    
 H    6.216200      0.2438000       1.469200    
 H   -4.587900       2.505600     -0.1776000    
 H   -5.289300      -1.705500     -0.4724000    
 H   -1.209500       2.480600     -0.2852000    
 H   -2.525600       3.355300      0.5055000    
 H   -1.489300       2.308400       1.470500    
 H   -2.051500      -2.746900     -0.6277000    
 H   -3.620100      -3.260000      3.9999999E-04
 H   -2.367000      -2.753900       1.130700    
 H   -6.107100      0.6153000     -0.6196000    


%chk=000031988-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000031988

0 1
Cl 7.698501 0.774742 -0.519514
O -0.055777 0.099081 -1.549942
N 2.440830 0.142398 0.135030
N -1.073699 -0.371341 0.510588
C 3.762457 -0.476566 0.379522
C 1.337045 -0.819726 0.271683
C 4.934630 0.424819 -0.081042
C -2.448550 -0.088890 0.183253
C 0.019887 -0.303573 -0.357668
C 2.202402 1.391523 0.882667
C -2.834363 1.187532 -0.319474
C -3.408935 -1.116072 0.429259
C 6.248552 -0.357201 -0.068826
C -4.206954 1.398527 -0.607079
C -4.769060 -0.855458 0.144466
C -1.837705 2.310298 -0.517355
C -2.979950 -2.469024 0.970816
C -5.168745 0.392395 -0.381701
H 3.909363 -0.745529 1.460345
H 3.792745 -1.423728 -0.194990
H 1.610051 -1.740765 -0.277914
H 1.155245 -1.114776 1.342884
H 4.719711 0.791633 -1.100487
H 5.035981 1.304659 0.579426
H 2.984503 2.131073 0.648122
H 2.180652 1.242053 1.993178
H 1.236868 1.825355 0.571088
H -0.898894 -0.803842 1.421952
H 6.270167 -1.161880 -0.819937
H 6.497857 -0.757177 0.926962
H -4.518227 2.373621 -0.999326
H -5.513030 -1.640180 0.324365
H -1.193920 2.109563 -1.392703
H -2.355459 3.273128 -0.665110
H -1.166588 2.408511 0.357130
H -2.172202 -2.911481 0.358388
H -3.828317 -3.173390 0.977166
H -2.604072 -2.406142 2.012671
H -6.224098 0.580729 -0.607394


