%chk=000052592.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052592

0 1
 Cl -0.1013000       3.323400      0.1977000    
 O  -0.3554000      -1.704300      0.6967000    
 O    2.671400       2.568700     -0.3813000    
 N   -1.580900      0.7137000      0.7708000    
 C   -5.148400     -0.3809000     -0.1492000    
 C   -3.981500      0.2956000      0.5984000    
 C   -2.595300      3.3500001E-02  1.1100000E-02
 C   -5.158300      7.5099997E-02  -1.611000    
 C   -5.076200      -1.907100     -8.6000003E-02
 C  -0.2493000      0.6550000      0.4660000    
 C    1.765800     -0.8757000      0.1308000    
 C   0.3342000     -0.7197000      0.4505000    
 C    2.557800      0.2361000     -0.1507000    
 C   0.5337000       1.709700      0.1915000    
 C    1.976800       1.589700     -0.1339000    
 C    2.331900      -2.156900      0.1109000    
 C    3.915300      7.0299998E-02 -0.4521000    
 C    3.684600      -2.319100     -0.1896000    
 C    4.475100      -1.207300     -0.4707000    
 H   -6.083700     -5.9000000E-02  0.3251000    
 H   -3.996000     -3.0200001E-02   1.646900    
 H   -4.161500       1.379000      0.6205000    
 H   -2.548900      0.3932000      -1.022300    
 H   -2.426300      -1.044300     -1.3000000E-02
 H   -4.318600     -0.3338000      -2.181700    
 H   -6.076800     -0.2637000      -2.103200    
 H   -5.129800       1.167300      -1.683900    
 H   -5.015600      -2.249700      0.9522000    
 H   -5.974200      -2.349600     -0.5309000    
 H   -4.212000      -2.303400     -0.6282000    
 H   -1.869000       1.631800       1.104200    
 H    1.737200      -3.040600      0.3264000    
 H    4.552800      0.9217000     -0.6748000    
 H    4.121400      -3.313500     -0.2043000    
 H    5.528000      -1.335000     -0.7045000    


%chk=000052592-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000052592

0 1
Cl -0.007780 3.226161 1.189964
O -0.393446 -1.654546 -0.548382
O 2.922150 2.503556 0.936564
N -1.550942 0.798421 0.313119
C -5.246652 -0.242293 -0.210269
C -3.993381 0.594385 0.173731
C -2.648389 -0.126706 -0.054052
C -5.297630 -0.566161 -1.723924
C -5.380664 -1.530472 0.638830
C -0.193683 0.619150 0.256885
C 1.857738 -0.842325 -0.253767
C 0.376768 -0.702069 -0.209062
C 2.709767 0.229757 0.128815
C 0.696500 1.637095 0.626075
C 2.148085 1.547285 0.596753
C 2.417485 -2.070393 -0.687512
C 4.111418 0.065633 0.073296
C 3.817041 -2.229231 -0.740718
C 4.664638 -1.159253 -0.360034
H -6.121820 0.400249 0.021255
H -4.070712 0.880603 1.243382
H -4.001926 1.533983 -0.417746
H -2.536739 -0.437530 -1.107484
H -2.581639 -1.045998 0.553059
H -4.499269 -1.273902 -2.015318
H -6.263879 -1.033368 -1.989001
H -5.184043 0.347976 -2.336623
H -5.327039 -1.308652 1.721360
H -6.349333 -2.026244 0.443072
H -4.584247 -2.259645 0.399708
H -1.842511 1.725351 0.645700
H 1.739349 -2.879659 -0.975707
H 4.740688 0.908943 0.373805
H 4.248870 -3.177933 -1.075932
H 5.752226 -1.282166 -0.401441


