%chk=000019439.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019439

0 1
 Cl   1.402100       2.740600     -0.3935000    
 N   0.3209000     -0.4725000      0.1534000    
 N   0.9998000      8.9800000E-02   1.025700    
 N   -1.848000      -1.917900      -2.566300    
 N   8.8500001E-02  -4.086000      0.6916000    
 C   -1.053100     -0.7445000      0.6547000    
 C   -2.013600      0.3744000      0.4312000    
 C   -1.525100      -2.102100      4.5699999E-02
 C   -1.905700       1.168600     -0.7105000    
 C   -3.020200      0.6265000       1.363500    
 C   -2.803900       2.215000     -0.9198000    
 C   -3.918500       1.672800       1.154100    
 C   -3.810400       2.467000      1.2400000E-02
 C    2.285600      0.3256000      0.5109000    
 C   -1.704100      -2.000100      -1.417700    
 C  -0.6200000      -3.212400      0.4057000    
 C    2.588400       1.508200     -0.1601000    
 C    3.261700     -0.6530000      0.6842000    
 C    3.874300       1.713100     -0.6604000    
 C    4.547500     -0.4480000      0.1837000    
 C    4.853800      0.7350000     -0.4885000    
 H  -0.9803000     -0.9067000       1.743000    
 H   -2.510300      -2.334400      0.4745000    
 H   -1.135700      0.9904000      -1.456000    
 H   -3.118100      1.4300000E-02   2.256000    
 H   -2.720700       2.832600      -1.809300    
 H   -4.702800       1.868700       1.879400    
 H   -4.510200       3.281300     -0.1509000    
 H    3.033800      -1.578300       1.207000    
 H    4.129100       2.629400      -1.187000    
 H    5.310200      -1.209500      0.3176000    
 H    5.854900      0.8944000     -0.8782000    


%chk=000019439-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000019439

0 1
Cl 2.998637 1.683217 2.843092
N 0.235151 -0.319180 0.196077
N 1.119640 0.198917 0.988966
N -1.585029 -2.792264 -1.858741
N 0.116315 -3.623178 2.126612
C -1.076999 -0.509922 0.888276
C -2.132469 0.428747 0.309299
C -1.486816 -2.029311 0.700701
C -2.216603 0.682401 -1.084060
C -3.050806 1.055223 1.188637
C -3.218400 1.541689 -1.586053
C -4.054807 1.910423 0.682831
C -4.141681 2.154001 -0.707367
C 2.413204 0.408435 0.398768
C -1.525513 -2.445665 -0.720452
C -0.595219 -2.922885 1.475991
C 3.392293 1.079725 1.179521
C 2.772620 -0.039866 -0.905295
C 4.692312 1.304957 0.684627
C 4.066698 0.178149 -1.405125
C 5.028304 0.851951 -0.609719
H -0.969907 -0.334959 1.977655
H -2.513938 -2.131213 1.106560
H -1.497887 0.218672 -1.766313
H -2.975493 0.882414 2.269453
H -3.277530 1.733618 -2.662855
H -4.760145 2.389770 1.370365
H -4.917797 2.819602 -1.100893
H 2.010309 -0.562932 -1.491707
H 5.426837 1.824803 1.305881
H 4.334806 -0.175736 -2.405731
H 6.039817 1.022695 -0.992900


