%chk=000031827.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031827

0 1
 Cl   4.688000     -0.1613000     -0.4897000    
 N   -1.960400       1.231100      0.1679000    
 N   -1.931700      -1.122100     -3.2200001E-02
 C   -1.238500      1.9200001E-02  0.6077000    
 C   -2.778000      0.8248000     -0.9700000    
 C   -3.185900     -0.5779000     -0.5559000    
 C   0.2577000     -2.6900001E-02  0.3309000    
 C   -1.207300       2.449500     -5.1899999E-02
 C   -2.143100      -2.253300      0.8597000    
 C   0.7261000     -0.5633000     -0.8667000    
 C    1.154200      0.4682000       1.275600    
 C    2.097000     -0.6048000      -1.120600    
 C    2.525200      0.4266000       1.021700    
 C    2.996600     -0.1100000     -0.1764000    
 H   -1.382100     -3.4600001E-02   1.695900    
 H   -2.199300      0.8040000      -1.902500    
 H   -3.648500       1.474600      -1.101900    
 H   -3.968500     -0.5350000      0.2132000    
 H   -3.554000      -1.161000      -1.405600    
 H  -0.4900000       2.362700     -0.8750000    
 H  -0.6732000       2.748600      0.8557000    
 H   -1.888200       3.273700     -0.2929000    
 H   -1.185000      -2.646000       1.216700    
 H   -2.642900      -3.069400      0.3266000    
 H   -2.752600      -1.989400       1.731500    
 H   5.2999999E-02 -0.9403000      -1.631200    
 H   0.7995000      0.8890000       2.212500    
 H    2.450100      -1.022000      -2.060300    
 H    3.214400      0.8162000       1.766500    


%chk=000031827-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000031827

0 1
Cl 4.794767 -0.157728 -0.529804
N -1.961251 1.254370 0.078213
N -2.004340 -1.085353 0.058126
C -1.267164 0.056662 0.659470
C -2.811200 0.806005 -1.046257
C -3.256490 -0.577589 -0.548332
C 0.239157 -0.038083 0.371314
C -1.201157 2.494716 -0.109838
C -2.111303 -2.283511 0.897363
C 0.714327 -0.504737 -0.879855
C 1.177561 0.384340 1.343290
C 2.096594 -0.541212 -1.164061
C 2.567141 0.352808 1.082664
C 3.001500 -0.107004 -0.174366
H -1.393955 0.097045 1.771137
H -2.258831 0.715836 -2.013394
H -3.658079 1.501352 -1.191377
H -4.084181 -0.470134 0.193086
H -3.592668 -1.244814 -1.362659
H -0.424574 2.439733 -0.909502
H -0.696403 2.778221 0.830682
H -1.903762 3.307675 -0.369587
H -1.104537 -2.613020 1.210321
H -2.567809 -3.104694 0.316423
H -2.727651 -2.124617 1.816917
H -0.014118 -0.869817 -1.611224
H 0.824403 0.736887 2.320841
H 2.465191 -0.904756 -2.127863
H 3.291432 0.672321 1.837573


