%chk=000027452.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027452

0 1
 Cl   2.014800      -4.209500      -1.401000    
 O   0.9653000       2.671900       1.476700    
 N   -2.772200       1.219900      0.6166000    
 N   0.3439000       1.435100       1.298600    
 N   -1.830000     -0.7607000       1.326000    
 C   -4.690800       1.177100     -0.8360000    
 C   -5.747500      0.4910000      -1.644200    
 C   -4.635000       1.227400      -2.331100    
 C   -3.690500      0.3496000     -0.1029000    
 C   -1.872200      0.5966000       1.300700    
 C  -0.8473000       1.319700       2.104400    
 C   0.9541000      0.4381000      0.5378000    
 C   0.5352000     -0.8418000      0.3229000    
 C  -0.7706000      -1.386400      0.9119000    
 C    2.235100      0.8796000     -8.5100003E-02
 C    1.313800      -1.803500     -0.4741000    
 C  -0.8630000      -2.880700      0.9862000    
 C    1.057500      -3.118400     -0.4663000    
 C    2.219400       1.443700      -1.352100    
 C    3.422200      0.7206000      0.6143000    
 C   9.9999997E-05  -3.666300      0.3359000    
 C    3.418000       1.858200      -1.932800    
 C    4.620800       1.135000      3.3599999E-02
 C    4.618800       1.703900      -1.240000    
 H   -4.999900       2.062100     -0.2928000    
 H   -6.735000      0.9354000      -1.667300    
 H   -5.742400     -0.5908000      -1.696300    
 H   -3.889600      0.6396000      -2.852400    
 H   -4.874600       2.168100      -2.811900    
 H   -3.152500     -0.3009000     -0.8045000    
 H   -4.243000     -0.2843000      0.6029000    
 H   -1.242400       2.305000       2.378200    
 H  -0.6331000      0.7714000       3.028300    
 H    2.137200      -1.444200      -1.083100    
 H   -1.680200      -3.310400       1.556400    
 H    1.290300       1.570600      -1.901500    
 H    3.437300      0.2797000       1.607600    
 H  -0.1074000      -4.744800      0.3969000    
 H   0.5412000       3.208300      0.7847000    
 H    3.416400       2.301400      -2.924300    
 H    5.555700       1.014900      0.5731000    
 H    5.551900       2.026700      -1.692000    


%chk=000027452-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027452

0 1
Cl 3.263914 -4.532924 1.025215
O 0.477237 2.504947 1.000327
N -2.871732 0.928273 0.371329
N 0.374350 1.176079 1.044095
N -1.590448 -1.026470 0.106264
C -5.154599 1.268183 -0.476252
C -6.012325 1.717670 -1.664338
C -5.339298 2.771669 -0.770636
C -3.806608 0.613278 -0.724966
C -1.798741 0.137910 0.698779
C -0.846841 0.665136 1.760097
C 1.206383 0.278188 0.441412
C 0.904261 -1.172683 0.528513
C -0.413699 -1.751672 0.352151
C 2.411697 0.755765 -0.279881
C 2.010777 -2.058823 0.726311
C -0.541339 -3.174678 0.336125
C 1.825032 -3.442737 0.741500
C 2.900858 0.000335 -1.387722
C 3.105797 1.948603 0.081399
C 0.553262 -4.026665 0.536853
C 4.047530 0.409506 -2.096758
C 4.264237 2.341672 -0.620293
C 4.741105 1.580897 -1.713008
H -5.693811 0.874692 0.393248
H -7.096121 1.594064 -1.593485
H -5.609088 1.572118 -2.671347
H -4.490742 3.321654 -1.191557
H -5.970555 3.360290 -0.099142
H -3.386425 0.955526 -1.694291
H -3.888685 -0.486257 -0.782957
H -1.240869 1.520476 2.326419
H -0.560295 -0.151179 2.445248
H 3.009908 -1.639479 0.871782
H -1.540755 -3.583242 0.160037
H 2.369277 -0.904258 -1.700061
H 2.726618 2.562685 0.899975
H 0.431343 -5.113481 0.533059
H -2.962710 1.841537 0.818324
H 4.396872 -0.182884 -2.949562
H 4.789958 3.254822 -0.319370
H 5.635070 1.899359 -2.260835


