%chk=000022017.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022017

0 1
 Cl  -5.693400      -1.035800     -0.3168000    
 N    2.814900      -2.853000      0.1338000    
 N    1.008300       1.951900      -1.210900    
 C   0.9493000     -0.6893000      0.5466000    
 C    2.428400     -0.4686000      0.7106000    
 C   0.5183000      -2.119000      0.7284000    
 C    3.216900      -1.464400     -0.1475000    
 C    1.379900      -3.051400     -0.1308000    
 C   9.5399998E-02  0.2951000      0.2341000    
 C    3.614700      -3.786800     -0.6588000    
 C   -1.348400     -3.7400000E-02  9.6400000E-02
 C   0.6383000       1.667300      4.2700000E-02
 C   -1.828400     -0.4148000      -1.139300    
 C   -2.157300      4.3699998E-02   1.209800    
 C   0.7149000       2.502200       1.125000    
 C   -3.181900     -0.7261000      -1.268100    
 C   -3.510800     -0.2676000       1.081200    
 C    1.228800       3.774100      0.8976000    
 C   -4.023300     -0.6527000     -0.1578000    
 C    1.502800       3.196900      -1.393500    
 C    1.632600       4.135800     -0.3829000    
 H    2.777300      0.5357000      0.4581000    
 H    2.683400     -0.6205000       1.768100    
 H   0.6465000      -2.383100       1.786900    
 H  -0.5288000      -2.324600      0.4947000    
 H    3.079400      -1.226800      -1.211300    
 H    4.282900      -1.338300      7.8699999E-02
 H    1.102900      -4.085800      0.1078000    
 H    1.153500      -2.890600      -1.193700    
 H    4.679700      -3.673200     -0.4279000    
 H    3.477400      -3.639200      -1.736000    
 H    3.350200      -4.821900     -0.4159000    
 H   -1.181600     -0.4756000      -2.009900    
 H   -1.768600      0.3415000       2.179500    
 H   0.3977000       2.208500       2.119400    
 H   -3.567200      -1.024600      -2.239600    
 H   -4.154400     -0.2060000       1.955000    
 H    1.314900       4.481800       1.716600    
 H    1.803600       3.429500      -2.409700    
 H    2.036300       5.121600     -0.5833000    


%chk=000022017-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000022017

0 1
Cl -5.940088 -0.655570 -0.444261
N 2.924537 -2.950523 0.291695
N 0.462997 2.092092 -1.346449
C 0.995106 -0.770341 0.625091
C 2.490629 -0.549962 0.811111
C 0.598284 -2.222812 0.850085
C 3.314054 -1.559540 -0.028201
C 1.488362 -3.176736 0.012910
C 0.123772 0.207969 0.207457
C 3.789514 -3.944504 -0.372973
C -1.351491 -0.020342 0.029782
C 0.593575 1.613765 -0.064845
C -2.009224 0.302307 -1.189227
C -2.136987 -0.520370 1.105282
C 1.115614 2.424425 0.980237
C -3.399783 0.107722 -1.341075
C -3.529014 -0.716951 0.971627
C 1.522695 3.746142 0.699343
C -4.138853 -0.402682 -0.257163
C 0.862279 3.370639 -1.602823
C 1.399215 4.234133 -0.621631
H 2.794808 0.474437 0.539541
H 2.751702 -0.712999 1.876776
H 0.741003 -2.482562 1.918673
H -0.458448 -2.401993 0.593296
H 3.169429 -1.330533 -1.116821
H 4.389637 -1.434888 0.198514
H 1.241952 -4.224647 0.267246
H 1.252334 -3.029578 -1.073802
H 4.842166 -3.774409 -0.083413
H 3.728898 -3.909344 -1.490567
H 3.505276 -4.961617 -0.048278
H -1.417548 0.714003 -2.011895
H -1.657811 -0.740171 2.065803
H 1.181300 2.017686 1.994303
H -3.895970 0.349796 -2.285545
H -4.124170 -1.097003 1.806902
H 1.922157 4.383427 1.495675
H 0.741793 3.707726 -2.639236
H 1.701400 5.252312 -0.885845


