%chk=000057846.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057846

0 1
 Cl  -8.677000       1.231600      0.6851000    
 Cl  -4.484200      -4.119700     -0.5044000    
 N   -4.936500     -0.1779000      0.1889000    
 N    7.353800     -0.1823000      0.2380000    
 N    1.327100      0.9708000      2.6900001E-02
 N    1.775500     -0.1706000     -0.2327000    
 C   -4.332300      0.9914000     -0.4486000    
 C   -6.394800     -0.1123000      9.9299997E-02
 C   -4.441300      -1.408600     -0.4264000    
 C   -2.832100      0.9868000     -0.3218000    
 C   -6.901000       1.153700      0.7729000    
 C   -5.096100      -2.616400      0.2261000    
 C   -2.052500       1.288400      -1.429600    
 C   -2.250200      0.6797000      0.9001000    
 C  -0.6625000       1.282600      -1.313100    
 C  -0.8602000      0.6741000       1.016500    
 C  -6.6399999E-02  0.9755000     -9.0099998E-02
 C    5.948800     -0.1809000      0.1186000    
 C    3.175900     -0.1749000     -0.1153000    
 C    5.154900     -0.4837000       1.224700    
 C    5.352800      0.1250000      -1.104800    
 C    3.764900     -0.4808000       1.107500    
 C    3.962900      0.1280000      -1.222100    
 C    7.983800      0.1499000       1.500500    
 C    8.186700     -0.5295000     -0.8965000    
 H   -4.630900       1.057300      -1.503500    
 H   -4.627000       1.928700      3.3000000E-02
 H   -6.735600     -0.1557000     -0.9434000    
 H   -6.869500     -0.9322000      0.6453000    
 H   -3.358500      -1.518500     -0.3037000    
 H   -4.645900      -1.415600      -1.505900    
 H   -6.576400       2.071600      0.2818000    
 H   -6.617000       1.194400       1.829300    
 H   -6.172900      -2.673800      6.3500002E-02
 H   -4.890900      -2.660300       1.300300    
 H   -2.504700       1.530000      -2.387200    
 H   -2.849900      0.4559000       1.777900    
 H  -5.2499998E-02   1.519800      -2.180800    
 H  -0.4050000      0.4373000       1.974800    
 H    5.587100     -0.7378000       2.188400    
 H    5.942000      0.3769000      -1.982000    
 H    3.153500     -0.7209000       1.973300    
 H    3.506200      0.3696000      -2.178200    
 H    7.491100       1.001500       1.983300    
 H    9.032200      0.4340000       1.355800    
 H    7.965900     -0.7080000       2.180700    
 H    9.195700     -0.8110000     -0.5748000    
 H    8.284400      0.3201000      -1.580500    
 H    7.780300      -1.387000      -1.444800    


%chk=000057846-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000057846

0 1
Cl -8.481647 1.850718 1.598782
Cl -5.148935 -4.239290 0.178829
N -5.318540 -0.116041 -0.230558
N 7.603529 -0.111895 0.377945
N 1.201747 0.262591 0.254852
N 2.060249 0.405202 -0.733026
C -4.442751 0.825456 -0.967048
C -6.695216 0.369493 0.001180
C -5.187189 -1.540055 -0.608820
C -2.957180 0.639848 -0.674379
C -6.746468 1.129527 1.334819
C -5.202394 -2.406427 0.658335
C -2.003222 0.745596 -1.721361
C -2.496041 0.407453 0.646632
C -0.624567 0.633459 -1.465835
C -1.119036 0.288571 0.913508
C -0.168001 0.403110 -0.136556
C 6.237836 0.010989 0.129823
C 3.421983 0.261632 -0.369814
C 5.274595 -0.164026 1.184681
C 5.745057 0.315055 -1.183056
C 3.904567 -0.040624 0.939760
C 4.369004 0.434147 -1.417218
C 8.088268 -0.426482 1.730297
C 8.570274 0.070713 -0.714590
H -4.608699 0.763600 -2.069889
H -4.743614 1.849762 -0.667932
H -7.052515 1.030049 -0.818815
H -7.391273 -0.487086 0.046274
H -4.223316 -1.685540 -1.126404
H -5.991524 -1.872068 -1.302011
H -6.063960 1.992588 1.355412
H -6.558577 0.468405 2.193035
H -6.126445 -2.287884 1.244606
H -4.316141 -2.226516 1.282656
H -2.351984 0.915701 -2.748320
H -3.230744 0.314673 1.454262
H 0.116509 0.712070 -2.266968
H -0.746336 0.108581 1.927520
H 5.610798 -0.398598 2.198572
H 6.438886 0.456336 -2.015733
H 3.174635 -0.174543 1.744359
H 3.989951 0.664828 -2.418690
H 7.788808 0.348612 2.463557
H 9.188000 -0.477383 1.721498
H 7.705091 -1.403451 2.086680
H 9.591804 -0.062057 -0.326331
H 8.501631 1.085144 -1.155775
H 8.414789 -0.667744 -1.526448


