%chk=000038984.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038984

0 1
 Cl   4.781500       2.317000     -0.2205000    
 N  -0.5554000     -5.0000002E-04  0.2921000    
 N   -3.894200       1.442300     -0.5644000    
 C   0.6062000      0.7289000      0.1967000    
 C  -0.3001000      -1.345500      0.1638000    
 C   -1.871300      0.5708000      0.5006000    
 C    1.648300     -0.1778000      6.9999998E-04
 C    1.075300      -1.489100     -1.9900000E-02
 C   -2.567300      0.8952000     -0.8180000    
 C   0.8094000       2.111800      0.2686000    
 C   -1.177200      -2.435600      0.1969000    
 C    2.961100      0.3216000     -0.1304000    
 C    1.602600      -2.788000     -0.1786000    
 C    2.118500       2.582200      0.1354000    
 C  -0.6311000      -3.712000      3.7400000E-02
 C    3.180100       1.702100     -6.1299998E-02
 C   0.7380000      -3.888000     -0.1476000    
 C   -3.801000       2.691300      0.1940000    
 C   -4.723400      0.4732000      0.1546000    
 H   -2.420700     -0.1510000       1.111800    
 H   -1.725800       1.451100       1.133800    
 H   -1.972300       1.606700      -1.404900    
 H   -2.646600     -2.4999999E-03  -1.444500    
 H  -9.2000002E-03   2.808000      0.4159000    
 H   -2.246000      -2.312000      0.3348000    
 H    3.789900     -0.3648000     -0.2839000    
 H    2.668200      -2.941400     -0.3240000    
 H    2.294300       3.654600      0.1873000    
 H   -1.285800      -4.579500      5.6800000E-02
 H    1.141000      -4.889900     -0.2699000    
 H   -3.098800       3.389200     -0.2762000    
 H   -3.519800       2.559800       1.244000    
 H   -4.777800       3.189400      0.1872000    
 H   -4.455500      0.3452000       1.208500    
 H   -4.708000     -0.5059000     -0.3375000    
 H   -5.766900      0.8094000      0.1329000    


%chk=000038984-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038984

0 1
Cl 4.960030 2.325879 -0.386442
N -0.502209 -0.014593 0.457736
N -3.940024 1.438439 -0.474243
C 0.691671 0.711287 0.286510
C -0.230905 -1.380650 0.241823
C -1.826940 0.560413 0.710071
C 1.755751 -0.207895 -0.023455
C 1.168626 -1.539954 -0.051935
C -2.587853 0.883781 -0.622760
C 0.921090 2.100866 0.388310
C -1.108683 -2.485933 0.290769
C 3.067665 0.277747 -0.230895
C 1.688074 -2.832370 -0.295964
C 2.233886 2.576494 0.180446
C -0.565927 -3.765317 0.044543
C 3.273454 1.662495 -0.122717
C 0.816831 -3.940538 -0.246289
C -4.019179 2.807137 0.057732
C -4.952187 0.519928 0.068609
H -2.411221 -0.154645 1.317268
H -1.706062 1.476649 1.315701
H -1.975463 1.596330 -1.208442
H -2.652695 -0.048556 -1.216692
H 0.117064 2.806553 0.619244
H -2.174936 -2.366909 0.509705
H 3.896928 -0.394650 -0.467384
H 2.751042 -2.973538 -0.520997
H 2.452614 3.645818 0.250286
H -1.223490 -4.641355 0.075849
H 1.203537 -4.947699 -0.434335
H -3.289340 3.450770 -0.466308
H -3.828660 2.891870 1.157278
H -5.028024 3.218425 -0.131996
H -4.867123 0.330881 1.168433
H -4.885606 -0.453162 -0.451420
H -5.961538 0.932302 -0.115839


