%chk=000058939.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058939

0 1
 Cl   3.902700       2.540000      0.1929000    
 N   -3.176800       1.973900     -0.7793000    
 N   0.7129000      -2.348800     -4.2599998E-02
 C   -2.281600       1.006900     -0.1329000    
 C   -3.048100     -4.0399998E-02  0.7266000    
 C   -1.386700      0.3913000      -1.232600    
 C  -0.3216000     -0.5320000     -0.7096000    
 C   0.9804000     -0.1530000     -0.3330000    
 C   -4.001900     -0.9335000     -7.3899999E-02
 C   -3.818200      0.6245000       1.875400    
 C    1.619900      -1.321200      8.7099999E-02
 C  -0.4746000      -1.871800     -0.5290000    
 C    1.695500       1.060600     -0.3009000    
 C    2.944100      -1.336500      0.5397000    
 C    3.020600       1.060700      0.1494000    
 C    3.633400     -0.1208000      0.5628000    
 H   -1.635100       1.575700      0.5486000    
 H   -2.309700     -0.6949000       1.205000    
 H  -0.8956000       1.196600      -1.796800    
 H   -1.996500     -0.1456000      -1.971100    
 H   -4.813100     -0.3531000     -0.5254000    
 H   -3.487600      -1.473100     -0.8727000    
 H   -4.460000      -1.684200      0.5799000    
 H   -4.258800     -0.1320000       2.533900    
 H   -4.630500       1.258600       1.505200    
 H   -3.150400       1.244500       2.482800    
 H   -1.303900      -2.543300     -0.6994000    
 H   -3.754400       1.501000      -1.473300    
 H   -2.627200       2.661700      -1.293300    
 H   0.8980000      -3.315400      0.1874000    
 H    1.219300       1.983600     -0.6212000    
 H    3.421800      -2.255700      0.8617000    
 H    4.663800     -0.1136000      0.9118000    


%chk=000058939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058939

0 1
Cl 3.558871 2.794520 0.556396
N -3.169293 1.924638 -0.877783
N 0.924663 -2.524726 -0.166857
C -2.260284 0.912678 -0.294033
C -3.041142 -0.036761 0.666384
C -1.444682 0.127598 -1.389485
C -0.323228 -0.725501 -0.852717
C 0.946301 -0.248123 -0.326885
C -4.269705 -0.692794 -0.010789
C -3.468971 0.720742 1.944044
C 1.708274 -1.396586 0.095138
C -0.292054 -2.116326 -0.737169
C 1.511928 1.048269 -0.187195
C 3.002072 -1.282430 0.649095
C 2.797065 1.138653 0.363256
C 3.549802 0.009389 0.783877
H -1.528497 1.466758 0.328057
H -2.334561 -0.841661 0.955198
H -1.034048 0.881639 -2.091785
H -2.149746 -0.493546 -1.976395
H -5.043944 0.064645 -0.236045
H -4.007433 -1.215527 -0.950623
H -4.727544 -1.438032 0.665302
H -4.061936 0.071110 2.615261
H -4.079816 1.599988 1.671271
H -2.587377 1.078340 2.509162
H -1.048504 -2.845461 -1.023187
H -3.847829 1.537675 -1.542685
H -2.690364 2.743585 -1.265699
H 1.196001 -3.487989 0.015488
H 0.971847 1.946090 -0.500993
H 3.576098 -2.159000 0.967923
H 4.548135 0.148847 1.207672


