%chk=000090829.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090829

0 1
 Cl  -8.464600       1.903700     -0.6881000    
 O   -1.928900      0.9515000      0.1031000    
 N    1.736500       1.265300      0.3303000    
 N    4.490000      0.5871000     -1.3500000E-02
 N    6.153700      -1.058000     -0.3314000    
 N    6.757100       1.218400      0.1799000    
 C    2.681100       2.246700     -0.2168000    
 C    2.120700     -8.7099999E-02 -9.3000002E-02
 C    4.105100       1.972600      0.2729000    
 C    3.525500     -0.4390000      0.4020000    
 C   0.3728000       1.569700     -0.1011000    
 C  -0.6187000      0.6090000      0.5356000    
 C    5.844400      0.2377000     -5.6100000E-02
 C   -2.906400      8.6900003E-02  0.6657000    
 C   -4.310500      0.5468000      0.3243000    
 C   -2.637700      -1.346100      0.2558000    
 C   -5.339000      0.2811000       1.209000    
 C   -4.527500       1.219500     -0.8641000    
 C   -3.007000      -2.371800       1.107800    
 C   -2.029400      -1.596800     -0.9614000    
 C    7.468300      -1.359700     -0.3653000    
 C    8.053100      0.8468000      0.1302000    
 C    8.472000     -0.4400000     -0.1400000    
 C   -6.630800      0.7030000      0.8942000    
 C   -5.819100       1.641600      -1.178900    
 C   -2.759800      -3.691500      0.7303000    
 C   -1.782400      -2.916700      -1.338800    
 C   -6.870900       1.383400     -0.2996000    
 C   -2.147600      -3.964000     -0.4929000    
 H    2.399000       3.257800      0.1013000    
 H    2.661600       2.232500      -1.315000    
 H    2.077900     -0.1820000      -1.186400    
 H    1.480900     -0.8626000      0.3334000    
 H    4.770400       2.680400     -0.2365000    
 H    4.180400       2.159400       1.351700    
 H    3.535100     -0.5241000       1.496300    
 H    3.778500      -1.424500     -6.6000000E-03
 H   0.1008000       2.591300      0.1948000    
 H   0.2741000       1.533900      -1.194500    
 H  -0.3756000     -0.4179000      0.2902000    
 H  -0.5682000      0.7121000       1.627700    
 H   -2.795500      0.1703000       1.757200    
 H   -5.164300     -0.2434000       2.143500    
 H   -3.725600       1.421700      -1.567600    
 H   -3.479200      -2.172500       2.064900    
 H   -1.763300     -0.8045000      -1.655000    
 H    7.700300      -2.396200     -0.5857000    
 H    8.769800       1.638500      0.3203000    
 H    9.518900     -0.7100000     -0.1734000    
 H   -7.440400      0.4957000       1.589300    
 H   -5.992000       2.168500      -2.113800    
 H   -3.043200      -4.507000       1.389200    
 H   -1.312100      -3.129500      -2.294400    
 H   -1.956500      -4.991800     -0.7876000    


%chk=000090829-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000090829

0 1
Cl -8.191480 2.745898 -1.162311
O -1.848916 0.661396 0.000096
N 1.858741 0.938572 0.404037
N 4.703310 0.589496 0.561569
N 6.450088 -0.842232 -0.131971
N 6.742350 1.596672 -0.077810
C 2.776769 2.064589 0.091490
C 2.484226 -0.357861 0.030583
C 4.105672 1.905278 0.855508
C 3.808416 -0.559217 0.793037
C 0.505954 1.125428 -0.171931
C -0.550241 0.322127 0.600663
C 5.995695 0.444517 0.105819
C -2.983494 -0.046233 0.627496
C -4.264424 0.635743 0.138354
C -2.935935 -1.546863 0.332351
C -5.522770 0.029109 0.380116
C -4.222106 1.893754 -0.508877
C -2.806279 -2.486756 1.382155
C -2.994548 -2.009590 -1.007060
C 7.729477 -0.957683 -0.572064
C 8.014875 1.425815 -0.519436
C 8.577327 0.154917 -0.786844
C -6.722287 0.664010 -0.008917
C -5.413146 2.539506 -0.912773
C -2.745454 -3.872914 1.104123
C -2.928067 -3.390159 -1.288299
C -6.646094 1.914760 -0.651537
C -2.805990 -4.326921 -0.232512
H 2.295843 3.010321 0.401837
H 2.993998 2.130727 -1.004897
H 2.684474 -0.409322 -1.070122
H 1.797682 -1.183805 0.287800
H 4.827945 2.684327 0.569123
H 3.904979 1.976141 1.943905
H 3.591491 -0.637365 1.877812
H 4.325949 -1.471865 0.461635
H 0.238840 2.195553 -0.097066
H 0.455525 0.849399 -1.253352
H -0.370957 -0.769649 0.525869
H -0.533486 0.611165 1.672850
H -2.912042 0.088593 1.732939
H -5.572658 -0.951655 0.866460
H -3.251207 2.357330 -0.699312
H -2.752684 -2.134630 2.420729
H -3.089181 -1.280060 -1.819313
H 8.077483 -1.981083 -0.756537
H 8.595664 2.345061 -0.661335
H 9.604374 0.039763 -1.139238
H -7.692031 0.194437 0.179411
H -5.379599 3.509165 -1.418002
H -2.648213 -4.592432 1.924802
H -2.973941 -3.739574 -2.325939
H -2.758117 -5.399499 -0.451714


