%chk=000076786.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076786

0 1
 Cl   4.766400       1.110000      -2.365100    
 N   -4.158600     -5.2400000E-02 -0.7364000    
 N    3.040000     -0.8513000      0.1578000    
 C   -2.155000      -1.431900     -0.3962000    
 C   0.7371000      -1.702400      0.2328000    
 C   -1.604000      -2.665400      0.3302000    
 C   -1.273700     -0.2046000     -0.1307000    
 C  -0.1439000      -2.929400     -3.3300001E-02
 C   0.1865000     -0.4688000     -0.4938000    
 C   -3.598500      -1.159900      2.2399999E-02
 C   -5.536900      0.2169000     -0.3311000    
 C    2.181200      -1.974400     -0.1844000    
 C   -5.582600      0.5634000       1.161200    
 C   -6.117100       1.353000      -1.180400    
 C   -6.998700      0.9264000       1.605100    
 C   -7.532700       1.714500     -0.7338000    
 C   -7.584900       2.049400      0.7542000    
 C    4.416800      -1.103500     -0.2481000    
 C    5.320800      5.3500000E-02  8.5400000E-02
 C    5.528600       1.089300     -0.8167000    
 C    5.944200      5.6100000E-02   1.327400    
 C    6.373100       2.144600     -0.4716000    
 C    6.788600       1.111500       1.672300    
 C    7.003100       2.155600      0.7728000    
 H   -2.135600      -1.643000      -1.475000    
 H   0.7152000      -1.503300       1.313900    
 H   -2.203100      -3.548000      7.5900003E-02
 H   -1.685300      -2.529000       1.416300    
 H   -1.334600      7.9800002E-02  0.9278000    
 H   -1.621100      0.6578000     -0.7114000    
 H  -8.1500001E-02  -3.212700      -1.091800    
 H   0.2218000      -3.785500      0.5462000    
 H   0.7698000      0.4247000     -0.2422000    
 H   0.2679000     -0.6058000      -1.579900    
 H   -4.198900      -2.064700     -0.1344000    
 H   -3.570200     -0.9577000       1.096500    
 H   -6.146400     -0.6802000     -0.5080000    
 H   -4.127700     -0.2654000      -1.733100    
 H    2.536900      -2.881300      0.3208000    
 H    2.220600      -2.163500      -1.264700    
 H   -5.283000     -0.2773000       1.794000    
 H   -4.907500       1.400300       1.382600    
 H   -6.136000       1.064200      -2.238600    
 H   -5.479700       2.244100      -1.105500    
 H   -6.989100       1.229900       2.658200    
 H   -7.642600      4.1000001E-02   1.533500    
 H   -8.206900      0.8747000     -0.9431000    
 H   -7.896000       2.568500      -1.316600    
 H   -8.622100       2.236300       1.054000    
 H   -7.026700       2.975600      0.9389000    
 H    3.001200     -0.6886000       1.163900    
 H    4.794200      -2.000300      0.2632000    
 H    4.476900      -1.346100      -1.315400    
 H    5.784400     -0.7492000       2.039200    
 H    6.550700       2.966100      -1.161100    
 H    7.278700       1.120500       2.641500    
 H    7.660500       2.977300       1.041600    


%chk=000076786-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076786

0 1
Cl 3.999711 1.529641 -1.880739
N -4.184404 -0.078131 -0.537538
N 3.212755 -1.129213 0.202487
C -2.121820 -1.472967 -0.289157
C 0.826778 -1.870613 0.184405
C -1.565234 -2.787995 0.313301
C -1.178810 -0.289591 0.041720
C -0.110438 -3.061895 -0.136977
C 0.266571 -0.564144 -0.428744
C -3.570673 -1.216253 0.183227
C -5.588379 0.244022 -0.180819
C 2.270981 -2.157315 -0.284618
C -5.677735 0.897177 1.221536
C -6.175944 1.197998 -1.247404
C -7.129153 1.308516 1.567060
C -7.627874 1.613924 -0.914575
C -7.718393 2.252368 0.492169
C 4.578251 -1.190597 -0.355584
C 5.383240 0.029793 0.060557
C 5.200266 1.308216 -0.519912
C 6.354084 -0.072487 1.090850
C 5.926514 2.441822 -0.106684
C 7.095192 1.047639 1.529560
C 6.879228 2.308474 0.929824
H -2.137640 -1.593346 -1.398150
H 0.843218 -1.746585 1.292464
H -2.214952 -3.640952 0.030891
H -1.597308 -2.715557 1.421686
H -1.186282 -0.129539 1.141922
H -1.576062 0.636318 -0.412453
H -0.095222 -3.244108 -1.233149
H 0.267387 -3.986242 0.345430
H 0.936946 0.277482 -0.177051
H 0.281725 -0.658889 -1.536178
H -4.166160 -2.160585 0.069696
H -3.553420 -0.981855 1.265805
H -6.225899 -0.682067 -0.162630
H -4.093427 -0.210838 -1.556644
H 2.560796 -3.194607 0.027712
H 2.300657 -2.141195 -1.393666
H -5.290337 0.204882 1.993733
H -5.016686 1.787044 1.222983
H -6.138838 0.711575 -2.244756
H -5.528076 2.096673 -1.299810
H -7.154872 1.795145 2.561370
H -7.763352 0.400131 1.640146
H -8.284974 0.720182 -0.951634
H -8.002974 2.318811 -1.681754
H -8.770462 2.500884 0.733093
H -7.151403 3.206326 0.495786
H 3.213865 -1.047893 1.227866
H 5.142575 -2.110008 -0.057428
H 4.480859 -1.216663 -1.458171
H 6.524589 -1.054841 1.548465
H 5.752811 3.408555 -0.588303
H 7.835870 0.936816 2.328564
H 7.446939 3.185960 1.257423


