%chk=000091008.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091008

0 1
 Cl  -5.973800      -4.468600     -0.3475000    
 N   0.5374000      0.9565000       1.006100    
 N    3.242900      0.2109000      0.4734000    
 C    1.058700     -0.3336000       1.473800    
 C    1.604100       1.965000       1.032000    
 C  -0.5919000       1.383200       1.831600    
 C    2.205500     -0.8190000      0.5836000    
 C    2.768100       1.556300      0.1263000    
 C   -1.736800      0.3690000       1.727200    
 C   -2.244600      0.1935000      0.2719000    
 C    4.539500     -0.1482000      8.8799998E-02
 C   -3.191500     -0.9894000      0.1145000    
 C   -2.843500       1.465300     -0.3215000    
 C    4.765900      -1.247400     -0.7635000    
 C    5.658300      0.5788000      0.5423000    
 C   -3.232600      -1.652800      -1.093900    
 C   -3.977200      -1.360000       1.185700    
 C   -2.754300       1.668300      -1.681600    
 C   -3.453100       2.367900      0.5227000    
 C    6.058400      -1.605000      -1.146800    
 C    6.950800      0.2212000      0.1590000    
 C    7.151000     -0.8707000     -0.6856000    
 C   -4.099000      -2.736300      -1.237700    
 C   -4.843800      -2.443600       1.041800    
 C   -3.301700       2.830800      -2.224100    
 C   -4.000500       3.530500     -1.9900000E-02
 C   -4.904800      -3.131700     -0.1700000    
 C   -3.924900       3.762000      -1.393400    
 C    8.533100      -1.253000      -1.095200    
 H   0.3118000      -1.130000       1.428500    
 H    1.404800     -0.2611000       2.513700    
 H    1.971000       2.115800       2.056300    
 H    1.218300       2.928600      0.6777000    
 H  -0.2944000       1.476500       2.884600    
 H  -0.9303000       2.376100       1.518100    
 H    2.616200      -1.735400       1.026000    
 H    1.819500      -1.067000     -0.4137000    
 H    2.450500       1.566400     -0.9244000    
 H    3.561200       2.305400      0.2315000    
 H   -2.525900      0.7046000       2.409200    
 H   -1.444900     -0.5988000       2.150500    
 H   -1.359700     -5.7900000E-02 -0.3305000    
 H    3.938700      -1.835500      -1.152800    
 H    5.527900       1.425800       1.212200    
 H   -2.602500      -1.366700      -1.929800    
 H   -3.976800     -0.8398000       2.136100    
 H   -2.260300      0.9604000      -2.339000    
 H   -3.566200       2.222200       1.589100    
 H    6.201700      -2.457000      -1.806000    
 H    7.794400      0.7982000      0.5287000    
 H   -4.133800      -3.265200      -2.186900    
 H   -5.469300      -2.737900       1.880700    
 H   -3.240200       3.012600      -3.293200    
 H   -4.492000       4.252700      0.6255000    
 H   -4.352000       4.666700      -1.816000    
 H    8.952400      -1.968000     -0.3806000    
 H    8.538300      -1.708300      -2.091500    
 H    9.188500     -0.3765000      -1.140500    


%chk=000091008-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000091008

0 1
Cl -6.572060 -4.337658 -0.402720
N 0.548690 0.819062 1.093859
N 3.308986 0.191439 0.446709
C 1.186415 -0.430056 1.575422
C 1.572010 1.888358 0.987585
C -0.609798 1.245591 1.920442
C 2.314574 -0.881095 0.629540
C 2.690276 1.468063 0.021202
C -1.826383 0.302091 1.809976
C -2.313966 0.095322 0.346926
C 4.616212 -0.141563 -0.001584
C -3.368832 -1.010336 0.208837
C -2.801003 1.421650 -0.261894
C 4.974023 -1.472708 -0.365287
C 5.643915 0.848989 -0.060663
C -3.649225 -1.531760 -1.082783
C -4.097042 -1.532911 1.307175
C -1.944964 2.177328 -1.103268
C -4.092849 1.932568 0.027179
C 6.295763 -1.791157 -0.748752
C 6.951699 0.516462 -0.457225
C 7.314875 -0.811872 -0.806680
C -4.615978 -2.539306 -1.281816
C -5.072616 -2.543034 1.132174
C -2.368123 3.412892 -1.645124
C -4.516987 3.168677 -0.508644
C -5.316930 -3.031035 -0.162833
C -3.656238 3.914349 -1.348438
C 8.736626 -1.158917 -1.214666
H 0.430164 -1.233702 1.623276
H 1.609401 -0.293292 2.603654
H 2.022290 2.123927 1.985298
H 1.085478 2.804726 0.604057
H -0.327335 1.339798 3.000567
H -0.905773 2.253547 1.574192
H 2.808456 -1.758891 1.081099
H 1.869219 -1.195765 -0.344333
H 2.257293 1.363656 -1.001519
H 3.451962 2.262056 -0.016401
H -2.639372 0.737052 2.424810
H -1.585622 -0.683396 2.254966
H -1.420146 -0.210730 -0.231838
H 4.222575 -2.267527 -0.374105
H 5.429734 1.881556 0.234373
H -3.106485 -1.136893 -1.949926
H -3.911185 -1.162204 2.320076
H -0.942530 1.789640 -1.324494
H -4.775862 1.350712 0.657970
H 6.531197 -2.827703 -1.021748
H 7.713972 1.306057 -0.482698
H -4.820172 -2.933250 -2.281658
H -5.627320 -2.939658 1.987696
H -1.696192 3.980592 -2.299325
H -5.520041 3.546837 -0.279687
H -3.987939 4.869957 -1.769980
H 9.447358 -1.008505 -0.378903
H 8.816636 -2.213183 -1.532581
H 9.085766 -0.528047 -2.053991


