%chk=000038968.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038968

0 1
 Cl   4.986500      -2.161500      0.5054000    
 N  -0.4415000     -0.2930000     -0.5659000    
 N   -3.706000      -1.944200      0.1964000    
 C  -0.2799000       1.067400     -0.5332000    
 C    1.051200       1.334300     -0.2706000    
 C   -1.415400       2.003800     -0.7562000    
 C    1.650800       2.696200     -0.1554000    
 C   -1.548200       3.030600      0.3690000    
 C   0.9302000       3.591500      0.8546000    
 C  -0.4426000       4.091700      0.3913000    
 C    1.716000      7.2499998E-02 -0.1399000    
 C   0.7566000     -0.9238000     -0.3290000    
 C   -1.687900     -0.9929000     -0.8079000    
 C   -2.450200      -1.263500      0.4861000    
 C    3.046300     -0.3198000      0.1219000    
 C    1.057600      -2.289400     -0.2686000    
 C    3.363300      -1.681600      0.1851000    
 C    2.381700      -2.650300     -7.1999999E-03
 C   -4.531000      -1.141700     -0.7087000    
 C   -4.437400      -2.226500       1.432900    
 H   -1.273700       2.516500      -1.715600    
 H   -2.378500       1.492600     -0.8235000    
 H    2.698800       2.608700      0.1550000    
 H    1.659800       3.173200      -1.143200    
 H   -2.503500       3.553800      0.2331000    
 H   -1.603600       2.528500       1.343200    
 H   0.8345000       3.080800       1.820900    
 H    1.560800       4.472900       1.027600    
 H  -0.7573000       4.881000       1.086000    
 H  -0.3567000       4.565700     -0.5940000    
 H   -2.237300     -0.4038000      -1.545200    
 H   -1.454300      -1.935000      -1.318500    
 H   -1.831800      -1.892100       1.139600    
 H   -2.623900     -0.3235000       1.027200    
 H    3.815600      0.4331000      0.2728000    
 H   0.3026000      -3.054700     -0.4111000    
 H    2.632900      -3.707500      4.4599999E-02
 H   -4.150400      -1.158800      -1.734200    
 H   -4.634400     -0.1030000     -0.3739000    
 H   -5.540100      -1.566300     -0.7813000    
 H   -5.350800      -2.793100       1.220200    
 H   -4.714700      -1.310700       1.967500    
 H   -3.833800      -2.848400       2.103500    


%chk=000038968-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000038968

0 1
Cl 4.987737 -2.272117 0.742921
N -0.474759 -0.264909 -0.675355
N -3.775363 -1.963613 0.169558
C -0.244782 1.132392 -0.605345
C 1.094183 1.366617 -0.265623
C -1.322206 2.151076 -0.880765
C 1.752934 2.717326 -0.101458
C -1.487911 3.214893 0.239990
C 1.022283 3.684863 0.868806
C -0.328852 4.237217 0.349294
C 1.721535 0.072186 -0.103690
C 0.718186 -0.930634 -0.357739
C -1.754528 -0.943527 -0.916018
C -2.555837 -1.158924 0.393712
C 3.040383 -0.335412 0.234099
C 0.999259 -2.312074 -0.278110
C 3.295757 -1.711292 0.305894
C 2.311615 -2.704417 0.058784
C -4.845279 -1.218199 -0.526396
C -4.269766 -2.598584 1.410033
H -1.098443 2.681528 -1.830644
H -2.294445 1.646791 -1.031937
H 2.786098 2.565304 0.265656
H 1.853332 3.223177 -1.086043
H -2.423879 3.774400 0.039237
H -1.622552 2.701356 1.212793
H 0.864241 3.174297 1.839797
H 1.691242 4.546985 1.065646
H -0.654099 5.053427 1.025475
H -0.168113 4.706119 -0.645195
H -2.341602 -0.363487 -1.648400
H -1.560451 -1.928709 -1.373960
H -1.905836 -1.702595 1.103743
H -2.781401 -0.162567 0.856476
H 3.833084 0.391763 0.432193
H 0.236064 -3.073872 -0.468120
H 2.575162 -3.763187 0.130582
H -4.493613 -0.858707 -1.508771
H -5.211591 -0.334813 0.057148
H -5.703547 -1.889108 -0.707083
H -5.118532 -3.264270 1.171282
H -4.615220 -1.863063 2.179737
H -3.470186 -3.213935 1.858595


