%chk=000082612.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082612

0 1
 Cl   3.668600       2.355200     -0.1070000    
 N    4.540300     -0.2696000      -1.377700    
 N   -4.972300      0.5348000      -1.406500    
 C  -0.2809000     -0.5100000       1.641700    
 C    1.002700     -0.4368000      0.8395000    
 C   -1.510100     -0.2364000      0.8430000    
 C    1.668000      0.7716000      0.7414000    
 C    1.478200      -1.581100      0.2255000    
 C   -2.179300      -1.284700      0.2113000    
 C   -1.990900       1.067900      0.7275000    
 C    2.849800      0.8381000      3.5000001E-03
 C    2.659900      -1.514500     -0.5125000    
 C    3.345800     -0.3050000     -0.6235000    
 C   -3.329200      -1.028800     -0.5356000    
 C   -3.140800       1.323800     -1.9500000E-02
 C   -3.809900      0.2755000     -0.6511000    
 H  -0.2222000      0.1873000       2.489300    
 H  -0.3568000      -1.496900       2.119500    
 H    1.276800       1.658400       1.233300    
 H   0.9519000      -2.527500      0.3068000    
 H   -1.816300      -2.305800      0.2934000    
 H   -1.480100       1.894100       1.214900    
 H    3.034800      -2.413200     -0.9957000    
 H   -3.841700      -1.854200      -1.023000    
 H   -3.505400       2.344500     -0.1019000    
 H    5.050600      0.5989000      -1.468200    
 H    4.884700      -1.108700      -1.824700    
 H   -5.320800       1.480500      -1.490900    
 H   -5.457700     -0.2246000      -1.865300    


%chk=000082612-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000082612

0 1
Cl 2.935080 1.895373 -1.855219
N 4.712801 -0.523932 -1.326231
N -5.086587 0.958563 -1.278792
C -0.303854 -0.607254 1.606620
C 0.998242 -0.606903 0.805211
C -1.549130 -0.177328 0.834574
C 1.323406 0.472086 -0.057244
C 1.941088 -1.657660 0.929305
C -1.895541 -0.782937 -0.401772
C -2.418259 0.820919 1.339650
C 2.543904 0.479423 -0.743519
C 3.166213 -1.641164 0.233606
C 3.509614 -0.560419 -0.630055
C -3.059061 -0.416017 -1.102873
C -3.588650 1.203532 0.651664
C -3.929986 0.587978 -0.585673
H -0.192590 0.060173 2.485580
H -0.450243 -1.626445 2.019315
H 0.614979 1.295166 -0.195105
H 1.713480 -2.508556 1.583308
H -1.234891 -1.549623 -0.825220
H -2.176255 1.312102 2.291228
H 3.874922 -2.470382 0.347973
H -3.299855 -0.901924 -2.057039
H -4.239526 1.982333 1.068731
H 4.922460 0.262722 -1.935531
H 5.389001 -1.274597 -1.231213
H -5.702236 1.679734 -0.915915
H -5.320828 0.527838 -2.167864


