%chk=000063607.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063607

0 1
 Cl  0.2246000      -5.850200     -5.2499998E-02
 O   -4.199500      -1.235900      0.9235000    
 N   -2.251500     -0.4555000     -0.1465000    
 N   0.6426000      0.8568000     -4.6700001E-02
 N   -2.164300       1.812100     -0.8615000    
 C  -0.1772000      0.5342000      -1.193000    
 C   -1.615000      0.6441000     -0.7275000    
 C    2.064500      0.7749000     -0.3703000    
 C    2.923900       1.091800      0.8542000    
 C   -4.164100       1.001900      0.2861000    
 C   -3.543200     -0.3338000      0.4082000    
 C    4.395000       1.032800      0.5279000    
 C   -3.456700       2.011600     -0.3662000    
 C   -1.651600      -1.761300     -0.1240000    
 C   -5.447300       1.240900      0.7924000    
 C    5.077200     -0.1661000      0.6716000    
 C    5.041400       2.178600      8.9500003E-02
 C   -4.049600       3.271700     -0.5075000    
 C   -1.851400      -2.626600      -1.192200    
 C  -0.8793000      -2.142900      0.9660000    
 C    7.100500      0.9248000     -7.1999997E-02
 C    6.437900     -0.2202000      0.3699000    
 C    6.402200       2.124200     -0.2123000    
 C   -6.026000       2.500800      0.6455000    
 C   -5.328400       3.515600     -5.1000002E-03
 C   -1.269700      -3.894200      -1.170100    
 C  -0.2976000      -3.410500      0.9882000    
 C  -0.4927000      -4.286100     -7.9899997E-02
 C    8.555100      0.8664000     -0.3955000    
 H   3.9999999E-02 -0.4655000      -1.577200    
 H  -1.3100000E-02   1.250400      -2.007200    
 H    2.305000     -0.2340000     -0.7291000    
 H    2.303500       1.475600      -1.180500    
 H    2.677800       2.087900       1.245700    
 H    2.699600      0.3892000       1.667800    
 H   0.4272000       1.797600      0.2834000    
 H   -6.010000      0.4620000       1.299400    
 H    4.569400      -1.063500       1.013500    
 H    4.506100       3.116900     -2.4400000E-02
 H   -3.514600       4.074900      -1.008700    
 H   -2.455000      -2.329300      -2.045500    
 H  -0.7231000      -1.467900       1.803100    
 H    6.971200      -1.160300      0.4843000    
 H    6.907600       3.023500     -0.5545000    
 H   -7.021300       2.690200       1.036800    
 H   -5.778500       4.497300     -0.1199000    
 H   -1.430400      -4.565900      -2.009500    
 H   0.3053000      -3.702200       1.844300    
 H    8.814000       1.583000      -1.182400    
 H    9.147600       1.095000      0.4959000    
 H    8.839200     -0.1264000     -0.7608000    


%chk=000063607-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063607

0 1
Cl 0.291714 -5.924018 0.012085
O -4.383602 -1.469369 0.406711
N -2.362219 -0.467583 -0.298784
N 0.673798 0.933567 -0.003666
N -2.201994 1.911562 -0.683325
C -0.220547 0.604462 -1.144252
C -1.667543 0.699023 -0.692938
C 2.116211 0.843735 -0.333078
C 2.980432 1.227855 0.893772
C -4.330683 0.940233 0.126199
C -3.756311 -0.416370 0.102184
C 4.468256 1.117871 0.595556
C -3.532152 2.063112 -0.256708
C -1.707924 -1.768290 -0.239026
C -5.676587 1.127767 0.537500
C 5.171577 -0.090654 0.830503
C 5.183078 2.202622 0.027533
C -4.099626 3.366750 -0.219823
C -2.213425 -2.837752 -1.013142
C -0.605712 -1.963253 0.624684
C 7.258191 0.875280 -0.057996
C 6.541205 -0.210263 0.508112
C 6.552997 2.083311 -0.294397
C -6.224341 2.420336 0.572155
C -5.431009 3.540737 0.192133
C -1.605238 -4.108675 -0.939665
C 0.011970 -3.231138 0.698134
C -0.499385 -4.283805 -0.084683
C 8.740094 0.756951 -0.372461
H 0.024018 -0.410525 -1.500786
H -0.105335 1.308787 -1.998323
H 2.340460 -0.200361 -0.626781
H 2.402184 1.489756 -1.199278
H 2.727882 2.264617 1.195087
H 2.696329 0.567831 1.734365
H 0.428490 1.864466 0.368158
H -6.259004 0.245914 0.823322
H 4.641767 -0.945017 1.270845
H 4.662837 3.150356 -0.161889
H -3.472759 4.211544 -0.520642
H -3.084893 -2.686324 -1.655157
H -0.209854 -1.117803 1.197291
H 7.062469 -1.156331 0.700604
H 7.083480 2.938000 -0.732487
H -7.261346 2.569360 0.890593
H -5.864635 4.546443 0.220084
H -1.988298 -4.944379 -1.531443
H 0.868919 -3.393854 1.357602
H 9.031672 1.420332 -1.205840
H 9.357171 1.038597 0.503107
H 9.014523 -0.277011 -0.647052


