%chk=000029659.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029659

0 1
 Cl  1.7700000E-02   4.682100      8.0399998E-02
 O    4.343100      -2.856800     -7.0000000E-02
 O    5.306700     -0.8847000     -3.0099999E-02
 N   -1.952900      0.1398000     -1.0200000E-02
 N   -4.477500      -1.194100      7.2300002E-02
 N  -0.8876000       2.255600      3.2099999E-02
 N    4.278700      -1.603900     -4.4399999E-02
 C   -2.908000      0.3072000      -1.109700    
 C   -2.531300     -0.2625000       1.278200    
 C   -3.827200     -0.9125000      -1.213300    
 C   -3.461500      -1.464100       1.097100    
 C  -0.7732000      0.8922000      4.9999999E-03
 C   -5.393300      -2.327300     -5.3199999E-02
 C   0.4865000      0.2494000     -7.4000000E-03
 C    1.652700       1.042000      8.6000003E-03
 C   0.5939000      -1.150800     -3.5599999E-02
 C    1.524400       2.435600      3.6200002E-02
 C    2.907700      0.4116000     -3.8000001E-03
 C   0.2501000       2.982000      4.6700001E-02
 C    1.848400      -1.760200     -4.7400001E-02
 C    3.002600     -0.9808000     -3.1500001E-02
 H   -2.373500      0.4271000      -2.060100    
 H   -3.500200       1.216400     -0.9460000    
 H   -3.082700      0.5835000       1.708200    
 H   -1.742100     -0.5338000       1.990200    
 H   -4.583800     -0.7069000      -1.980200    
 H   -3.246300      -1.781100      -1.552100    
 H   -2.869300      -2.350400      0.8321000    
 H   -3.944900      -1.670700       2.059600    
 H   -4.878100      -3.246800     -0.3542000    
 H   -6.172800      -2.111200     -0.7923000    
 H   -5.905500      -2.514300      0.8971000    
 H  -0.2823000      -1.794000     -5.3500000E-02
 H    2.402500       3.075600      4.9100000E-02
 H    3.801500       1.033300      8.7000001E-03
 H    1.886500      -2.846400     -7.0299998E-02


%chk=000029659-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000029659

0 1
Cl 0.051204 4.573093 -1.333947
O 4.477502 -2.815592 0.707825
O 5.429793 -0.747158 0.582404
N -1.998437 0.163551 -0.027011
N -4.466147 -1.301303 0.192796
N -0.867749 2.131827 -0.618222
N 4.408628 -1.535633 0.550745
C -3.253014 0.740324 -0.569951
C -2.266835 -0.714081 1.142305
C -4.204827 -0.405917 -0.959864
C -3.207989 -1.860041 0.736418
C -0.793547 0.834206 -0.215902
C -5.467006 -2.341753 -0.112476
C 0.503104 0.179899 -0.045320
C 1.680843 1.025406 -0.088124
C 0.674202 -1.236176 0.075535
C 1.545646 2.412784 -0.426663
C 2.966250 0.439709 0.136488
C 0.262582 2.854325 -0.741485
C 1.935488 -1.803726 0.259749
C 3.066171 -0.938684 0.322030
H -3.009419 1.366611 -1.441225
H -3.734023 1.389384 0.190233
H -2.773905 -0.108493 1.923589
H -1.330132 -1.100119 1.568367
H -5.165983 0.027008 -1.293768
H -3.762202 -0.964019 -1.824812
H -2.686745 -2.522024 -0.005070
H -3.446504 -2.470171 1.627451
H -5.142912 -3.046027 -0.919549
H -6.410059 -1.864993 -0.433660
H -5.677044 -2.934027 0.795905
H -0.194595 -1.892322 -0.025020
H 2.414061 3.071684 -0.481515
H 3.870386 1.055233 0.143119
H 2.082214 -2.882684 0.344926


