%chk=000063971.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063971

0 1
 Cl   2.960500      -6.003700     -0.5161000    
 O    1.246600       1.506200       2.059400    
 N   0.8856000       1.860800     -0.2140000    
 N   -6.660700      0.2499000      0.2058000    
 N    2.678700       2.083100      -1.732400    
 N  -0.4651000       1.848300     -6.9700003E-02
 N  -0.3346000     -0.4727000     -0.4466000    
 N  -1.9700000E-02  -1.031000      0.6288000    
 C    3.126900       1.706400      0.6582000    
 C    3.567600       1.908100     -0.6571000    
 C    1.406800       2.054500      -1.481700    
 C    1.670800       1.678000      0.9214000    
 C   -5.258000      0.3587000      0.1069000    
 C   -2.522300      0.5712000     -8.5900001E-02
 C   -1.037100      0.6861000     -0.1900000    
 C   -4.584900       1.359800      0.8074000    
 C   -4.543700     -0.5347000     -0.6914000    
 C   -3.197800       1.467500      0.7095000    
 C   -3.156300     -0.4269000     -0.7891000    
 C    4.039300       1.534800       1.704100    
 C    4.944100       1.935500     -0.9076000    
 C   0.4344000       2.239100      -2.619000    
 C    5.407000       1.564600       1.436300    
 C    5.859000       1.764800      0.1330000    
 C   -7.473500       1.426800      0.4407000    
 C   -7.309000      -1.038300      5.9999999E-02
 C   0.6886000      -2.213500      0.3575000    
 C    2.074800      -2.177000      0.2409000    
 C  -7.9999998E-04  -3.412900      0.2062000    
 C    2.778200      -3.350800     -2.9500000E-02
 C   0.7024000      -4.586800     -6.4099997E-02
 C    2.092100      -4.555700     -0.1819000    
 H   -5.109600       2.062700       1.448300    
 H   -5.038000      -1.316500      -1.261000    
 H   -2.688600       2.245800       1.269500    
 H   -2.620800      -1.124300      -1.425800    
 H    3.705400       1.377200       2.725600    
 H    5.313400       2.090100      -1.918600    
 H  -6.3800000E-02   1.290500      -2.837200    
 H   0.9648000       2.565200      -3.518700    
 H  -0.3181000       2.991900      -2.368100    
 H    6.121100       1.431600       2.243800    
 H    6.925100       1.787700     -7.3799998E-02
 H   -8.518900       1.246800      0.1656000    
 H   -7.131900       2.276800     -0.1608000    
 H   -7.455700       1.705800       1.499400    
 H   -6.759800      -1.826300      0.5879000    
 H   -7.399600      -1.309800     -0.9969000    
 H   -8.319400      -1.022100      0.4836000    
 H    2.619800      -1.246100      0.3586000    
 H   -1.083400      -3.445700      0.2967000    
 H    3.860800      -3.311300     -0.1186000    
 H   0.1545000      -5.518300     -0.1806000    


%chk=000063971-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000063971

0 1
Cl 3.245325 -6.451176 -1.243427
O 0.573569 1.067491 1.907988
N 0.874261 1.556990 -0.383239
N -6.863307 0.607330 0.212143
N 2.990581 2.273673 -1.276900
N -0.514579 1.504920 -0.623462
N -0.595080 -0.943376 -0.343399
N 0.644300 -1.138421 0.022535
C 2.812542 1.583292 1.104593
C 3.577442 2.019683 -0.024762
C 1.691225 2.059558 -1.424630
C 1.363919 1.364923 0.973826
C -5.477613 0.539091 0.079064
C -2.616655 0.401760 -0.195562
C -1.152875 0.353928 -0.307096
C -4.663285 1.717751 0.175953
C -4.812504 -0.710971 -0.152532
C -3.271955 1.642434 0.044469
C -3.419372 -0.770286 -0.288798
C 3.447856 1.354929 2.354032
C 4.978105 2.221971 0.124976
C 1.022235 2.328427 -2.745218
C 4.832049 1.555155 2.485030
C 5.596687 1.990229 1.364535
C -7.523158 1.904186 0.423195
C -7.671329 -0.619782 0.164568
C 1.175063 -2.424296 -0.323298
C 0.486639 -3.424745 -1.067507
C 2.497294 -2.665218 0.135530
C 1.117534 -4.649492 -1.347980
C 3.136520 -3.890374 -0.140240
C 2.433789 -4.863892 -0.878775
H -5.121900 2.690048 0.374891
H -5.390481 -1.635199 -0.237022
H -2.659569 2.544049 0.142825
H -2.929971 -1.730379 -0.477799
H 2.829925 1.024684 3.195592
H 5.543287 2.560146 -0.748809
H 0.604005 1.402790 -3.180744
H 1.769933 2.751586 -3.431246
H 0.174986 3.025265 -2.620289
H 5.324291 1.380914 3.447746
H 6.675669 2.148036 1.471881
H -8.613891 1.758445 0.457953
H -7.300419 2.612179 -0.399287
H -7.210048 2.375961 1.376498
H -7.367175 -1.339326 0.950702
H -7.587913 -1.128755 -0.816863
H -8.730632 -0.367579 0.327204
H -0.531493 -3.223437 -1.413985
H 3.003669 -1.879726 0.705602
H 0.605424 -5.428734 -1.919880
H 4.154280 -4.084759 0.208320


