%chk=000076837.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076837

0 1
 Cl  -1.612100      -3.004900      0.9251000    
 O   -2.067000       2.655900      -1.781900    
 O  -0.2683000       1.400500      -1.692900    
 O   -6.183100       1.195600      0.1905000    
 O   -6.296300     -0.7484000       1.203900    
 N   0.4768000     -0.3542000      0.3275000    
 N    5.820600      -1.447900     -0.9684000    
 N  -0.2400000     -0.7962000     -0.5988000    
 N   -1.476400       1.607300      -1.432000    
 N   -5.653200      0.1242000      0.5721000    
 C    2.838500      0.2781000      0.4957000    
 C    4.187400      1.5000000E-03  0.1691000    
 C    1.829500     -0.5817000      3.1500001E-02
 C    4.487800      -1.126200     -0.6121000    
 C    2.538200       1.405800       1.276900    
 C    5.196400      0.8613000      0.6328000    
 C    2.146300      -1.697900     -0.7433000    
 C    3.472700      -1.969800      -1.064600    
 C    3.553600       2.248900       1.729500    
 C    4.880000       1.977300       1.408000    
 C   -1.594600     -0.5682000     -0.3020000    
 C   -2.203200      0.6171000     -0.7131000    
 C   -4.283100     -0.1080000      0.2793000    
 C   -3.547900      0.8472000     -0.4223000    
 C   -2.329000      -1.523800      0.3994000    
 C   -3.673700      -1.293500      0.6903000    
 H    1.513500       1.650900       1.547400    
 H    6.248000      0.7025000      0.4155000    
 H    1.397700      -2.402200      -1.098200    
 H    3.703900      -2.846700      -1.664500    
 H    3.308100       3.118000       2.332900    
 H    5.669400       2.634700       1.760800    
 H   -4.027100       1.769800     -0.7414000    
 H   -4.230100      -2.051200       1.237900    
 H    5.994000      -2.270300      -1.532400    
 H    6.606900     -0.8876000     -0.6777000    


%chk=000076837-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076837

0 1
Cl -1.057973 -0.933893 2.448134
O -3.066989 0.843178 -3.433381
O -0.944555 1.124547 -2.636438
O -6.715776 0.160927 -0.323237
O -6.277470 -0.547026 1.807291
N 0.670447 0.243513 0.176844
N 5.903907 -1.283860 -1.290183
N -0.325794 -0.200095 -0.537523
N -2.187643 0.793836 -2.484151
N -5.903800 -0.171878 0.625865
C 3.057367 0.294044 0.607174
C 4.408593 -0.081543 0.263050
C 1.952356 -0.173524 -0.212031
C 4.630611 -0.910989 -0.911508
C 2.836050 1.110471 1.760799
C 5.484734 0.376496 1.089666
C 2.212848 -0.982650 -1.347302
C 3.521593 -1.341176 -1.692195
C 3.907043 1.547729 2.545143
C 5.243390 1.176831 2.209844
C -1.649517 -0.040515 -0.165858
C -2.629174 0.326737 -1.157452
C -4.457487 -0.126153 0.346809
C -4.012109 0.276844 -0.922423
C -2.181371 -0.436736 1.112109
C -3.550148 -0.483124 1.374976
H 1.805874 1.380305 2.007061
H 6.522555 0.105401 0.862851
H 1.366451 -1.299438 -1.964514
H 3.702878 -1.951454 -2.584640
H 3.722329 2.175461 3.423244
H 6.078018 1.518138 2.830919
H -4.717757 0.557242 -1.707832
H -3.937129 -0.781048 2.352541
H 6.042957 -1.864889 -2.113810
H 6.728893 -0.983809 -0.779343


