%chk=000028737.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028737

0 1
 Cl   4.813300      -2.158500      -1.651100    
 O  -0.8810000       1.677900       1.690400    
 O   -4.978000      -2.360200      0.5073000    
 O   -5.009400       2.116300      -1.195600    
 O   -6.252000     -0.3415000     -0.8974000    
 N    1.140900     -0.1607000       1.357600    
 N    3.767300     -8.2999999E-03  0.2449000    
 C    1.361200      0.4858000      5.8300000E-02
 C    2.085300      -1.271700       1.529100    
 C    2.784400       1.039700     -4.6500001E-02
 C    3.532100     -0.7758000       1.474400    
 C  -0.2372000     -0.6378000       1.466300    
 C    5.086800      0.1349000     -0.1985000    
 C   -1.182800      0.5419000       1.330800    
 C    5.693700     -0.7877000      -1.076900    
 C    5.855800       1.234300      0.2354000    
 C   -2.532200      0.3060000      0.7362000    
 C    7.011300     -0.6175000      -1.501800    
 C    7.173500       1.404400     -0.1896000    
 C   -3.135000       1.331400      4.5000002E-02
 C   -3.119800     -0.9264000      0.9047000    
 C    7.751300      0.4786000      -1.058100    
 C   -4.381100      -1.145700      0.3508000    
 C   -4.396300       1.112100     -0.5086000    
 C   -5.019300     -0.1264000     -0.3559000    
 C   -4.719200      -3.343200     -0.4931000    
 C   -5.842600       2.999000     -0.4469000    
 C   -6.371100     -0.2008000      -2.311100    
 H    1.193000     -0.2309000     -0.7579000    
 H   0.6878000       1.329600     -0.1199000    
 H    1.925000      -1.753800       2.501000    
 H    1.930500      -2.036200      0.7556000    
 H    2.913800       1.875500      0.6528000    
 H    2.936300       1.428500      -1.061000    
 H    3.749300     -0.1440000       2.345200    
 H    4.202100      -1.643000       1.523900    
 H  -0.4113000      -1.084800       2.451800    
 H  -0.4431000      -1.384800      0.6908000    
 H    5.428500       1.966400      0.9174000    
 H    7.476500      -1.329800      -2.178600    
 H    7.750200       2.256900      0.1569000    
 H   -2.652600       2.296300     -8.2699999E-02
 H   -2.647100      -1.725100       1.467900    
 H    8.777400      0.6110000      -1.388600    
 H   -5.269300      -4.251300     -0.2313000    
 H   -5.061800      -2.997300      -1.473200    
 H   -3.651100      -3.579700     -0.5304000    
 H   -5.256200       3.528700      0.3105000    
 H   -6.269700       3.733200      -1.135500    
 H   -6.660400       2.448000      2.8200001E-02
 H   -5.424900     -0.3944000      -2.828500    
 H   -7.105800     -0.9321000      -2.661000    
 H   -6.743500      0.7971000      -2.558700    


%chk=000028737-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028737

0 1
Cl 5.876885 -2.611681 0.047735
O -0.795711 1.744927 0.240642
O -4.640489 -2.899112 -0.223178
O -5.915433 1.841481 -0.131221
O -6.700171 -0.839185 -0.211452
N 1.285577 -0.160308 0.537482
N 4.152674 0.028140 0.233283
C 1.888951 0.582475 -0.596488
C 2.171176 -1.273888 0.960710
C 3.272499 1.132216 -0.208483
C 3.549496 -0.728036 1.362409
C -0.088839 -0.606737 0.289114
C 5.554469 0.212102 0.187082
C -1.129005 0.524410 0.193610
C 6.477973 -0.877524 0.141884
C 6.135241 1.518100 0.128330
C -2.569454 0.132855 0.036216
C 7.870141 -0.695606 0.087911
C 7.528242 1.715238 0.047154
C -3.530970 1.177447 -0.015502
C -2.995432 -1.210719 -0.049974
C 8.408977 0.611040 0.041275
C -4.368002 -1.527258 -0.187879
C -4.897008 0.873762 -0.132733
C -5.343281 -0.486895 -0.224262
C -5.828278 -3.419759 -0.924554
C -5.513459 3.238604 0.071987
C -7.581616 -0.261389 -1.251908
H 2.002432 -0.077522 -1.494621
H 1.229490 1.427130 -0.851364
H 1.715729 -1.779900 1.832847
H 2.311479 -2.030656 0.148119
H 3.136302 1.896395 0.591426
H 3.722131 1.621064 -1.090507
H 3.426149 -0.052848 2.239777
H 4.207984 -1.560493 1.651446
H -0.395688 -1.270481 1.121423
H -0.182137 -1.224746 -0.645732
H 5.473499 2.388455 0.171580
H 8.524206 -1.572098 0.052224
H 7.925191 2.735658 0.007150
H -3.162575 2.204014 0.061321
H -2.296831 -2.051048 -0.029524
H 9.492869 0.753008 -0.011212
H -5.640370 -4.501534 -1.010041
H -6.746326 -3.224643 -0.349988
H -5.919492 -2.975281 -1.934333
H -4.867530 3.594489 -0.752938
H -6.454735 3.807316 0.082850
H -4.986490 3.362413 1.036542
H -7.247198 -0.583697 -2.257659
H -8.579263 -0.673011 -1.036786
H -7.590475 0.837415 -1.186390


