%chk=000051921.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051921

0 1
 Cl   4.034100      -3.476800      -1.131300    
 Cl  -6.240000     -0.4892000      0.9567000    
 O    1.020900      -3.348100      0.3128000    
 O    1.919900       3.916300     -4.6900000E-02
 O   -4.159700       1.261300     -0.4103000    
 N    1.999900      -1.209200      0.2549000    
 N    2.344300       1.604000      0.1215000    
 N   -2.765300     -0.6228000     -0.1961000    
 C   0.9032000     -0.3546000      0.1096000    
 C    1.072700       1.028400      4.3400001E-02
 C   -1.485800     -7.2600000E-02 -0.1158000    
 C  -0.3761000     -0.9050000      3.0099999E-02
 C  -3.7000000E-02   1.860800     -0.1022000    
 C   -1.316300       1.310400     -0.1820000    
 C    1.999900      -2.606800      0.3362000    
 C    2.680900       2.961500      7.2200000E-02
 C   -3.987900      4.6999998E-02 -0.3428000    
 C    3.389300      -3.178900      0.4906000    
 C    4.169700       3.170900      0.1905000    
 C   -5.166500     -0.8964000     -0.3911000    
 H  -0.5807000      -1.964900      7.2400004E-02
 H   6.6999998E-03   2.938600     -0.1622000    
 H   -2.125300       2.018200     -0.2958000    
 H    2.912500     -0.7700000      0.2985000    
 H    3.125700      0.9665000      0.2279000    
 H   -2.800500      -1.638300     -0.1433000    
 H    4.054900      -2.492900       1.021300    
 H    3.343300      -4.125000       1.037000    
 H    4.521100       2.790400       1.153800    
 H    4.400400       4.237700      0.1243000    
 H    4.684200       2.646400     -0.6197000    
 H   -4.874700      -1.945000     -0.2965000    
 H   -5.704000     -0.7563000      -1.332900    


%chk=000051921-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051921

0 1
Cl 4.784999 -1.879031 1.136228
Cl -5.067541 -2.657770 0.068603
O 1.065105 -3.323121 0.306816
O 2.136892 3.665066 0.613092
O -4.286852 1.280224 -0.647429
N 1.938448 -1.134462 0.458872
N 2.405900 1.505390 -0.263111
N -2.891577 -0.561577 -0.156341
C 0.810550 -0.329819 0.121701
C 1.050562 1.046592 -0.181506
C -1.593267 0.025531 -0.157617
C -0.504652 -0.840969 0.106545
C -0.051577 1.899050 -0.412003
C -1.370005 1.406737 -0.397149
C 2.008854 -2.507716 0.540315
C 2.875368 2.779977 0.099933
C -4.102437 0.051778 -0.385796
C 3.350097 -3.115166 0.964861
C 4.358995 3.008377 -0.177700
C -5.359685 -0.822772 -0.323338
H -0.660345 -1.905333 0.302501
H 0.131278 2.958607 -0.599580
H -2.216081 2.069826 -0.582583
H 2.789179 -0.630857 0.740711
H 3.074977 0.895084 -0.740901
H -2.939047 -1.569653 0.036717
H 3.251401 -3.594745 1.950069
H 3.671074 -3.850605 0.213634
H 4.893496 2.109458 -0.531394
H 4.841228 3.369029 0.746323
H 4.467154 3.805621 -0.933914
H -5.870513 -0.799494 -1.296937
H -6.028179 -0.447658 0.465179


