%chk=000057995.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057995

0 1
 Cl   3.852600       2.724900     -0.2888000    
 F   -2.722000      0.6400000       1.969800    
 F   -3.516900      -1.296100       1.367700    
 F   -4.154400      0.5126000      0.3310000    
 F  -0.5770000      0.9754000      -1.599600    
 F   -1.114400       1.952000      0.2647000    
 F   -2.616400       1.678100      -1.292500    
 O   -2.412600      -1.076000      -1.163500    
 O    1.701100      -1.942400      -1.992100    
 N   0.4466000      -1.856700      -1.391100    
 C   -1.938700     -0.2601000     -9.0599999E-02
 C  -0.7567000     -0.9644000      0.6157000    
 C   -3.093500     -0.1005000      0.9010000    
 C   -1.561600       1.096600     -0.6797000    
 C   0.4748000      -1.187100     -0.2748000    
 C    1.775800     -0.6522000      0.1514000    
 C    2.145000      0.6290000     -0.2309000    
 C    2.612600      -1.437200      0.9308000    
 C    3.379200       1.136600      0.1753000    
 C    3.846600     -0.9297000       1.337000    
 C    4.229900      0.3573000      0.9595000    
 H  -0.4515000     -0.3943000       1.501200    
 H   -1.064800      -1.962100      0.9537000    
 H   -2.676100      -1.935100     -0.7916000    
 H    1.495600       1.241700     -0.8449000    
 H    2.321400      -2.440200       1.230100    
 H    4.508900      -1.536400       1.947600    
 H    5.194400      0.7397000       1.283700    
 H    1.501100      -2.459600      -2.790400    


%chk=000057995-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000057995

0 1
Cl 5.308518 1.147419 -1.449388
F -2.915315 -0.195984 2.295722
F -3.185638 -2.148657 1.180721
F -4.424307 -0.349003 0.609374
F -0.986134 1.522220 -1.166817
F -1.569285 1.879714 0.992953
F -3.164412 1.761054 -0.612409
O -2.395414 -0.955524 -1.251792
O 1.195134 -1.395332 -2.602749
N 0.142092 -1.326938 -1.618218
C -2.022620 -0.360328 -0.002413
C -0.662382 -0.878329 0.579684
C -3.150456 -0.748075 1.008610
C -1.957528 1.199793 -0.190190
C 0.505600 -0.903360 -0.418282
C 1.861844 -0.520289 0.047911
C 2.832738 0.038856 -0.832733
C 2.200351 -0.700198 1.420854
C 4.084868 0.411666 -0.318588
C 3.473476 -0.335679 1.901478
C 4.433738 0.233123 1.034230
H -0.396368 -0.258114 1.449404
H -0.839719 -1.907457 0.942958
H -1.514197 -1.240453 -1.702213
H 2.603662 0.185959 -1.888202
H 1.481431 -1.145589 2.115562
H 3.724375 -0.489325 2.955652
H 5.421298 0.528703 1.399320
H 0.743652 -1.796073 -3.390738


