%chk=000051338.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051338

0 1
 Cl  -6.720100       1.798700      -2.626000    
 O    2.037400     -0.4516000       1.135900    
 O    4.287600       1.855200     -0.4173000    
 O    4.326300      0.7805000       1.619400    
 C    2.498600      0.3660000      6.1700001E-02
 C    2.777100     -0.5448000      -1.147700    
 C    3.698900      -1.732500     -0.8423000    
 C    1.447900       1.440500     -0.2162000    
 C    3.857500      -2.636500      -2.066300    
 C    3.802100       1.004800      0.5351000    
 C   0.6831000     -0.6124000       1.245900    
 C    4.801300      -3.795000      -1.784900    
 C  -6.4199999E-02  0.2777000       2.017300    
 C   5.0000001E-02  -1.666500      0.5874000    
 C   -2.078000     -0.9405000       1.471600    
 C   -3.553800      -1.116500       1.591900    
 C   -1.444700      0.1136000       2.130100    
 C   -1.330500      -1.830500      0.7003000    
 C    5.510600       2.521000     -8.6800002E-02
 C   -4.349200     -0.3830000      0.5307000    
 C    5.909700       3.419300      -1.238000    
 C   -4.657700      -1.017200     -0.6727000    
 C   -4.774400      0.9258000      0.7582000    
 C   -5.391200     -0.3427000      -1.648600    
 C   -5.507900       1.600600     -0.2177000    
 C   -5.816300      0.9663000      -1.421100    
 H    3.213000      4.4199999E-02  -1.965100    
 H    1.828800     -0.9370000      -1.534900    
 H    3.297400      -2.325300     -1.2700000E-02
 H    4.684800      -1.367500     -0.5316000    
 H   0.4908000       1.051800     -0.5794000    
 H    1.801600       2.104700      -1.015900    
 H    1.279100       2.093300      0.6470000    
 H    2.880100      -3.032600      -2.365700    
 H    4.245500      -2.055300      -2.910900    
 H    5.798200      -3.432200      -1.514900    
 H    4.427000      -4.415200     -0.9643000    
 H    4.899000      -4.428300      -2.672200    
 H   0.4206000       1.088500       2.554300    
 H   0.6225000      -2.373500     -5.7999999E-03
 H   -3.890500     -0.7922000       2.586500    
 H   -3.808100      -2.185200       1.561800    
 H   -2.013900      0.8111000       2.738700    
 H   -1.810300      -2.658000      0.1844000    
 H    5.366300       3.121200      0.8184000    
 H    6.294700       1.776600      9.0899996E-02
 H    6.039600       2.835300      -2.155100    
 H    5.126600       4.157700      -1.439800    
 H    6.843100       3.945100      -1.018700    
 H   -4.333100      -2.036900     -0.8620000    
 H   -4.541400       1.431000       1.691800    
 H   -5.624100     -0.8494000      -2.581700    
 H   -5.832500       2.620200     -2.6600000E-02


%chk=000051338-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000051338

0 1
Cl -7.723400 2.119868 -1.655549
O 1.947611 0.140218 1.172676
O 4.730142 1.786139 -0.497934
O 4.421056 1.072222 1.697746
C 2.627796 0.726256 -0.025421
C 2.841855 -0.350273 -1.126034
C 3.713068 -1.548395 -0.690483
C 1.842296 1.940199 -0.570564
C 3.695496 -2.698357 -1.722724
C 3.991682 1.189208 0.535441
C 0.590376 -0.250721 1.053948
C 4.590297 -3.886470 -1.308428
C -0.426674 0.633975 1.489837
C 0.247794 -1.557301 0.633199
C -2.135511 -1.086384 1.057875
C -3.589714 -1.553313 1.103025
C -1.773133 0.217186 1.487414
C -1.105773 -1.962837 0.636212
C 6.089504 2.283358 -0.121139
C -4.594643 -0.617522 0.433126
C 6.692948 2.908851 -1.374323
C -4.367910 -0.121414 -0.877140
C -5.795428 -0.253332 1.091376
C -5.312029 0.708344 -1.519653
C -6.754467 0.578465 0.467645
C -6.495580 1.045118 -0.833625
H 3.299212 0.147612 -2.001481
H 1.840208 -0.704756 -1.441485
H 3.367559 -1.920405 0.293801
H 4.759708 -1.212660 -0.541724
H 0.860317 1.615993 -0.957383
H 2.408416 2.414903 -1.388374
H 1.676796 2.688883 0.223595
H 2.651825 -3.050976 -1.859850
H 4.022554 -2.312676 -2.710088
H 5.645062 -3.570088 -1.202483
H 4.268819 -4.303674 -0.335611
H 4.554841 -4.700751 -2.055225
H -0.144188 1.629685 1.846429
H 1.037903 -2.253974 0.337059
H -3.894969 -1.699458 2.158299
H -3.652545 -2.552355 0.627263
H -2.553856 0.909751 1.823871
H -1.361182 -2.980469 0.315109
H 5.977171 3.009165 0.704546
H 6.680027 1.427566 0.253692
H 6.778048 2.165925 -2.185856
H 6.073688 3.748473 -1.733751
H 7.704037 3.294712 -1.149502
H -3.440089 -0.381284 -1.399495
H -5.991412 -0.620896 2.105860
H -5.132612 1.084940 -2.530910
H -7.678098 0.856125 0.983591


