%chk=000128386.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128386

0 1
 Cl  -1.479200      -3.110300     -0.1710000    
 O    9.428800     -0.4595000     -9.5700003E-02
 O   7.4299999E-02 -0.6828000      0.6999000    
 O    2.546400      -1.196200     -0.2337000    
 O   -9.407800      0.6652000     -0.5542000    
 N    6.803700      0.6393000     -0.1507000    
 N    3.109000       1.061300     -0.2863000    
 N   -6.308300     -0.7925000      0.3707000    
 N   -7.635100     -0.5641000      0.2236000    
 C    7.066600     -0.7441000     -0.5711000    
 C    7.790400       1.055900      0.8554000    
 C    5.444400      0.7742000      0.3687000    
 C    8.494100     -0.8633000      -1.097200    
 C    9.200500      0.8950000      0.2948000    
 C    4.452700      0.9172000     -0.7764000    
 C   -5.959800       1.553700     -0.2853000    
 C    2.260900     -1.5500000E-02 -5.3800002E-02
 C   -5.483200      0.1757000      0.1128000    
 C   -7.214000       1.422400      -1.117400    
 C   -4.020200     -5.8699999E-02  0.2656000    
 C   0.9087000      0.4306000      0.4603000    
 C   -1.279700     -0.4960000      0.5514000    
 C   -8.193100      0.5017000     -0.4443000    
 C   -3.484900      -1.321200      9.9999998E-03
 C   -3.185300      0.9852000      0.6641000    
 C   -2.114700      -1.539800      0.1527000    
 C   -1.815000      0.7665000      0.8071000    
 H    6.936500      -1.431000      0.2755000    
 H    6.382200      -1.055600      -1.366600    
 H    7.685300      0.4485000       1.763900    
 H    7.639000       2.106600       1.128200    
 H    5.174300     -5.8400001E-02   1.031700    
 H    5.362700       1.683500      0.9804000    
 H    8.643800     -0.2614000      -2.001900    
 H    8.711200      -1.905300      -1.353200    
 H    9.938000       1.148300       1.063100    
 H    9.373600       1.557400     -0.5622000    
 H    4.675500       1.810100      -1.371400    
 H    4.478500      5.2099999E-02  -1.446500    
 H    2.774800       2.001400     -9.4499998E-02
 H   -6.166900       2.114500      0.6339000    
 H   -5.196400       2.089800     -0.8571000    
 H   -6.983800       1.001000      -2.102800    
 H   -7.677400       2.403900      -1.260500    
 H   0.4974000       1.096600     -0.3102000    
 H    1.059000      0.9837000       1.394500    
 H   -4.129900      -2.137200     -0.3082000    
 H   -3.578000       1.972000      0.8921000    
 H   -1.208400       1.598600       1.151900    
 H   -8.230400      -1.280700      0.6267000    


%chk=000128386-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128386

0 1
Cl -0.261032 0.421267 2.387202
O 9.248461 -1.011334 0.168483
O 0.427568 1.181555 -0.378498
O 3.225073 1.820838 -2.599548
O -9.122480 -0.406918 1.479115
N 6.474564 -0.155028 0.317035
N 3.028763 1.323724 -0.315028
N -5.553577 0.275705 1.729579
N -6.919442 0.107968 1.994505
C 7.303109 0.115782 -0.888553
C 6.935550 -1.400954 0.983956
C 5.021978 -0.146732 0.037142
C 8.785235 0.220161 -0.494346
C 8.421192 -1.270945 1.358273
C 4.471588 1.300005 -0.036681
C -6.229037 0.510782 -0.655527
C 2.528977 1.565173 -1.569155
C -5.194301 0.450351 0.462689
C -7.442830 -0.395291 -0.342911
C -3.749837 0.644060 0.200620
C 0.998582 1.521698 -1.690608
C -0.950446 1.029047 -0.255400
C -7.936080 -0.222302 1.088749
C -2.806655 0.469569 1.258511
C -3.258940 1.018798 -1.077231
C -1.444908 0.659093 1.025907
C -1.880409 1.211713 -1.305362
H 7.181784 -0.696122 -1.649113
H 6.982615 1.064840 -1.355457
H 6.804426 -2.296335 0.325381
H 6.338847 -1.560035 1.902221
H 4.765547 -0.680118 -0.910852
H 4.508625 -0.680829 0.859978
H 8.929021 1.087646 0.185387
H 9.426094 0.334451 -1.384066
H 8.808168 -2.209711 1.788086
H 8.546683 -0.443177 2.089444
H 4.677199 1.813241 0.919387
H 4.967025 1.860275 -0.847369
H 2.353019 1.119610 0.428294
H -6.565181 1.563529 -0.762811
H -5.790777 0.217222 -1.623393
H -7.167004 -1.461474 -0.467363
H -8.284891 -0.196689 -1.024933
H 0.726195 0.759230 -2.445366
H 0.639918 2.512952 -2.028740
H -3.171505 0.185507 2.248627
H -3.947555 1.178409 -1.912273
H -1.535404 1.504829 -2.300996
H -7.152715 0.123262 2.989808


