%chk=000096954.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096954

0 1
 Cl   6.695500      6.1900001E-02 -0.1546000    
 O    2.225300       1.838600     -0.5171000    
 O    2.970100      -2.645300      0.1994000    
 N   0.5490000      0.5102000      0.3259000    
 N    2.665600     -0.4118000     -0.1817000    
 N    2.143300      -1.730400      0.2788000    
 C   -3.153000      0.4552000      5.1399998E-02
 C   -4.119100     -0.7027000     -0.1922000    
 C   -2.381900      0.2502000       1.361400    
 C   -2.190400      0.6145000      -1.132000    
 C  -0.4184000       1.579600      0.4207000    
 C   -1.367000       1.368400       1.604200    
 C   -1.185100       1.742000     -0.8942000    
 C   -4.910600     -0.4552000      -1.487400    
 C   -5.100700     -0.8170000      0.9862000    
 C   -3.331900      -2.017400     -0.3239000    
 C    1.840600      0.7234000     -0.1508000    
 C    4.042200     -0.3368000     -0.6547000    
 C    5.026500     -2.7600000E-02  0.4606000    
 H   -3.727100       1.388600      0.1438000    
 H   -3.058400      0.2425000       2.222100    
 H   -1.833600     -0.6951000       1.377100    
 H   -1.614300     -0.2950000      -1.323000    
 H   -2.728800      0.8565000      -2.053700    
 H   0.1379000       2.507400      0.6034000    
 H  -0.7963000       1.152000       2.515600    
 H   -1.914400       2.301900       1.788900    
 H   -1.728400       2.695600     -0.8714000    
 H  -0.4919000       1.796500      -1.742200    
 H   -4.294600     -0.5605000      -2.386100    
 H   -5.723700      -1.184000      -1.589700    
 H   -5.365600      0.5416000      -1.493400    
 H   -4.623200      -1.184300       1.900100    
 H   -5.902300      -1.528900      0.7551000    
 H   -5.575100      0.1460000       1.205800    
 H   -4.036100      -2.841700     -0.5013000    
 H   -2.645500      -2.037700      -1.173900    
 H   -2.784000      -2.296800      0.5792000    
 H   0.2316000     -0.4296000      0.5323000    
 H    4.096600      0.4609000      -1.406400    
 H    4.308300      -1.261500      -1.179900    
 H    5.001600     -0.8003000       1.235100    
 H    4.795600      0.9311000      0.9358000    


%chk=000096954-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096954

0 1
Cl 6.827901 -0.014488 -0.204429
O 2.341502 1.892278 -0.572784
O 2.908788 -2.592910 0.320070
N 0.607644 0.597343 0.340977
N 2.708808 -0.396913 -0.155754
N 2.132001 -1.576961 0.316899
C -3.117295 0.383297 0.038400
C -4.167036 -0.769661 -0.204323
C -2.301371 0.226657 1.352890
C -2.133137 0.601663 -1.145276
C -0.395847 1.686988 0.413168
C -1.355174 1.429502 1.597175
C -1.197339 1.810541 -0.909303
C -5.007452 -0.450018 -1.473853
C -5.147597 -0.848614 1.000821
C -3.489170 -2.154871 -0.390089
C 1.862311 0.803102 -0.151683
C 4.099687 -0.325807 -0.656268
C 5.082580 -0.077260 0.500213
H -3.714060 1.319951 0.140617
H -2.978216 0.133491 2.221025
H -1.718745 -0.718270 1.317192
H -1.519083 -0.309731 -1.294027
H -2.689452 0.763801 -2.085937
H 0.170847 2.621434 0.578167
H -0.774566 1.283893 2.528341
H -1.966580 2.342617 1.736992
H -1.799126 2.740337 -0.854033
H -0.493619 1.932682 -1.753596
H -4.403216 -0.498364 -2.397227
H -5.831144 -1.180570 -1.581198
H -5.457499 0.559619 -1.410606
H -4.647996 -1.197423 1.922377
H -5.966793 -1.559157 0.782487
H -5.604028 0.138335 1.209671
H -4.256949 -2.932145 -0.563398
H -2.807540 -2.165017 -1.259907
H -2.910999 -2.455452 0.503045
H 0.363104 -0.354224 0.631817
H 4.147569 0.501264 -1.380369
H 4.330142 -1.286197 -1.148176
H 5.082060 -0.896762 1.232654
H 4.914384 0.897021 0.980537


