%chk=000100762.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100762

0 1
 Cl  -3.726800       2.425200      -2.039100    
 Cl  -2.842100      -3.254100      -2.312000    
 Cl  -4.792600       2.920600      0.9763000    
 Cl  -3.569200      -4.405400      0.6238000    
 O    4.112100       1.813900     -0.5150000    
 O    4.367200      -2.177700       1.299100    
 N    3.234600     -0.3232000     -0.5096000    
 N    2.173300      -1.159700     -0.3653000    
 N    1.578700       4.208100     -1.4300000E-02
 C   0.7307000      0.8208000      1.1000000E-03
 C    1.018700     -0.6358000     -0.1211000    
 C  -0.6322000       1.340300      0.2242000    
 C    1.792600       1.631300     -0.1434000    
 C  -0.1160000      -1.564600      4.6300001E-02
 C    4.498800     -0.9908000     -0.7734000    
 C    3.147100       1.055300     -0.4027000    
 C    5.208400      -1.330300      0.5276000    
 C   -1.458400       1.611900     -0.8637000    
 C   -1.087200       1.555300       1.523000    
 C  -0.8669000      -1.941500      -1.061600    
 C  -0.4244000      -2.053700       1.310900    
 C   -2.747300       2.101400     -0.6516000    
 C   -2.375900       2.044700       1.735200    
 C   -1.939800      -2.818800     -0.9029000    
 C   -1.497100      -2.930800       1.469700    
 C   -3.206000       2.317600      0.6480000    
 C   -2.254800      -3.313500      0.3628000    
 C    1.674600       3.053500     -7.2099999E-02
 H    5.135000     -0.3384000      -1.381000    
 H    4.293200      -1.900400      -1.350300    
 H    5.431000     -0.4344000       1.115900    
 H    6.144900      -1.859500      0.3300000    
 H   -1.097900       1.442400      -1.876400    
 H  -0.4518000       1.346000       2.380000    
 H  -0.6147000      -1.552100      -2.045500    
 H   0.1606000      -1.761700       2.179000    
 H   -2.717200       2.206800       2.754600    
 H   -1.728300      -3.306600       2.463300    
 H    3.542100      -1.692400       1.470600    


%chk=000100762-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100762

0 1
Cl -4.217614 1.420751 -1.564516
Cl -1.111410 -4.878835 -2.040056
Cl -4.873003 3.320858 1.040557
Cl -3.282523 -4.872144 0.433123
O 4.267117 1.991337 -0.110262
O 4.081816 -3.055938 -0.044369
N 3.226368 -0.088270 -0.463202
N 2.155410 -0.932281 -0.393974
N 1.718614 4.402630 0.588069
C 0.728262 0.964470 0.220230
C 0.941581 -0.451305 -0.046782
C -0.639545 1.521824 0.436663
C 1.853845 1.805576 0.193329
C -0.118167 -1.496742 0.059171
C 4.511282 -0.729039 -0.850731
C 3.208532 1.304907 -0.112800
C 4.902716 -1.861228 0.123482
C -1.667273 1.246302 -0.502118
C -0.927632 2.356339 1.547757
C -0.150203 -2.548197 -0.892409
C -1.054782 -1.507676 1.126649
C -2.951499 1.793965 -0.330938
C -2.218000 2.892773 1.723201
C -1.107139 -3.574737 -0.789205
C -2.007619 -2.538752 1.229858
C -3.233455 2.614654 0.784415
C -2.040899 -3.573075 0.270417
C 1.765201 3.221439 0.409185
H 5.264824 0.074732 -0.855943
H 4.397634 -1.144162 -1.867719
H 4.868471 -1.482357 1.167547
H 5.936233 -2.174790 -0.099941
H -1.472401 0.616311 -1.374440
H -0.153009 2.582384 2.286597
H 0.569498 -2.562719 -1.715647
H -1.036858 -0.725426 1.890118
H -2.440792 3.531734 2.582005
H -2.725561 -2.551176 2.054540
H 3.128978 -2.764435 -0.071464


