%chk=000116785.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116785

1 1
 Cl  -4.201100       2.419400      -1.229700    
 Cl  -2.953100      -2.634400      0.3881000    
 O   -8.641400     -0.1373000     -0.3060000    
 O   -8.138900      -2.172700      0.3451000    
 N    3.547400       1.811300     -3.5999999E-03
 N    5.819000      -1.114400     -0.5670000    
 N   -1.896600      0.6175000      0.5481000    
 N   -2.334600      0.1631000     -0.5342000    
 N   -7.798500      -1.026200     -3.4400001E-02
 C    4.554100      0.8151000      0.3043000    
 C    4.760100     -0.1245000     -0.8747000    
 C    2.176900       1.509900      0.1405000    
 C    3.967000       3.125500     -0.4481000    
 C    1.673500       1.127100       1.383800    
 C    1.324900       1.594800     -0.9608000    
 C   0.3182000      0.8292000       1.525700    
 C    4.141500       4.048400      0.7426000    
 C  -0.5337000      0.9143000      0.4244000    
 C  -3.0300001E-02   1.297100     -0.8188000    
 C    5.456400      -2.260200      2.0000001E-03
 C    7.074000     -0.8026000     -0.8771000    
 C  -0.1980000      0.4197000       2.866400    
 C    6.426700      -3.205900      0.3009000    
 C    8.086300      -1.710400     -0.6004000    
 C    7.754500      -2.923800     -5.2000000E-03
 C   -3.702300     -0.1348000     -0.4095000    
 C   -4.656600      0.8376000     -0.7061000    
 C   -4.103500      -1.402200      1.1200000E-02
 C   -6.416400     -0.7254000     -0.1611000    
 C   -6.014200      0.5421000     -0.5817000    
 C   -5.461100      -1.697500      0.1354000    
 H    4.289300      0.2415000       1.200700    
 H    5.505100       1.304800      0.5498000    
 H    5.054600      0.4208000      -1.779900    
 H    3.843900     -0.6737000      -1.123700    
 H    3.250200       3.566000      -1.150600    
 H    4.917500       3.053900     -0.9908000    
 H    2.334300       1.071900       2.245800    
 H    1.701900       1.885800      -1.937900    
 H    4.480900       5.035000      0.4119000    
 H    4.880800       3.653900       1.447500    
 H    3.199200       4.179100       1.285200    
 H  -0.6594000       1.397300      -1.699900    
 H    4.406500      -2.414400      0.2188000    
 H    7.264400      0.1604000      -1.334400    
 H  -0.6320000     -0.5845000       2.817000    
 H  -0.9604000       1.125100       3.212900    
 H   0.5952000      0.3969000       3.621400    
 H    6.155200      -4.147500      0.7662000    
 H    9.117800      -1.477900     -0.8425000    
 H    8.530600      -3.649000      0.2207000    
 H   -6.743800       1.313900     -0.8175000    
 H   -5.754600      -2.692000      0.4651000    


%chk=000116785-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116785

1 1
Cl -4.648269 3.010091 0.796814
Cl -3.260435 -2.267766 -0.583584
O -9.101173 0.179222 0.186823
O -8.506255 -1.966291 -0.330247
N 3.579102 1.786349 -0.352954
N 6.079186 -1.074826 -0.154183
N -1.775853 0.104749 0.511417
N -2.738306 0.873845 0.075654
N -8.227153 -0.739362 -0.046881
C 4.687336 1.017028 0.191036
C 5.010583 -0.216424 -0.733419
C 2.245129 1.397234 -0.133880
C 3.919912 2.997321 -1.149357
C 1.924302 0.236083 0.640849
C 1.160460 2.154414 -0.688879
C 0.597530 -0.176707 0.867094
C 3.845928 4.304284 -0.331012
C -0.463775 0.589552 0.285078
C -0.158700 1.750280 -0.484969
C 5.743620 -2.051496 0.768114
C 7.407490 -0.820997 -0.448243
C 0.299115 -1.399488 1.709538
C 6.736889 -2.801890 1.407062
C 8.428066 -1.551672 0.169834
C 8.101241 -2.557647 1.113160
C -4.055369 0.365328 0.127353
C -5.100527 1.313136 0.370409
C -4.466077 -0.972203 -0.181104
C -6.792816 -0.355788 0.013861
C -6.457826 0.977363 0.329923
C -5.817670 -1.338178 -0.250991
H 4.467737 0.658042 1.213622
H 5.580560 1.662823 0.259091
H 5.337671 0.135803 -1.725422
H 4.098634 -0.822635 -0.861286
H 3.260679 3.050611 -2.033598
H 4.945636 2.862203 -1.540594
H 2.715431 -0.357605 1.110575
H 1.349123 3.060939 -1.268097
H 4.106459 5.166433 -0.970447
H 4.550339 4.284634 0.519625
H 2.832568 4.469432 0.071963
H -0.990498 2.322999 -0.907258
H 4.677135 -2.209992 0.943132
H 7.603052 -0.041910 -1.188255
H -0.369005 -2.095896 1.175333
H -0.232573 -1.118798 2.636275
H 1.225510 -1.930069 1.991034
H 6.440155 -3.573411 2.121472
H 9.466604 -1.335447 -0.091625
H 8.888010 -3.137887 1.602198
H -7.244443 1.707427 0.533225
H -6.127069 -2.356139 -0.499378


