%chk=000040168.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040168

0 1
 Cl  -2.607500       3.083700      -1.487200    
 O  -0.5747000      -4.255400      0.3852000    
 O  -0.8410000      6.9300003E-02  -1.948600    
 O    1.807200     -0.6823000      -1.154700    
 N  -0.8631000      -1.522900     -0.2569000    
 N    1.105300      0.9732000      0.3221000    
 C  -0.6758000      -1.951800       1.135600    
 C   -1.441000      -2.559500      -1.114300    
 C   9.0099998E-02  -3.268100       1.178500    
 C  -0.6473000      -3.852700     -0.9851000    
 C  -0.6707000     -0.2440000     -0.7689000    
 C  -0.2345000      0.8161000      0.1612000    
 C   -1.193000       1.516600      0.7763000    
 C   -2.638900       1.316900      0.6017000    
 C    2.056200      0.2109000     -0.3487000    
 C    3.475500      0.5438000     -5.9900001E-02
 C   -3.355100       1.978500     -0.3873000    
 C   -3.271200      0.4347000       1.469300    
 C   -4.726300       1.754300     -0.5115000    
 C   -4.642400      0.2108000       1.345000    
 C    4.431200     -0.4412000     -0.1970000    
 C    3.791000       1.826900      0.3354000    
 C   -5.370000      0.8706000      0.3548000    
 C    5.763300     -0.1288000      7.3799998E-02
 C    5.123300       2.139200      0.6060000    
 C    6.109400       1.161300      0.4751000    
 H   -1.676800      -2.097400       1.556100    
 H  -0.1588000      -1.194100       1.727800    
 H   -1.476500      -2.237000      -2.159100    
 H   -2.471300      -2.709900     -0.7706000    
 H    1.117200      -3.144400      0.8148000    
 H   0.1403000      -3.640700       2.206200    
 H   -1.139200      -4.653700      -1.545400    
 H   0.3687000      -3.739100      -1.381800    
 H  -0.9238000       2.303100       1.477900    
 H    1.391300       1.672400       1.000700    
 H   -2.724900     -7.2999999E-02   2.259300    
 H   -5.308400       2.260200      -1.277700    
 H   -5.144300     -0.4741000       2.022200    
 H    4.176800      -1.451500     -0.5032000    
 H    3.061500       2.625900      0.4137000    
 H   -6.437700      0.6968000      0.2588000    
 H    6.531200     -0.8903000     -2.7200000E-02
 H    5.394700       3.145900      0.9104000    
 H    7.146900       1.405000      0.6842000    


%chk=000040168-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000040168

0 1
Cl -2.717964 2.616209 2.966537
O -0.768557 -4.429441 0.937926
O -0.304021 -0.623941 -2.024491
O 2.046973 -1.262655 0.338660
N -1.067856 -1.782857 -0.145324
N 1.189237 0.894156 0.137684
C -1.140296 -1.998672 1.315619
C -1.440583 -2.967119 -0.952185
C -0.315204 -3.248313 1.696227
C -0.604369 -4.183661 -0.506435
C -0.501197 -0.692310 -0.764976
C -0.181933 0.534745 0.081472
C -1.124337 1.389311 0.599093
C -2.585670 1.304348 0.467017
C 2.248501 -0.021313 0.161784
C 3.620245 0.563921 -0.003032
C -3.444182 1.854037 1.461663
C -3.232725 0.737102 -0.675128
C -4.846256 1.833529 1.369844
C -4.636317 0.701518 -0.785981
C 4.716721 -0.163240 0.527837
C 3.859000 1.783912 -0.690570
C -5.449984 1.245640 0.235044
C 6.029146 0.334173 0.399216
C 5.175006 2.277980 -0.822121
C 6.261323 1.559223 -0.271130
H -2.200179 -2.146182 1.601994
H -0.751685 -1.113457 1.842790
H -1.260066 -2.728518 -2.013691
H -2.516864 -3.177685 -0.796478
H 0.756223 -3.053403 1.493798
H -0.465322 -3.505303 2.757649
H -0.952352 -5.103310 -1.004771
H 0.466304 -4.009459 -0.741025
H -0.755676 2.240583 1.188473
H 1.413115 1.889394 0.203992
H -2.616824 0.362613 -1.498066
H -5.453511 2.266394 2.169826
H -5.095981 0.265228 -1.679018
H 4.516088 -1.115811 1.028962
H 3.034171 2.324289 -1.170546
H -6.541471 1.225734 0.151235
H 6.870081 -0.229955 0.816544
H 5.354425 3.212347 -1.364740
H 7.281725 1.944422 -0.374177


