%chk=000043982.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043982

0 1
 Cl  -3.645000       4.241900      0.3068000    
 O   -2.670300      -2.946500      0.7558000    
 O    6.036400       2.296600      0.6118000    
 N   0.7032000      -1.702100     -0.6002000    
 N    4.663700      5.5999998E-03 -0.3722000    
 C   -2.037600     -0.7349000      6.6100001E-02
 C  -0.7360000     -0.1473000      0.6694000    
 C   -1.671600      -1.442600      -1.263800    
 C   0.4169000      -1.156100      0.7297000    
 C  -0.4716000      -2.389900      -1.142700    
 C    1.849300      -2.609200     -0.5464000    
 C   -3.146500      0.3049000     -0.1673000    
 C   -2.576700      -1.755500       1.048700    
 C    3.081900      -1.871900     -1.9900000E-02
 C    3.474100     -0.6717000     -0.8841000    
 C   -2.917000       1.643400      0.1407000    
 C   -4.374300     -9.7700000E-02 -0.6862000    
 C   -2.989400      -1.240600       2.401000    
 C    5.062800       1.103900      -1.263000    
 C    4.428800      0.5180000      0.9849000    
 C    6.298200       1.802300     -0.7022000    
 C    5.678700       1.231100       1.493000    
 C   -3.923000       2.586100     -7.1400002E-02
 C   -5.380300      0.8451000     -0.8980000    
 C   -5.154700       2.187000     -0.5906000    
 H  -0.3833000      0.6835000      4.0899999E-02
 H  -0.8924000      0.2701000       1.671000    
 H   -2.519000      -2.014700      -1.662800    
 H   -1.438700     -0.6818000      -2.023000    
 H    1.258200     -0.5844000       1.131000    
 H   0.1901000      -1.952500       1.449900    
 H  -0.2405000      -2.753100      -2.152400    
 H  -0.7163000      -3.277000     -0.5486000    
 H    1.644800      -3.478600      9.1700003E-02
 H    2.070500      -2.989100      -1.551700    
 H    3.917200      -2.586600     -3.9600000E-02
 H    2.948700      -1.641200       1.038000    
 H    3.674800      -1.034500      -1.900500    
 H    2.642300      3.9700001E-02 -0.9593000    
 H   -1.979000       1.994600      0.5557000    
 H   -4.574500      -1.137700     -0.9273000    
 H   -2.108700      -1.037000       3.013700    
 H   -3.617400     -0.3514000       2.333100    
 H   -3.577900      -2.014600       2.904700    
 H    4.246400       1.831300      -1.360500    
 H    5.295900      0.7186000      -2.262200    
 H    3.580200       1.214400      0.9914000    
 H    4.227200     -0.2797000       1.703500    
 H    7.165300       1.131100     -0.6749000    
 H    6.561400       2.657500      -1.332900    
 H    5.485300       1.666800       2.478600    
 H    6.525600      0.5415000       1.595700    
 H   -6.339900      0.5344000      -1.300900    
 H   -5.947900       2.910400     -0.7607000    


%chk=000043982-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043982

0 1
Cl -4.170464 4.242840 0.538053
O -3.217831 -2.967146 0.366490
O 6.771316 2.154158 0.293353
N 0.646377 -1.566850 -0.376599
N 4.816548 0.080973 -0.322572
C -2.199365 -0.743117 0.063236
C -0.991609 -0.127479 0.822596
C -1.671041 -1.303072 -1.293120
C 0.178850 -1.121551 0.955703
C -0.455930 -2.234607 -1.118084
C 1.853024 -2.433529 -0.308686
C -3.331062 0.281975 -0.200015
C -2.875479 -1.879477 0.901533
C 3.119998 -1.712916 0.200311
C 3.470360 -0.467301 -0.636985
C -3.249875 1.627451 0.241508
C -4.495608 -0.132721 -0.903133
C -3.156729 -1.609595 2.374247
C 5.263898 1.059818 -1.348793
C 4.890994 0.700807 1.026439
C 6.692817 1.533894 -1.040459
C 6.321957 1.187724 1.308485
C -4.307715 2.512663 -0.038092
C -5.542423 0.773803 -1.169127
C -5.460870 2.119302 -0.739277
H -0.626638 0.744933 0.247789
H -1.285337 0.232682 1.826306
H -2.471360 -1.862589 -1.806861
H -1.383341 -0.444692 -1.928710
H 1.011190 -0.620430 1.481052
H -0.127888 -1.996828 1.592064
H -0.075440 -2.518779 -2.117112
H -0.779203 -3.175357 -0.607086
H 1.666927 -3.337983 0.328415
H 2.043411 -2.802413 -1.335934
H 3.968473 -2.421750 0.144795
H 3.003420 -1.449723 1.269246
H 3.471981 -0.757201 -1.706211
H 2.667918 0.302213 -0.520244
H -2.378991 1.993344 0.789894
H -4.586203 -1.173067 -1.233925
H -2.224190 -1.716906 2.961653
H -3.532931 -0.583798 2.533407
H -3.888604 -2.341896 2.749249
H 4.585963 1.950515 -1.392552
H 5.245708 0.570118 -2.341301
H 4.184097 1.566627 1.114102
H 4.612754 -0.046102 1.792174
H 7.389259 0.668973 -1.091612
H 7.016708 2.314813 -1.748376
H 6.377217 1.724351 2.270330
H 7.011319 0.315682 1.326260
H -6.432334 0.437392 -1.711641
H -6.265619 2.831725 -0.940684


