%chk=000028645.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028645

0 1
 Cl   1.247800       4.058600       1.340100    
 N  -0.1700000      -1.812500      0.7471000    
 N    2.517200      -1.363200     -0.7183000    
 C  -0.2603000     -0.7290000     -0.2683000    
 C   -1.459400      -2.449700       1.044300    
 C   0.8024000      -2.846200      0.3376000    
 C   -1.645200     -9.2900001E-02 -0.4423000    
 C   0.8626000      0.2917000     -1.1400000E-02
 C   -2.474100      -1.412100       1.516600    
 C   -2.698900     -0.4030000      0.4311000    
 C    2.255700      -2.367600      0.3187000    
 C    2.198900     -4.9800001E-02 -0.3431000    
 C   -1.883400      0.8004000      -1.502100    
 C   0.5973000       1.559200      0.5431000    
 C   -3.942000      0.2257000      0.2848000    
 C    3.195500      0.9382000     -0.2156000    
 C    3.630200      -1.602400      -1.624900    
 C   -3.129000       1.410000      -1.653200    
 C   -4.154500       1.129800     -0.7543000    
 C    1.607300       2.509100      0.6836000    
 C    2.901800       2.205700      0.2865000    
 H  -8.4100001E-02  -1.171400      -1.261700    
 H   -1.332500      -3.184900       1.848600    
 H   -1.842000      -2.987700      0.1659000    
 H   0.5321000      -3.269800     -0.6391000    
 H   0.7619000      -3.673700       1.058400    
 H   -2.123200     -0.9022000       2.421900    
 H   -3.413000      -1.922500       1.761200    
 H    2.553900      -1.993800       1.308000    
 H    2.886000      -3.248100      0.1362000    
 H   -1.092200       1.035700      -2.210000    
 H  -0.4092000       1.820200      0.8614000    
 H   -4.755100      2.4000001E-03  0.9707000    
 H    4.231100      0.7209000     -0.4663000    
 H    3.614000     -0.9020000      -2.467300    
 H    3.560900      -2.611100      -2.046800    
 H    4.591100      -1.519900      -1.105900    
 H   -3.296800       2.106600      -2.469300    
 H   -5.122800       1.608200     -0.8683000    
 H    3.701700       2.935100      0.3848000    


%chk=000028645-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028645

0 1
Cl 1.106555 4.164878 1.300333
N -0.208072 -1.903963 0.648243
N 2.528928 -1.373177 -0.754919
C -0.268964 -0.762673 -0.330105
C -1.507176 -2.463076 1.087265
C 0.734134 -2.941256 0.191114
C -1.651874 -0.118773 -0.449856
C 0.835603 0.268129 -0.020306
C -2.405765 -1.336541 1.625788
C -2.673669 -0.346810 0.507652
C 2.201538 -2.473324 0.198545
C 2.198600 -0.051430 -0.327999
C -1.909598 0.744688 -1.544296
C 0.526637 1.549145 0.489203
C -3.925768 0.299678 0.361340
C 3.192413 0.958204 -0.197984
C 3.798863 -1.558475 -1.479802
C -3.155754 1.389740 -1.683378
C -4.170336 1.171032 -0.721158
C 1.540489 2.510831 0.642212
C 2.871724 2.246274 0.280256
H -0.007609 -1.165788 -1.341948
H -1.296044 -3.200483 1.884924
H -2.049154 -2.999970 0.267525
H 0.481910 -3.311300 -0.835688
H 0.661344 -3.802602 0.883556
H -1.882332 -0.847305 2.470844
H -3.354305 -1.751786 2.013074
H 2.470876 -2.176003 1.234019
H 2.827891 -3.342354 -0.076784
H -1.119448 0.920336 -2.284370
H -0.508854 1.806216 0.727831
H -4.713176 0.110422 1.101279
H 4.235020 0.737864 -0.445534
H 3.904459 -0.780922 -2.255544
H 3.785668 -2.539897 -1.985274
H 4.701349 -1.523559 -0.825978
H -3.336346 2.055615 -2.534264
H -5.142337 1.666712 -0.821573
H 3.644279 3.013702 0.384157


