%chk=000058616.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058616

0 1
 Cl   3.953200      -1.308300       2.521500    
 O   0.9181000      0.7001000      -1.412600    
 N   -4.628600     -0.2738000     -0.1117000    
 N   -1.262100       1.316000      0.1600000    
 N    1.985600     -0.1916000      0.4789000    
 C   -3.258600      5.3300001E-02 -0.4917000    
 C   -2.641300       1.002100      0.5314000    
 C   -4.641500      -1.281500      0.9500000    
 C   -5.385400     -0.7479000      -1.271300    
 C  -0.8503000       2.588400      0.7518000    
 C  -0.3626000      0.2421000      0.5801000    
 C   -1.774400       3.716600      0.3257000    
 C   -6.060000      -1.584700       1.401800    
 C   -4.790600      -2.030300      -1.828200    
 C   0.9036000      0.2868000     -0.2576000    
 C    3.331400     -0.3110000      5.7799999E-02
 C    4.318400     -0.8094000      0.9084000    
 C    3.662300      8.3899997E-02  -1.238500    
 C    5.636000     -0.9130000      0.4624000    
 C    4.980000     -1.9600000E-02  -1.684200    
 C    5.966900     -0.5179000     -0.8338000    
 H   -2.650700     -0.8500000     -0.6124000    
 H   -3.247900      0.5718000      -1.460900    
 H   -3.298500       1.875400      0.5404000    
 H   -2.667100      0.6030000       1.552200    
 H   -4.111800      -2.206600      0.6965000    
 H   -4.128900     -0.8852000       1.833500    
 H   -6.448100     -0.8815000      -1.042900    
 H   -5.372100      2.2900000E-02  -2.053100    
 H  -0.8207000       2.540500       1.847900    
 H   0.1614000       2.839800      0.4113000    
 H  -0.1419000      0.2992000       1.653300    
 H  -0.7852000     -0.7527000      0.3980000    
 H   -1.266900       4.675500      0.4836000    
 H   -2.692900       3.762700      0.9184000    
 H   -2.030000       3.662100     -0.7382000    
 H   -6.032400      -2.151100       2.339600    
 H   -6.609000      -2.198800      0.6816000    
 H   -6.629100     -0.6683000       1.593100    
 H   -3.745700      -1.933400      -2.135300    
 H   -4.887700      -2.884700      -1.153000    
 H   -5.344700      -2.303400      -2.734700    
 H    1.812400     -0.5037000       1.431900    
 H    2.966200      0.4792000      -1.962900    
 H    6.417100      -1.299000       1.112500    
 H    5.239300      0.2874000      -2.693400    
 H    6.992800     -0.5984000      -1.181000    


%chk=000058616-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000058616

0 1
Cl 3.996220 -0.910034 2.762508
O 1.007882 0.650913 -1.398358
N -4.680072 -0.480241 0.030122
N -1.290307 1.255348 0.319398
N 2.128534 -0.040483 0.549522
C -3.332690 -0.019777 -0.387943
C -2.677140 0.884192 0.684696
C -4.628917 -1.684497 0.896844
C -5.665792 -0.542566 -1.079833
C -0.882473 2.639965 0.660167
C -0.302968 0.237051 0.666530
C -1.567816 3.695660 -0.227212
C -5.958509 -1.980174 1.615949
C -5.422384 -1.633566 -2.159544
C 0.989912 0.325990 -0.180032
C 3.460416 -0.180256 0.093708
C 4.468416 -0.585228 1.012624
C 3.861575 0.063737 -1.250793
C 5.811681 -0.749835 0.644891
C 5.209358 -0.100350 -1.630833
C 6.188879 -0.504750 -0.695948
H -2.651718 -0.872793 -0.629599
H -3.418594 0.573553 -1.315727
H -3.285145 1.800199 0.768816
H -2.726455 0.387395 1.684665
H -4.301667 -2.595267 0.331915
H -3.850951 -1.502957 1.662951
H -6.672421 -0.679800 -0.642954
H -5.674048 0.452091 -1.564985
H -1.066357 2.870921 1.740516
H 0.209640 2.713654 0.500609
H -0.026962 0.243151 1.757997
H -0.741489 -0.760537 0.466518
H -1.209800 4.708829 0.034490
H -2.666366 3.688681 -0.106537
H -1.335274 3.496858 -1.287095
H -5.827121 -2.810582 2.333975
H -6.756115 -2.275173 0.910534
H -6.299852 -1.087074 2.168929
H -4.432504 -1.512187 -2.636303
H -5.474408 -2.651211 -1.731226
H -6.191200 -1.562911 -2.951506
H 1.987965 -0.243937 1.545431
H 3.099914 0.380393 -1.965678
H 6.547609 -1.062908 1.390903
H 5.493588 0.092579 -2.670660
H 7.233927 -0.629066 -0.996240


