%chk=000060652.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060652

0 1
 Cl  -2.308000      -3.535000      -1.881100    
 N  -0.9413000       1.920100      0.1026000    
 N    3.699000     -0.1246000      -1.487000    
 N    4.642500      -1.118600      0.2627000    
 N   -1.027500       4.064400     -0.2154000    
 C  -0.6992000      0.6185000      0.8020000    
 C   0.7129000      0.1407000      0.7091000    
 C   -1.810600     -0.3995000      0.4963000    
 C    1.421300      0.3276000     -0.4824000    
 C    1.301000     -0.4832000       1.811700    
 C    2.736100     -0.1388000     -0.5110000    
 C    3.349300     -0.7643000      0.5710000    
 C    2.622700     -0.9435000       1.760200    
 C   -1.563200      -1.373200     -0.4387000    
 C   -2.999100     -0.2885000       1.173300    
 C   -1.406600       2.031500      -1.143300    
 C  -0.7195000       3.119900      0.6456000    
 C   -2.571200      -2.297000     -0.7150000    
 C   -4.007200      -1.212100      0.8967000    
 C   -1.456900       3.392700      -1.332400    
 C    4.818800     -0.7208000     -0.9774000    
 C   -3.793200      -2.216400     -4.7300000E-02
 H  -0.8458000      0.8972000       1.859400    
 H   0.9962000      0.7904000      -1.363600    
 H   0.7369000     -0.6243000       2.731000    
 H    3.070500      -1.427800       2.622100    
 H  -0.6249000      -1.443800     -0.9772000    
 H   -3.173500      0.4914000       1.907700    
 H   -1.654600       1.209800      -1.800100    
 H  -0.3407000       3.281700       1.645600    
 H    3.598900      0.2584000      -2.417700    
 H   -4.958900      -1.148800       1.416200    
 H   -1.777600       3.922800      -2.217300    
 H    5.723200     -0.8325000      -1.558300    
 H   -4.588000      -2.929000     -0.2527000    


%chk=000060652-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060652

0 1
Cl -2.271084 -3.831941 -1.577454
N -0.977957 1.904724 0.104848
N 3.863504 0.219165 -1.396317
N 4.666023 -1.263799 0.148640
N -0.894254 4.100738 -0.466839
C -0.712791 0.667331 0.884586
C 0.719982 0.150403 0.690690
C -1.802712 -0.381122 0.602491
C 1.515261 0.567047 -0.397010
C 1.229742 -0.775101 1.655697
C 2.816533 0.029999 -0.481957
C 3.337678 -0.902071 0.478925
C 2.527352 -1.308676 1.564308
C -1.555474 -1.492543 -0.237981
C -3.089372 -0.211577 1.173291
C -1.521033 2.003031 -1.185669
C -0.609582 3.194185 0.488830
C -2.598805 -2.403243 -0.489721
C -4.118396 -1.139518 0.908409
C -1.465373 3.359361 -1.516699
C 4.935406 -0.575736 -0.969735
C -3.882266 -2.252565 0.067148
H -0.819442 0.962603 1.948219
H 1.133370 1.285542 -1.129572
H 0.583338 -1.077835 2.488487
H 2.911254 -2.013108 2.307822
H -0.565434 -1.648186 -0.675986
H -3.285788 0.652986 1.818074
H -1.908499 1.138870 -1.717330
H -0.145438 3.410777 1.448628
H 3.852430 0.826986 -2.213578
H -5.109566 -1.004227 1.353571
H -1.805421 3.845901 -2.427892
H 5.879807 -0.612975 -1.509742
H -4.671191 -2.980022 -0.143879


