%chk=000031997.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031997

0 1
 Cl  -4.209900      -2.159400      0.8266000    
 N   0.2286000      0.3452000      0.5031000    
 N   0.6325000     -0.5270000      -1.696000    
 N    5.184600     -1.1600000E-02  0.3960000    
 C   -3.911100      0.3738000     -0.1306000    
 C   -1.153600      0.3542000      0.2907000    
 C   -3.296100     -0.7559000      0.4090000    
 C   -3.147600       1.493700     -0.4594000    
 C   -1.917400     -0.7657000      0.6195000    
 C   -1.768600       1.484000     -0.2488000    
 C    2.490700     -5.2099999E-02 -0.1515000    
 C    1.021200     -7.4199997E-02 -0.4504000    
 C   -5.385300      0.4241000     -0.3730000    
 C    2.966700      0.8971000      0.7109000    
 C    3.292700     -0.9823000     -0.7543000    
 C    4.330500      0.8755000      0.9540000    
 C    4.642000     -0.9195000     -0.4458000    
 H   -3.609200       2.382800     -0.8808000    
 H   -1.431600      -1.643500       1.040400    
 H   -1.182000       2.361600     -0.5075000    
 H   -5.685400     -0.3547000      -1.082000    
 H   -5.934300      0.2950000      0.5656000    
 H   -5.696400       1.384600     -0.7985000    
 H    2.344000       1.645100       1.186600    
 H    2.932800      -1.755000      -1.421900    
 H    4.786900       1.596700       1.624100    
 H    5.344100      -1.625100     -0.8780000    
 H  -0.3454000     -0.5762000      -1.960400    
 H    1.297900     -0.7705000      -2.421600    


%chk=000031997-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000031997

0 1
Cl -4.195235 -2.329830 0.045789
N 0.240660 0.517779 0.172713
N 0.724558 -1.081198 -1.566915
N 5.320075 0.195849 0.387725
C -4.059982 0.472784 -0.072262
C -1.166034 0.461543 0.039802
C -3.306673 -0.722352 0.004752
C -3.301222 1.675658 -0.076807
C -1.903045 -0.762109 0.053909
C -1.895305 1.682499 -0.010129
C 2.539284 -0.103410 -0.226773
C 1.077098 -0.217935 -0.534108
C -5.572756 0.488796 -0.128501
C 3.012278 1.012190 0.509892
C 3.490774 -1.073666 -0.635551
C 4.390206 1.119388 0.787200
C 4.852695 -0.881344 -0.308248
H -3.840780 2.628722 -0.124777
H -1.387541 -1.721640 0.163443
H -1.337913 2.623701 0.007889
H -5.950116 -0.062632 -1.009446
H -6.013986 0.002139 0.760803
H -5.950315 1.523703 -0.180100
H 2.294774 1.762621 0.851555
H 3.197613 -1.988467 -1.162379
H 4.782806 1.973785 1.349243
H 5.606112 -1.619081 -0.606849
H -0.255773 -1.182317 -1.827818
H 1.429043 -1.454477 -2.198051


