%chk=000122356.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122356

0 1
 O    2.630300      0.4368000      -1.062900    
 N    1.223900      5.6299999E-02  0.7541000    
 N   -3.918800      -1.077000     -2.1299999E-02
 C  -0.7760000       1.132700     -0.2052000    
 C   -1.748100      6.7199998E-02  0.3164000    
 C   0.4616000       1.272300      0.6768000    
 C   -3.020200     -4.6200000E-02 -0.5265000    
 C    2.249500     -0.2612000     -0.1266000    
 C    2.897900      -1.580900      0.1951000    
 H  -0.4749000      0.8765000      -1.228300    
 H   -1.288300       2.100900     -0.2523000    
 H   -1.247000     -0.9087000      0.3354000    
 H   -2.020700      0.3046000       1.352700    
 H    1.101900       2.070100      0.2848000    
 H   0.1746000       1.543800       1.698200    
 H   -3.548300      0.9134000     -0.5286000    
 H   -2.757100     -0.2783000      -1.564500    
 H   0.9953000     -0.5970000       1.497900    
 H   -3.448200      -1.980900     -3.9400000E-02
 H   -4.722000      -1.160100     -0.6429000    
 H    3.523100      -1.898100     -0.6441000    
 H    3.519700      -1.472600       1.087900    
 H    2.136200      -2.345700      0.3718000    


%chk=000122356-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000122356

0 1
O 2.921589 0.699283 -0.697682
N 1.236239 -0.037791 0.731661
N -4.063706 -1.032053 -0.056209
C -0.816611 1.064242 -0.248508
C -1.841730 0.033925 0.273805
C 0.441855 1.199947 0.641437
C -3.126464 -0.016122 -0.579092
C 2.431431 -0.205427 0.045361
C 3.125670 -1.550923 0.252881
H -0.499081 0.800867 -1.276298
H -1.297602 2.062362 -0.307914
H -1.380721 -0.977167 0.282895
H -2.129496 0.266401 1.318181
H 1.116511 1.967334 0.223764
H 0.147710 1.512050 1.663123
H -3.628322 0.969426 -0.525654
H -2.838438 -0.170652 -1.648830
H 0.882822 -0.805498 1.303732
H -3.697193 -1.989081 -0.095199
H -5.011101 -0.973779 -0.442072
H 3.284304 -2.029010 -0.728890
H 4.121994 -1.375729 0.694543
H 2.564741 -2.244706 0.903467


