%chk=000046661.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046661

0 1
 N  -0.8508000       1.623700      9.9999997E-05
 N  -0.3151000      -2.533500     -1.9999999E-04
 N    5.435400     -0.8601000      3.9999999E-04
 C   0.6197000     -0.2806000     -1.9999999E-04
 C   -1.789600     -0.5915000       0.000000    
 C  -0.4962000      -1.123600     -9.9999997E-05
 C   0.3927000       1.106100     -9.9999997E-05
 C   -1.922200      0.8072000       0.000000    
 C    1.930800     -0.7878000     -9.9999997E-05
 C   -2.928900      -1.415200      9.9999997E-05
 C    1.499800       1.950600     -9.9999997E-05
 C   -3.207400       1.342900      9.9999997E-05
 C    3.020400      7.8000002E-02 -9.9999997E-05
 C    2.804000       1.450000     -9.9999997E-05
 C   -4.202600     -0.8546000      9.9999997E-05
 C   -4.341800      0.5275000      1.9999999E-04
 C    4.352100     -0.4393000      1.9999999E-04
 H    2.143300      -1.852600     -9.9999997E-05
 H   -2.880800      -2.498800      9.9999997E-05
 H    1.356100       3.029700       0.000000    
 H   -3.342800       2.423100       0.000000    
 H    3.637800       2.147900       0.000000    
 H   -5.081400      -1.492200      1.9999999E-04
 H   -5.331300      0.9753000      1.9999999E-04
 H   0.6021000      -2.951800     -3.0000001E-04
 H   -1.098600      -3.168100       0.000000    


%chk=000046661-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000046661

0 1
N -0.854975 1.652018 0.000035
N -0.317594 -2.601419 -0.000036
N 5.551393 -0.803804 -0.000070
C 0.644260 -0.343960 -0.000003
C -1.811525 -0.657951 0.000019
C -0.491003 -1.232303 -0.000006
C 0.391783 1.093607 0.000013
C -1.928563 0.793358 0.000040
C 1.995970 -0.806738 -0.000015
C -3.012391 -1.445631 0.000024
C 1.522018 1.988015 0.000008
C -3.241828 1.379254 0.000071
C 3.073789 0.092175 -0.000019
C 2.824892 1.514469 -0.000008
C -4.270168 -0.844422 0.000050
C -4.385058 0.584925 0.000077
C 4.424739 -0.399230 -0.000026
H 2.232018 -1.877043 -0.000017
H -2.966053 -2.541873 0.000006
H 1.299808 3.059037 0.000021
H -3.293655 2.472129 0.000089
H 3.675058 2.203299 -0.000008
H -5.173976 -1.462677 0.000053
H -5.377830 1.047737 0.000101
H 0.607517 -3.019537 -0.000065
H -1.113927 -3.231136 -0.000033


