%chk=000043667.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043667

0 1
 N   0.8076000     -0.3370000      2.6200000E-02
 N    3.125000     -0.8055000     -0.3301000    
 C    1.057300       1.013100      7.1000000E-03
 C    2.452200       1.530400     -3.8000001E-03
 C    1.844700      -1.361200      0.1310000    
 C    3.452500      0.4383000      0.3832000    
 C  -0.5516000     -0.5730000      2.4200000E-02
 C  -0.1554000       1.664300     -3.0999999E-02
 C   -1.179200      0.6769000     -1.9099999E-02
 C   -1.282800      -1.770300      6.1400000E-02
 C   -2.587600      0.7338000     -3.5799999E-02
 C  -0.3559000       3.128100     -7.7100001E-02
 C    4.188100      -1.794400     -0.1505000    
 C   -3.322900     -0.4555000     -4.1999999E-03
 C   -2.678000      -1.688100      4.5200001E-02
 C   -4.814200     -0.4000000     -2.6900001E-02
 H    2.680900       1.898400      -1.012000    
 H    2.552300       2.376800      0.6850000    
 H    1.871000      -1.679900       1.180000    
 H    1.543000      -2.197200     -0.5089000    
 H    4.458100      0.7866000      0.1170000    
 H    3.441200      0.2779000       1.469800    
 H  -0.7888000      -2.735600      0.1009000    
 H   -3.094600       1.694600     -6.8499997E-02
 H   0.5360000       3.648800     -0.4399000    
 H   -1.181300       3.390700     -0.7468000    
 H  -0.5900000       3.510500      0.9217000    
 H    3.960200      -2.709600     -0.7082000    
 H    4.334000      -2.058900      0.9031000    
 H    5.137000      -1.414900     -0.5456000    
 H   -3.255500      -2.609400      7.2999999E-02
 H   -5.168700      0.4728000     -0.5857000    
 H   -5.235900      -1.285000     -0.5155000    
 H   -5.203200     -0.3444000      0.9947000    


%chk=000043667-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043667

0 1
N 0.831763 -0.356939 -0.043610
N 3.185895 -0.831391 -0.273640
C 1.064105 1.035643 -0.056565
C 2.484464 1.533959 -0.113882
C 1.872052 -1.377101 0.113993
C 3.460575 0.457609 0.410514
C -0.548692 -0.587466 -0.009635
C -0.160768 1.711676 -0.058083
C -1.198767 0.696610 -0.028308
C -1.280824 -1.793200 0.040027
C -2.617565 0.749202 -0.012797
C -0.371926 3.203256 -0.104622
C 4.251967 -1.834396 -0.096583
C -3.369335 -0.445266 0.029597
C -2.687349 -1.703745 0.057153
C -4.890213 -0.413381 0.047604
H 2.761691 1.772609 -1.159676
H 2.589862 2.463808 0.475399
H 1.872456 -1.735867 1.180886
H 1.639221 -2.243698 -0.533802
H 4.501275 0.752500 0.188255
H 3.365234 0.360407 1.523065
H -0.786199 -2.770786 0.064500
H -3.134049 1.716798 -0.032898
H 0.583631 3.752318 -0.031229
H -0.861178 3.518758 -1.047170
H -1.019324 3.547104 0.725284
H 4.020761 -2.734313 -0.694974
H 4.394425 -2.152892 0.967080
H 5.207893 -1.421066 -0.461651
H -3.281748 -2.625432 0.092471
H -5.270787 0.622706 0.027118
H -5.317529 -0.944437 -0.824636
H -5.295516 -0.901484 0.954716


