%chk=000017767.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017767

0 1
 N   -3.060000      -1.548000      0.5735000    
 N   -1.911700       2.694600      -1.713500    
 C  -0.4714000       1.302100      2.5100000E-02
 C   0.1361000       2.313900       1.087300    
 C   -1.458200      0.3075000      0.7363000    
 C   0.6826000      0.5077000     -0.6310000    
 C   -2.179200     -0.6772000     -0.2005000    
 C  -0.9396000       3.059400       1.900000    
 C    1.101000       3.353600      0.4910000    
 C    1.522700     -0.2648000      0.1429000    
 C   -1.276800       2.080800     -0.9598000    
 C   0.7886000      0.6373000      -1.994000    
 C    2.558800     -0.9672000     -0.5175000    
 C   -3.674600      -2.555600     -0.2912000    
 C    1.807300     -5.3700000E-02  -2.643400    
 C    1.393900     -0.3813000       1.536500    
 C    2.687400     -0.8511000      -1.911200    
 C   -4.090600     -0.7622000       1.252700    
 C    3.435700      -1.765200      0.2352000    
 C    2.274400      -1.178600       2.268500    
 C   -2.619800      -3.382800      -1.006000    
 C    3.293300      -1.869100       1.619100    
 H   0.7426000       1.849900       1.855900    
 H   -1.058700     -0.2600000       1.571700    
 H   -2.235600      0.9400000       1.179300    
 H   -2.739600     -0.1487000     -0.9809000    
 H   -1.395200      -1.258800     -0.6918000    
 H  -0.4772000       3.807700       2.554800    
 H   -1.651300       3.588500       1.259100    
 H   -1.492600       2.380800       2.556100    
 H   0.5978000       4.005100     -0.2306000    
 H    1.514600       3.995100       1.277600    
 H    1.948800       2.877100     -1.0300000E-02
 H   0.1454000       1.234700      -2.626000    
 H   -4.276000      -3.236600      0.3235000    
 H   -4.347900      -2.101900      -1.029500    
 H    1.918900      2.6600000E-02  -3.721000    
 H   0.6470000      6.6100001E-02   2.167400    
 H    3.476400      -1.382200      -2.439700    
 H   -3.686600     -0.2032000       2.102300    
 H   -4.847700      -1.424200       1.691300    
 H   -4.608500     -7.2499998E-02  0.5762000    
 H    4.239100      -2.314300     -0.2516000    
 H    2.162700      -1.266700       3.345600    
 H   -2.161800      -2.847300      -1.843400    
 H   -1.833500      -3.722100     -0.3228000    
 H   -3.087400      -4.278200      -1.431400    
 H    3.977400      -2.490800       2.189400    


%chk=000017767-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000017767

0 1
N -3.256639 -1.336185 0.382321
N -1.911044 3.114807 -1.398298
C -0.510815 1.453315 0.171554
C 0.151723 2.385667 1.287569
C -1.606197 0.493906 0.785632
C 0.580595 0.686589 -0.636688
C -2.107445 -0.591427 -0.190859
C -0.898770 3.126572 2.148030
C 1.149922 3.392520 0.669077
C 1.450088 -0.313063 -0.033505
C -1.263262 2.362681 -0.735055
C 0.746012 0.978479 -1.999140
C 2.461094 -0.953088 -0.865461
C -3.321989 -2.756922 -0.053870
C 1.735135 0.344163 -2.807932
C 1.386687 -0.733806 1.342274
C 2.584141 -0.605829 -2.249690
C -4.539458 -0.628777 0.175976
C 3.337120 -1.939965 -0.301705
C 2.249975 -1.700802 1.862343
C -2.239578 -3.635127 0.601689
C 3.241962 -2.312955 1.037866
H 0.723067 1.709882 1.950534
H -1.224724 -0.001640 1.693498
H -2.461903 1.113136 1.107584
H -2.372595 -0.124311 -1.172363
H -1.287999 -1.302311 -0.391548
H -0.383732 3.778738 2.876788
H -1.547039 3.769297 1.524030
H -1.542052 2.434790 2.719014
H 0.631391 4.106263 0.001984
H 1.639576 3.974828 1.470501
H 1.937855 2.886132 0.085226
H 0.098607 1.725536 -2.469194
H -4.316604 -3.143075 0.240580
H -3.263335 -2.850435 -1.168600
H 1.816944 0.615817 -3.865555
H 0.641829 -0.302811 2.011666
H 3.352537 -1.101052 -2.854859
H -4.472796 0.403925 0.560865
H -5.343828 -1.142834 0.731948
H -4.840603 -0.567360 -0.900225
H 4.088438 -2.400587 -0.954418
H 2.163053 -1.993234 2.914574
H -1.218739 -3.303536 0.338532
H -2.336322 -3.598139 1.700866
H -2.344604 -4.685321 0.270790
H 3.915318 -3.068252 1.456853


