%chk=000052682.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052682

0 1
 N   0.5462000      0.7213000      0.6042000    
 N    3.654600       1.512000     -0.2343000    
 C    2.552000       1.349800      0.6787000    
 C    1.839400     -9.9999997E-05  0.5150000    
 C    1.243300       1.946000      0.1411000    
 C  -0.3936000      0.2376000     -0.4150000    
 C   -1.726100      0.9737000     -0.3309000    
 C  -0.4842000      -1.278400     -0.4384000    
 C    4.648300      0.4681000     -3.2000002E-02
 C   -2.803500      0.6395000      0.5165000    
 C   -1.029300      -2.008100      0.6325000    
 C   -2.885100     -0.5468000       1.455200    
 C   -1.611600      -1.298500       1.823500    
 C   -1.850200       2.120100      -1.153500    
 C   1.9800000E-02  -1.979900      -1.549000    
 C   -3.967500       1.443200      0.4787000    
 C   -1.059700      -3.411100      0.5747000    
 C    5.159800      0.4948000       1.402500    
 C    5.791300      0.6176000      -1.028500    
 C   -3.003900       2.901700      -1.164500    
 C  -1.6600000E-02  -3.373600      -1.596000    
 C   -4.068100       2.560300     -0.3474000    
 C  -0.5551000      -4.089300     -0.5331000    
 H    2.744200       1.642300       1.718900    
 H    2.042900     -0.4993000     -0.4406000    
 H    2.014000     -0.7149000       1.326100    
 H   0.9185000       2.863600      0.6432000    
 H    1.245600       2.135500     -0.9407000    
 H   8.6000003E-03  0.4841000      -1.410100    
 H    4.093400       2.430900     -0.1863000    
 H    4.221900     -0.5230000     -0.2239000    
 H   -3.319100     -0.1905000       2.399800    
 H   -3.606000      -1.255900       1.024800    
 H   -1.859100      -2.033600       2.600500    
 H  -0.8720000     -0.6357000       2.283800    
 H   -1.034800       2.414900      -1.811500    
 H   0.4522000      -1.445200      -2.391700    
 H   -4.818900       1.192300       1.109700    
 H   -1.484700      -3.986400       1.393700    
 H    6.005700     -0.1930000       1.517500    
 H    5.513500       1.492300       1.688100    
 H    4.403800      0.1756000       2.126900    
 H    5.421000      0.5762000      -2.059000    
 H    6.522700     -0.1887000     -0.9065000    
 H    6.317500       1.569800     -0.8963000    
 H   -3.067100       3.771000      -1.811800    
 H   0.3777000      -3.898000      -2.461300    
 H   -4.974600       3.157500     -0.3494000    
 H  -0.5853000      -5.174300     -0.5666000    


%chk=000052682-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052682

0 1
N 0.582366 0.270340 0.416647
N 3.706331 1.510246 -0.045597
C 2.571831 1.013276 0.741308
C 1.955572 -0.349528 0.272674
C 1.189179 1.655615 0.397010
C -0.444200 -0.067281 -0.614943
C -1.667701 0.852545 -0.466499
C -0.754704 -1.565144 -0.582749
C 5.007920 0.813907 0.147782
C -2.679588 0.718986 0.533432
C -1.276377 -2.186268 0.588902
C -2.798577 -0.398620 1.577600
C -1.597560 -1.347080 1.811651
C -1.762473 1.924215 -1.396318
C -0.499181 -2.349483 -1.731478
C -3.728225 1.680317 0.557472
C -1.518140 -3.580932 0.573729
C 5.614209 0.969971 1.571185
C 5.995102 1.307250 -0.929550
C -2.811096 2.864929 -1.359887
C -0.752365 -3.740336 -1.740366
C -3.805841 2.742193 -0.364566
C -1.261159 -4.360379 -0.578130
H 2.741368 1.006759 1.841453
H 2.236265 -0.554207 -0.784400
H 2.115443 -1.248681 0.890749
H 0.739359 2.363514 1.112680
H 1.221545 2.107865 -0.619299
H -0.016833 0.147160 -1.628318
H 3.812257 2.532778 0.039127
H 4.811129 -0.263494 -0.027395
H -3.052894 0.076291 2.546490
H -3.679925 -1.015883 1.302545
H -1.845107 -2.009179 2.662932
H -0.713306 -0.740600 2.078766
H -0.989794 2.012839 -2.170400
H -0.098201 -1.864562 -2.630402
H -4.507496 1.580487 1.324574
H -1.916093 -4.060063 1.477047
H 6.534754 0.365821 1.676111
H 5.876684 2.028032 1.766431
H 4.905329 0.641151 2.352987
H 5.576697 1.144068 -1.937477
H 6.963070 0.779682 -0.852974
H 6.192495 2.391210 -0.810587
H -2.851124 3.677208 -2.093876
H -0.550784 -4.330970 -2.640992
H -4.631898 3.460263 -0.310309
H -1.456463 -5.438827 -0.567475


