%chk=000049627.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049627

0 1
 N    1.419500      -1.051800     -0.6940000    
 C    1.029500       1.240300      0.1621000    
 C    1.371800     -0.2327000      0.5213000    
 C  -0.3629000       1.396500     -0.4941000    
 C    2.127900       1.853800     -0.7199000    
 C    2.686800     -0.4128000       1.281000    
 C   -1.479500      0.8839000      0.3769000    
 C   -2.414500     -3.6600001E-02  7.3700003E-02
 C    1.605000      -2.453600     -0.3590000    
 C   -3.477200     -0.4003000       1.076700    
 C   -2.506400     -0.7867000      -1.224800    
 H    1.018000       1.811900       1.101200    
 H   0.5747000     -0.6045000       1.178300    
 H  -0.3654000      0.9545000      -1.492900    
 H  -0.5480000       2.467300     -0.6534000    
 H    3.102700       1.835900     -0.2234000    
 H    1.896400       2.903400     -0.9333000    
 H    2.218600       1.337300      -1.680800    
 H    2.745700      -1.386700       1.778700    
 H    3.562700     -0.3073000      0.6312000    
 H    2.771500      0.3420000       2.071200    
 H   0.5426000     -0.9576000      -1.203500    
 H   -1.528900       1.355500       1.358000    
 H    1.444100      -3.054400      -1.260900    
 H   0.8873000      -2.802600      0.3911000    
 H    2.624200      -2.674700     -2.8600000E-02
 H   -3.377700      0.1588000       2.012900    
 H   -4.471200     -0.1896000      0.6686000    
 H   -3.419500      -1.466500       1.319700    
 H   -3.482400     -0.6115000      -1.689800    
 H   -1.746800     -0.5045000      -1.955200    
 H   -2.400700      -1.861700      -1.043700    


%chk=000049627-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000049627

0 1
N 1.428430 -1.118835 -0.608173
C 1.075961 1.235376 0.164527
C 1.415710 -0.229906 0.583844
C -0.343336 1.363783 -0.479135
C 2.139858 1.857023 -0.770085
C 2.762880 -0.310729 1.335030
C -1.461970 0.825812 0.390037
C -2.462337 -0.039501 0.052886
C 1.624741 -2.556031 -0.327949
C -3.510105 -0.456079 1.074467
C -2.644603 -0.660807 -1.321955
H 1.052379 1.819519 1.110301
H 0.613734 -0.549589 1.300479
H -0.343630 0.893943 -1.481853
H -0.516672 2.445942 -0.662927
H 3.121025 1.944493 -0.270954
H 1.835407 2.871598 -1.090435
H 2.275213 1.228957 -1.668482
H 2.897422 -1.291948 1.824577
H 3.606644 -0.156746 0.639574
H 2.808256 0.463081 2.123800
H 0.572979 -0.976348 -1.161986
H -1.454806 1.207192 1.424601
H 1.466072 -3.133016 -1.256839
H 0.940065 -2.965363 0.456528
H 2.661276 -2.745921 0.002519
H -3.332799 0.012659 2.058093
H -4.528646 -0.175442 0.738801
H -3.515801 -1.555969 1.213658
H -3.637273 -0.396959 -1.738237
H -1.883036 -0.337922 -2.050853
H -2.615140 -1.767266 -1.258559


