%chk=000053050.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053050

0 1
 O   0.8311000       2.881200      0.8000000    
 N   9.3199998E-02  0.7436000      0.1254000    
 N  -0.5201000       2.547600      -1.082300    
 C  -0.7885000      0.2112000     -0.9103000    
 C   -1.042100       1.421900      -1.818700    
 C   -2.068600     -0.2957000     -0.3332000    
 C   0.7657000     -7.2300002E-02   1.116500    
 C   0.2113000       2.142300      4.6000000E-02
 C    2.102000     -0.4904000      0.5793000    
 C   -2.531300      0.2067000      0.8822000    
 C   -2.799900      -1.270500      -1.010600    
 C    2.214800      -1.673200     -0.1437000    
 C    3.217600      0.3083000      0.8080000    
 C   -3.727400     -0.2666000       1.421500    
 C   -3.996200      -1.743700     -0.4713000    
 C   -4.459900      -1.241600      0.7448000    
 C    3.457600      -2.062100     -0.6436000    
 C    4.460300     -8.0700003E-02  0.3079000    
 C    4.580200      -1.265900     -0.4178000    
 H  -0.2608000     -0.5820000      -1.451200    
 H  -0.4595000       1.347200      -2.743100    
 H   -2.090600       1.604300      -2.072400    
 H   0.1498000     -0.9409000       1.372900    
 H   0.8976000      0.5153000       2.032800    
 H  -0.5934000       3.512800      -1.387900    
 H   -2.006700      0.9799000       1.435000    
 H   -2.449200      -1.667900      -1.959300    
 H    1.347700      -2.302500     -0.3245000    
 H    3.138800       1.232500       1.373400    
 H   -4.091300      0.1273000       2.366100    
 H   -4.567000      -2.502500     -0.9985000    
 H   -5.392000      -1.609200       1.164000    
 H    3.551100      -2.985100      -1.208400    
 H    5.334800      0.5389000      0.4840000    
 H    5.548000      -1.568700     -0.8070000    


%chk=000053050-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000053050

0 1
O 1.235455 3.280495 0.910494
N 0.046424 1.272344 0.411059
N -0.228463 3.040310 -0.956212
C -0.715491 0.732516 -0.740467
C -1.205365 2.051977 -1.439242
C -1.849916 -0.203688 -0.342470
C 0.786893 0.406340 1.343309
C 0.436038 2.609024 0.198167
C 1.902415 -0.393864 0.669553
C -2.727597 0.134537 0.719147
C -2.054073 -1.416336 -1.043437
C 1.773787 -1.788755 0.457227
C 3.081154 0.264230 0.228851
C -3.795283 -0.720918 1.065458
C -3.127605 -2.271986 -0.704033
C -4.001724 -1.925859 0.351419
C 2.803799 -2.518734 -0.181442
C 4.109637 -0.462306 -0.409854
C 3.974607 -1.856685 -0.616309
H -0.027823 0.188947 -1.424172
H -1.192387 1.950086 -2.537541
H -2.238220 2.294455 -1.116567
H 0.069805 -0.273922 1.838274
H 1.206163 1.084907 2.108261
H -0.245411 4.028233 -1.198903
H -2.556119 1.061856 1.279291
H -1.367943 -1.692990 -1.854227
H 0.866181 -2.304786 0.796491
H 3.183126 1.343846 0.394134
H -4.464814 -0.453202 1.890669
H -3.276902 -3.206580 -1.256222
H -4.831240 -2.589705 0.619503
H 2.694441 -3.598337 -0.335968
H 5.018012 0.054421 -0.740016
H 4.775539 -2.420370 -1.108228


