%chk=000063395.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063395

0 1
 O  -0.3129000      -2.037700     -0.2002000    
 N   0.1458000      0.2554000      8.3499998E-02
 N   -1.674100       1.770400      0.3150000    
 C    1.559300      4.6200000E-02 -7.0699997E-02
 C    2.150600      0.1187000      -1.326700    
 C  -0.4001000       1.526700      0.2762000    
 C  -0.6845000     -0.8815000     -1.2400000E-02
 C   -2.136700     -0.6160000      6.0899999E-02
 C    2.323400     -0.2289000       1.057700    
 C   -2.569700      0.7029000      0.1969000    
 C    3.696900     -0.4343000      0.9284000    
 C    3.524200     -8.6700000E-02  -1.456300    
 C    4.297300     -0.3632000     -0.3288000    
 C    1.347200      0.4130000      -2.551900    
 C   0.5062000       2.716900      0.5164000    
 C   -3.059100      -1.665100     -3.0200001E-02
 C   -3.944200      0.9636000      0.2415000    
 C    4.524200     -0.7301000       2.133600    
 C   -4.425400      -1.391900      1.6200000E-02
 C   -4.868400     -7.8299999E-02  0.1509000    
 H    1.853100     -0.2854000       2.036700    
 H    4.008200     -3.5500001E-02  -2.428000    
 H    5.366200     -0.5232000     -0.4429000    
 H    1.971200      0.4302000      -3.452200    
 H   0.5820000     -0.3549000      -2.704500    
 H   0.8665000       1.393300      -2.474000    
 H    1.173500       2.858400     -0.3376000    
 H    1.108600       2.545300       1.412700    
 H  -8.0700003E-02   3.629300      0.6565000    
 H   -2.734700      -2.696200     -0.1397000    
 H   -4.304300       1.983900      0.3515000    
 H    5.552000     -0.3739000       2.005800    
 H    4.120400     -0.2307000       3.020900    
 H    4.547600      -1.808800       2.317400    
 H   -5.144200      -2.203000     -5.4200001E-02
 H   -5.932600      0.1355000      0.1872000    


%chk=000063395-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063395

0 1
O -0.239230 -1.978220 -0.592828
N 0.119873 0.270110 -0.000050
N -1.692338 1.782402 0.498211
C 1.560751 0.061119 -0.123051
C 2.166908 0.071461 -1.406399
C -0.397929 1.542470 0.341063
C -0.731052 -0.865586 -0.245824
C -2.166912 -0.593901 -0.052377
C 2.310068 -0.153990 1.051611
C -2.597929 0.720109 0.317502
C 3.710679 -0.354074 0.995403
C 3.569430 -0.120947 -1.452966
C 4.328879 -0.324353 -0.280063
C 1.349965 0.252160 -2.669599
C 0.579969 2.678941 0.521236
C -3.116072 -1.633651 -0.234386
C -3.986815 0.967603 0.502734
C 4.513403 -0.625350 2.255561
C -4.483748 -1.375362 -0.047069
C -4.916601 -0.069683 0.322962
H 1.788855 -0.180828 2.016001
H 4.071243 -0.114687 -2.427746
H 5.413417 -0.468945 -0.356283
H 2.003636 0.356666 -3.551787
H 0.694267 -0.623806 -2.830203
H 0.696054 1.142899 -2.619498
H 1.237690 2.794078 -0.358787
H 1.238628 2.516909 1.392920
H 0.000949 3.600603 0.674841
H -2.749045 -2.625277 -0.518738
H -4.296039 1.978592 0.784467
H 5.561363 -0.295304 2.146632
H 4.082419 -0.111200 3.132728
H 4.531482 -1.708021 2.486932
H -5.218615 -2.175511 -0.184951
H -5.984802 0.126974 0.467402


