%chk=000042744.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042744

0 1
 N   4.2500000E-02  -1.032300      1.5000000E-03
 C    1.725600      0.6802000      3.9999999E-04
 C  -0.6336000       1.263600      6.9999998E-04
 C   0.7133000       1.642500      6.0000003E-04
 C  -0.9458000     -0.1081000      1.0000000E-03
 C    1.338800     -0.6670000      1.2000001E-03
 C   -2.306400     -0.4876000      5.0000002E-04
 C    3.086900       1.032300     -1.9999999E-04
 C    4.068200      4.5600001E-02 -6.0000003E-04
 C   -3.328900      0.4963000     -9.9999997E-05
 C    3.692800      -1.291600      1.9999999E-04
 C    2.338800      -1.635800      1.2000001E-03
 C   -1.647200       2.229700      5.0000002E-04
 C    1.081100       3.100900     -1.1000000E-03
 C   -2.983600       1.849000       0.000000    
 C   -2.701400      -1.842700      3.0000001E-04
 C   -4.679500      0.1095000     -1.1000000E-03
 C    5.506500      0.4443000     -1.3000000E-03
 C    4.716400      -2.379200     -1.4000000E-03
 C   -4.048100      -2.212600     -6.9999998E-04
 C   -5.036300      -1.237000     -1.6000000E-03
 H    3.422900       2.062900      2.8899999E-02
 H    2.050700      -2.686300      1.3000000E-03
 H   -1.460600       3.297600      3.0200001E-02
 H    2.019800       3.314400     -0.5178000    
 H   0.3776000       3.717700     -0.5670000    
 H    1.144800       3.476800       1.024900    
 H   -3.750500       2.620600      5.9000002E-03
 H   -1.958600      -2.638500      8.9999998E-04
 H   -5.469500      0.8580000     -1.7000000E-03
 H    6.009500      7.2800003E-02  0.8975000    
 H    6.014400      5.4499999E-02 -0.8895000    
 H    5.629300       1.533000     -1.3000000E-02
 H    4.254600      -3.372700      8.1000002E-03
 H    5.338800      -2.321100     -0.9003000    
 H    5.352700      -2.311500      0.8870000    
 H   -4.321300      -3.263800     -8.9999998E-04
 H   -6.084100      -1.522200     -2.3000001E-03


%chk=000042744-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000042744

0 1
N 0.011629 -1.018033 -0.024696
C 1.739233 0.770747 -0.022514
C -0.641933 1.369486 -0.013460
C 0.722980 1.782321 -0.037202
C -0.949775 -0.056407 -0.015037
C 1.327617 -0.624657 -0.021363
C -2.351482 -0.497071 -0.005903
C 3.150044 1.045790 -0.001789
C 4.114164 0.035370 0.009565
C -3.403527 0.480753 0.018716
C 3.694383 -1.354779 -0.002023
C 2.331260 -1.648789 -0.015858
C -1.746955 2.310458 0.020352
C 1.094287 3.254360 -0.056801
C -3.060654 1.888252 0.036807
C -2.688929 -1.880500 -0.020258
C -4.762985 0.046255 0.027860
C 5.590818 0.383893 0.035377
C 4.726314 -2.466368 0.003106
C -4.031967 -2.288630 -0.011868
C -5.076799 -1.320693 0.012367
H 3.493648 2.085686 0.016835
H 1.976869 -2.684802 -0.020728
H -1.533391 3.383218 0.046635
H 2.066376 3.423331 -0.546354
H 0.349678 3.857760 -0.600078
H 1.165748 3.661280 0.971266
H -3.874867 2.622480 0.065620
H -1.868861 -2.603793 -0.038224
H -5.561172 0.798033 0.047170
H 6.091695 -0.029949 0.931906
H 6.122771 -0.030539 -0.842715
H 5.743413 1.476213 0.037773
H 4.242753 -3.457141 -0.000908
H 5.390503 -2.408870 -0.880939
H 5.380629 -2.410811 0.894492
H -4.279790 -3.355784 -0.024002
H -6.123126 -1.645868 0.019072


