%chk=000049599.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049599

0 1
 N   -2.826400       1.566000     -0.8709000    
 C   -2.725600       1.556500      0.6020000    
 C   -1.568700      0.6500000       1.045900    
 C   -4.042300       1.172400       1.301800    
 C  -0.2664000       1.064100      0.3767000    
 C   0.8960000      0.1720000      0.8394000    
 C   -4.651300     -0.1123000      0.7483000    
 C   -3.425600      0.3364000      -1.410300    
 C   -4.760800     -4.6500001E-02 -0.7699000    
 C   0.6449000      -1.296600      0.5414000    
 C    2.247400      0.7585000      0.4422000    
 C   -3.516200       2.759900      -1.361000    
 C   0.7449000      -1.845200     -0.7468000    
 C    3.002900      0.4357000     -0.7025000    
 C    1.206700      -1.016900      -1.911400    
 C    2.661500     -0.6030000      -1.747800    
 C   0.2409000      -2.136500       1.599100    
 C    2.754600       1.754300       1.315400    
 C   0.4456000      -3.204500     -0.9506000    
 C    4.243800       1.088100     -0.9024000    
 C  -5.0799999E-02  -3.483800       1.386000    
 C    3.972200       2.393500       1.089500    
 C   5.0200000E-02  -4.018100      0.1087000    
 C    4.722400       2.055900     -2.2700001E-02
 H   -2.460900       2.567700      0.9426000    
 H   -1.810500     -0.3921000      0.8192000    
 H   -1.459100      0.7181000       2.135900    
 H   -4.768000       1.986700       1.181100    
 H   -3.880800       1.064400       2.381000    
 H  -5.5500001E-02   2.109500      0.6403000    
 H  -0.3583000       1.048500     -0.7109000    
 H   0.8968000      0.2321000       1.939500    
 H   -5.643200     -0.2719000       1.185900    
 H   -4.038500     -0.9739000       1.037300    
 H   -2.717200     -0.4909000      -1.277700    
 H   -3.552600      0.4243000      -2.496700    
 H   -5.087200      -1.019000      -1.155800    
 H   -5.534400      0.6779000      -1.051400    
 H   -3.510400       2.783100      -2.456600    
 H   -2.993000       3.665200      -1.033000    
 H   -4.555400       2.826200      -1.024300    
 H    1.126100      -1.611400      -2.831300    
 H   0.5543000     -0.1569000      -2.075600    
 H    2.979800     -0.2105000      -2.723800    
 H    3.278700      -1.490200      -1.550400    
 H   0.1419000      -1.742000       2.608200    
 H    2.187000       2.043100       2.199100    
 H   0.5266000      -3.642200      -1.943000    
 H    4.854700      0.8361000      -1.768100    
 H  -0.3603000      -4.110800       2.216800    
 H    4.328700       3.148600       1.783200    
 H  -0.1761000      -5.065900     -6.4400002E-02
 H    5.675800       2.540100     -0.2096000    


%chk=000049599-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000049599

0 1
N -2.765139 1.507111 -0.903047
C -2.743482 1.581263 0.592715
C -1.590731 0.718334 1.176347
C -4.125115 1.205160 1.217018
C -0.212520 1.125238 0.618049
C 0.956960 0.146955 1.002967
C -4.639238 -0.163454 0.702623
C -3.272231 0.203913 -1.408865
C -4.666487 -0.188800 -0.845712
C 0.653771 -1.308850 0.637894
C 2.298642 0.733609 0.524523
C -3.382265 2.681666 -1.551391
C 0.583870 -1.773820 -0.708011
C 2.929317 0.507086 -0.737463
C 0.971921 -0.873997 -1.868802
C 2.466495 -0.472660 -1.820658
C 0.364484 -2.219061 1.686185
C 2.917726 1.639773 1.432171
C 0.213866 -3.119179 -0.956948
C 4.135846 1.205813 -1.026457
C 0.001920 -3.560488 1.430710
C 4.113777 2.319824 1.133410
C -0.081298 -4.013998 0.096142
C 4.732087 2.100923 -0.117964
H -2.522648 2.639391 0.845156
H -1.773517 -0.351583 0.967917
H -1.605395 0.825817 2.280956
H -4.865877 1.988210 0.955199
H -4.044590 1.197976 2.322109
H 0.060738 2.131809 0.994874
H -0.303952 1.224022 -0.477002
H 1.002651 0.171161 2.111485
H -5.648374 -0.365101 1.110722
H -3.981756 -0.976745 1.070647
H -2.542183 -0.585511 -1.139178
H -3.297611 0.252489 -2.514153
H -4.947838 -1.194834 -1.214222
H -5.435573 0.519593 -1.215465
H -3.262506 2.596772 -2.647458
H -2.855813 3.597438 -1.225318
H -4.471194 2.824956 -1.343035
H 0.795371 -1.416830 -2.816739
H 0.345133 0.035368 -1.907188
H 2.739831 -0.038340 -2.802445
H 3.062292 -1.404380 -1.722995
H 0.422716 -1.866456 2.723766
H 2.437870 1.808665 2.405071
H 0.163188 -3.469595 -1.995660
H 4.616373 1.032792 -1.998450
H -0.213672 -4.239803 2.263112
H 4.556828 3.005910 1.863874
H -0.365634 -5.049529 -0.122526
H 5.661862 2.617779 -0.380889


