%chk=000177894.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177894

0 1
 N    2.040300     -0.2698000     -3.5999999E-03
 N   -3.183600       1.460800      2.7000001E-03
 N   -3.873100     -0.8519000     -1.4000000E-03
 N   -2.318500      -2.584800     -3.7000000E-03
 N   -5.455600      0.8754000      4.9999999E-03
 C    3.311800      0.4241000      3.3000000E-03
 C   0.8088000      0.3444000     -2.4999999E-03
 C    3.518400       1.288600      -1.260000    
 C    3.512900       1.272800       1.278100    
 C    1.888800      -1.629600     -6.3999998E-03
 C  -0.1588000     -0.6611000     -3.8999999E-03
 C   0.5407000      -1.903900     -6.3000000E-03
 C   -1.528100     -0.2706000     -2.0999999E-03
 C   0.4790000       1.701100      3.0000001E-04
 C    3.416700      0.4925000      -2.555200    
 C    3.405800      0.4606000       2.562900    
 C    3.041900      -2.553400     -7.6000001E-03
 C   -1.892400       1.088200      6.0000003E-04
 C  -0.8803000       2.041800      1.7000000E-03
 C   -2.572500      -1.197300     -3.1999999E-03
 C   -4.102200      0.4721000      1.3000000E-03
 H    4.111600     -0.3240000      1.9999999E-04
 H    4.522500       1.730500      -1.215400    
 H    2.827400       2.132900      -1.311400    
 H    2.820300       2.115500       1.336500    
 H    4.516700       1.716100       1.243400    
 H   0.1555000      -2.911400      1.3000000E-02
 H    1.212100       2.496500      2.7999999E-03
 H    3.670600       1.131300      -3.407400    
 H    2.404200      0.1118000      -2.718200    
 H    4.110600     -0.3540000      -2.551800    
 H    4.100400     -0.3852000       2.552400    
 H    2.392700      7.7200003E-02   2.716600    
 H    3.655100       1.089100       3.424100    
 H    2.702400      -3.595100     -1.1900000E-02
 H    3.662900      -2.412500     -0.8979000    
 H    3.659800      -2.418800      0.8858000    
 H   -1.143200       3.099100      4.3000001E-03
 H   -3.145700      -3.164400      9.2000000E-02
 H   -1.661700      -2.919900     -0.6972000    
 H   -6.183100      0.1739000      4.1999999E-03
 H   -5.680400       1.860700      7.1000000E-03


%chk=000177894-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177894

0 1
N 2.072927 -0.226911 -0.004973
N -3.273570 1.494046 0.050703
N -3.995097 -0.841967 -0.065351
N -2.524733 -2.615099 -0.283276
N -5.538464 0.901275 0.137845
C 3.378571 0.483626 -0.004740
C 0.792315 0.364665 -0.022031
C 3.594454 1.310141 -1.302676
C 3.589867 1.321532 1.286901
C 1.916125 -1.623737 0.019770
C -0.190586 -0.683400 -0.021931
C 0.548821 -1.925298 0.011331
C -1.587197 -0.332970 -0.038724
C 0.424721 1.739801 -0.015081
C 3.521163 0.459667 -2.587638
C 3.504599 0.485030 2.580254
C 3.073109 -2.582663 0.061062
C -1.954405 1.064992 0.007497
C -0.929105 2.072770 0.009697
C -2.704391 -1.255731 -0.122823
C -4.214771 0.518002 0.043837
H 4.146360 -0.314159 -0.000302
H 4.589604 1.791259 -1.225819
H 2.854194 2.129500 -1.359762
H 2.852802 2.144486 1.331109
H 4.587531 1.797711 1.211515
H 0.178122 -2.946397 0.086973
H 1.175914 2.534270 -0.017785
H 3.681761 1.084884 -3.484237
H 2.533399 -0.024756 -2.684902
H 4.293287 -0.333624 -2.588329
H 4.275322 -0.309506 2.596446
H 2.515153 0.003533 2.675094
H 3.659144 1.119808 3.471154
H 2.687486 -3.615089 0.088026
H 3.726998 -2.496546 -0.828376
H 3.708150 -2.441818 0.956780
H -1.258374 3.115368 0.031685
H -3.364070 -3.185784 -0.365256
H -1.615403 -3.012437 -0.488778
H -6.263156 0.190623 0.117435
H -5.757879 1.890202 0.208878


